X5MBH3_CAEEL Loading...

UBA domain-containing protein

AlphaFold DB , UniProt , Accession X5MBH3, Species CAEEL (Caenorhabditis elegans), Gene spe-48, Length 312 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
1M38.1Very low52.2Low232 Ų232149 Ų149100%1.14374%0.741SS**  0130.40-75176.6166.400107.1
2S40.2Very low52.5Low106 Ų106149.3 Ų149.374%0.74174%0.735SS**  trans-98.1119.9177-169.50000108.4
3F48.4Very low52.8Low182 Ų182149.5 Ų149.580%0.79874%0.741SS**  trans-84.8113.9166.2-72.5-85.5000107.2D5F3-D5 PolarHBondContact O-N 3.27Å
4N50.3Low53.3Low133 Ų133148.5 Ų148.571%0.71174%0.737SS**  trans-78106.1169.5-69.8-13.2000107.3V6N4-V6 HydrophobicContact CB-CG2 4.17Å; N4-V6 PolarHBondContact O-N 3.18Å
5D53.5Low53.7Low147 Ų147146.1 Ų146.179%0.78674%0.737SS**  trans-68.577.2166-87.5-33.2000109.5F3 F7F3-D5 PolarHBondContact O-N 3.27Å; D5-F7 VanDerWaalsContact C-N 3.33Å; D5-F7 PolarHBondContact O-N 3.31Å; D5-F7 VanDerWaalsContact O-N 3.09Å
6V59.8Low54.2Low99 Ų99146.3 Ų146.360%0.674%0.737SS**  trans-75.294.1164.8-177.20000106.3N4 H8N4-V6 HydrophobicContact CB-CG2 4.17Å; N4-V6 PolarHBondContact O-N 3.18Å; V6-H8 PolarHBondContact O-N 3.27Å
7F57.3Low54.7Low187 Ų187146.6 Ų146.682%0.8274%0.741SS**  trans-52.9106.1167.1-88-99.5000108.8D5 D9D5-F7 VanDerWaalsContact C-N 3.33Å; D5-F7 PolarHBondContact O-N 3.31Å; D5-F7 VanDerWaalsContact O-N 3.09Å; F7-D9 PolarHBondContact O-N 3.37Å
8H56.7Low55.2Low126 Ų126145.3 Ų145.358%0.58374%0.735SS**  trans-71.299.6169.1-70.1-27.8000107.9V6 Y10V6-H8 PolarHBondContact O-N 3.27Å; H8-Y10 HydrophobicContact CB-CD1 4.45Å; H8-Y10 HydrophobicContact CB-CE1 3.99Å; H8-Y10 HydrophobicContact CB-CE2 4.12Å; H8-Y10 WeakPolarHBondContact O-CD2 3.49Å; H8-Y10 WeakPolarHBondContact O-CE2 3.49Å; H8-Y10 PolarHBondContact O-N 3.37Å
9D56.4Low55.6Low84 Ų84144.1 Ų144.145%0.44974%0.741SS.*  trans-70.875.6176.6-16913.4000109F7 I11 K12F7-D9 PolarHBondContact O-N 3.37Å; D9-I11 PolarHBondContact O-N 3.45Å; D9-K12 PolarHBondContact O-N 3.17Å; D9-K12 VanDerWaalsContact O-N 3.1Å; D9-K12 WeakPolarHBondContact OD2-CD 3.49Å; D9-K12 WeakPolarHBondContact OD2-CE 3.32Å; D9-K12 IonicContact OD2-NZ 2.75Å; D9-K12 PolarHBondContact OD2-NZ 3.14Å
10Y55.7Low56Low200 Ų200147.5 Ų147.578%0.78474%0.744SS**THydrogen-bonded Turntrans-57.4-3-171.9-64.7-73.8000115.1H8H8-Y10 HydrophobicContact CB-CD1 4.45Å; H8-Y10 HydrophobicContact CB-CE1 3.99Å; H8-Y10 HydrophobicContact CB-CE2 4.12Å; H8-Y10 WeakPolarHBondContact O-CD2 3.49Å; H8-Y10 WeakPolarHBondContact O-CE2 3.49Å; H8-Y10 PolarHBondContact O-N 3.37Å
11I57.5Low56.5Low143 Ų143148.4 Ų148.473%0.73374%0.743SS**THydrogen-bonded Turntrans-82.4-19.2178.2-60.8176.2000111.7D9D9-I11 PolarHBondContact O-N 3.45Å
12K56Low57.6Low153 Ų153145.8 Ų145.867%0.66573%0.726SS**THydrogen-bonded Turntrans-81.9-23.1-167.2-80-177.9176.3145.90117.5D9D9-K12 PolarHBondContact O-N 3.17Å; D9-K12 VanDerWaalsContact O-N 3.1Å; D9-K12 WeakPolarHBondContact OD2-CD 3.49Å; D9-K12 WeakPolarHBondContact OD2-CE 3.32Å; D9-K12 IonicContact OD2-NZ 2.75Å; D9-K12 PolarHBondContact OD2-NZ 3.14Å
13D56.8Low58.9Low152 Ų152149.1 Ų149.181%0.81372%0.723SS**THydrogen-bonded Turntrans-122.752.2-174.6-67.5-49.6000113P15D13-P15 WeakPolarHBondContact O-CD 3.38Å
14I59.6Low59.9Low135 Ų135145.2 Ų145.269%0.69272%0.716SS**  trans-92.2101.3158.3-58178.5000107.6M16I14-M16 PolarHBondContact O-N 2.61Å
15P59.8Low60.8Low113 Ų113145 Ų14573%0.73472%0.72SS**  trans-65.9103.2172.427.1-33.5000109.2D13 D17D13-P15 WeakPolarHBondContact O-CD 3.38Å; P15-D17 PolarHBondContact O-N 3Å
16M60.3Low61.6Low149 Ų149149.1 Ų149.173%0.73472%0.724SS**  trans-82.293.2178.4-170.9175.36300109.2I14 I18I14-M16 PolarHBondContact O-N 2.61Å; M16-I18 HydrophobicContact CE-CD1 4.03Å; M16-I18 HydrophobicContact CE-CG1 4.08Å; M16-I18 HydrophobicContact CG-CG1 4.49Å; M16-I18 WeakPolarHBondContact O-CG1 3.24Å; M16-I18 PolarHBondContact O-N 3.29Å
17D63.4Low62.3Low151 Ų151152.4 Ų152.481%0.80774%0.739SS**  trans-66.292.3175.3-90.4-27.6000111P15 S19P15-D17 PolarHBondContact O-N 3Å; D17-S19 PolarHBondContact O-N 3.14Å
18I64.3Low63.1Low124 Ų124150.5 Ų150.564%0.63674%0.736SS**  trans-72.380.1175.4-50176.6000108.8M16 R20M16-I18 HydrophobicContact CE-CD1 4.03Å; M16-I18 HydrophobicContact CE-CG1 4.08Å; M16-I18 HydrophobicContact CG-CG1 4.49Å; M16-I18 WeakPolarHBondContact O-CG1 3.24Å; M16-I18 PolarHBondContact O-N 3.29Å; I18-R20 WeakPolarHBondContact CG2-O 3.33Å; I18-R20 PolarHBondContact O-N 3.49Å
19S62.2Low63.6Low121 Ų121152.3 Ų152.385%0.84675%0.749SS**  trans-64.62.8-174.7640000115.8D17D17-S19 PolarHBondContact O-N 3.14Å
20R63.9Low64.3Low212 Ų212153.1 Ų153.180%0.876%0.758SS**SBendtrans-130.3122.6171.2-77.8-175.6165.2-151.2-3.7110.3I18 F22I18-R20 WeakPolarHBondContact CG2-O 3.33Å; I18-R20 PolarHBondContact O-N 3.49Å; R20-F22 PolarHBondContact O-N 2.97Å
21K66.4Low65.2Low167 Ų167150.9 Ų150.973%0.72676%0.759SS**  trans-51.1110.1165.4-66.4177.8-178.4178.80108.4Y23K21-Y23 HydrophobicContact CB-CD2 4.1Å; K21-Y23 HydrophobicContact CB-CE2 3.53Å; K21-Y23 HydrophobicContact CD-CE2 4.27Å; K21-Y23 WeakPolarHBondContact CD-OH 3.25Å; K21-Y23 VanDerWaalsContact O-CD2 3.22Å; K21-Y23 WeakPolarHBondContact O-CD2 3.38Å; K21-Y23 PolarHBondContact O-N 3.48Å
22F61.5Low65.8Low177 Ų177154.4 Ų154.478%0.77677%0.769SS**  trans-71.696.2176.3-176.4-93.2000108.1R20 P24R20-F22 PolarHBondContact O-N 2.97Å; F22-P24 HydrophobicContact CE1-CB 4.22Å; F22-P24 VanDerWaalsContact O-CD 3.26Å; F22-P24 WeakPolarHBondContact O-CD 3.42Å
23Y66.8Low66.6Low176 Ų176153.7 Ų153.769%0.6977%0.772SS**  trans-84109.1169-66.6-77.4000107.5K21 T25K21-Y23 HydrophobicContact CB-CD2 4.1Å; K21-Y23 HydrophobicContact CB-CE2 3.53Å; K21-Y23 HydrophobicContact CD-CE2 4.27Å; K21-Y23 WeakPolarHBondContact CD-OH 3.25Å; K21-Y23 VanDerWaalsContact O-CD2 3.22Å; K21-Y23 WeakPolarHBondContact O-CD2 3.38Å; K21-Y23 PolarHBondContact O-N 3.48Å; Y23-T25 PolarHBondContact O-N 2.99Å
24P69.3Low67.1Low101 Ų101155.3 Ų155.366%0.65677%0.774SS**PPolyproline II helixtrans-57.7131.7172.924-32.5000108.7F22F22-P24 HydrophobicContact CE1-CB 4.22Å; F22-P24 VanDerWaalsContact O-CD 3.26Å; F22-P24 WeakPolarHBondContact O-CD 3.42Å
25T70Confident67.8Low129 Ų129155.4 Ų155.479%0.79178%0.775SS**PPolyproline II helixtrans-58.5140.4177.344.80000109.7Y23 N27Y23-T25 PolarHBondContact O-N 2.99Å; T25-N27 PolarHBondContact O-N 3.49Å
26R68.9Low68.4Low232 Ų232154.6 Ų154.688%0.87577%0.77SS**PPolyproline II helixtrans-51.3134.8-179.9-65.9-179.4178.9175.5-0.8110.1I28R26-I28 PolarHBondContact O-N 3.21Å
27N75.1Confident68.8Low168 Ų168152.8 Ų152.890%0.89876%0.763SS**  trans-59.5109.6173.1-69-28.1000109.1T25 N29T25-N27 PolarHBondContact O-N 3.49Å; N27-N29 PolarHBondContact O-N 3.46Å
28I73.4Confident68.7Low148 Ų148150.9 Ų150.976%0.75975%0.752SS**  trans-83.7111172.5-59.7173.1000106R26 V30R26-I28 PolarHBondContact O-N 3.21Å; I28-V30 HydrophobicContact CG2-CG1 4.18Å; I28-V30 PolarHBondContact O-N 3.44Å; I28-V30 VanDerWaalsContact O-N 3.17Å
29N67.8Low68.7Low163 Ų163154 Ų15487%0.87276%0.756SS**  trans-74.8105.7172.4-145.712000107N27N27-N29 PolarHBondContact O-N 3.46Å
30V72.1Confident68.6Low102 Ų102154.8 Ų154.862%0.61874%0.744SS**  trans-85134.2174.7-69.70000108.7I28I28-V30 HydrophobicContact CG2-CG1 4.18Å; I28-V30 PolarHBondContact O-N 3.44Å; I28-V30 VanDerWaalsContact O-N 3.17Å
31D74.7Confident68.3Low153 Ų153151.1 Ų151.182%0.81875%0.745SS**  trans-57.3153.3173.8-68.5-48.4000110.7I33D31-I33 PolarHBondContact O-N 3.49Å
32F68.6Low67.9Low216 Ų216152 Ų15295%0.94775%0.75SS**  trans-57.497.8-178.5-80.9-89.4000111.3Q34F32-Q34 PolarHBondContact O-N 2.61Å
33I72.6Confident67.7Low139 Ų139151.7 Ų151.771%0.71375%0.748SS**  trans-65.9102.9174.9-57.3178.5000107.4D31 I35D31-I33 PolarHBondContact O-N 3.49Å; I33-I35 PolarHBondContact O-N 3.45Å
34Q69.2Low67.8Low186 Ų186152.2 Ų152.287%0.86976%0.757SS**  trans-74.992.3178.4-150.4172.235.600108.6F32 P36F32-Q34 PolarHBondContact O-N 2.61Å; Q34-P36 WeakPolarHBondContact O-CD 3.49Å
35I72.7Confident67.9Low136 Ų136156 Ų15670%0.69776%0.759SS**  trans-62.7121174.6-57.6176.7000107.4I33I33-I35 PolarHBondContact O-N 3.45Å
36P72.6Confident68.4Low97 Ų97153.4 Ų153.463%0.6375%0.747SS**  trans-61140.7177.2-22.233.7000110.6Q34 L38Q34-P36 WeakPolarHBondContact O-CD 3.49Å; P36-L38 PolarHBondContact O-N 3Å
37D69.6Low69Low111 Ų111148.4 Ų148.459%0.59473%0.731SS**  trans-69.398.7178.1-168.3-7.5000109.9R39D37-R39 PolarHBondContact O-N 3.31Å; D37-R39 VanDerWaalsContact OD1-CG 3.23Å; D37-R39 WeakPolarHBondContact OD1-CG 3.18Å; D37-R39 IonicContact OD1-NE 2.73Å; D37-R39 PolarHBondContact OD1-NE 2.85Å; D37-R39 IonicContact OD2-CZ 3.5Å; D37-R39 IonicContact OD2-NE 3.22Å; D37-R39 PolarHBondContact OD2-NE 2.82Å; D37-R39 IonicContact OD2-NH2 2.7Å; D37-R39 PolarHBondContact OD2-NH2 3.32Å
38L61.7Low69.5Low111 Ų111146.7 Ų146.758%0.58172%0.718SS**  trans-76.155-177.3-66.2175000111.7P36 F40P36-L38 PolarHBondContact O-N 3Å; L38-F40 VanDerWaalsContact C-N 3.28Å; L38-F40 HydrophobicContact CB-CD2 4.25Å; L38-F40 HydrophobicContact CB-CE1 4.47Å; L38-F40 HydrophobicContact CB-CE2 3.7Å; L38-F40 HydrophobicContact CB-CZ 3.84Å; L38-F40 HydrophobicContact CD1-CE2 4.34Å; L38-F40 HydrophobicContact CD1-CZ 3.97Å; L38-F40 HydrophobicContact CD2-CE1 4.35Å; L38-F40 HydrophobicContact CD2-CZ 4.17Å; L38-F40 HydrophobicContact CG-CZ 4.22Å; L38-F40 WeakPolarHBondContact O-CD2 3.46Å; L38-F40 PolarHBondContact O-N 3.18Å
39R63.7Low69.9Low188 Ų188143.1 Ų143.171%0.70971%0.711SS**  trans-71.189.5166.7-54.7-166.1-163.9175.19.2108.3D37 T41D37-R39 PolarHBondContact O-N 3.31Å; D37-R39 VanDerWaalsContact OD1-CG 3.23Å; D37-R39 WeakPolarHBondContact OD1-CG 3.18Å; D37-R39 IonicContact OD1-NE 2.73Å; D37-R39 PolarHBondContact OD1-NE 2.85Å; D37-R39 IonicContact OD2-CZ 3.5Å; D37-R39 IonicContact OD2-NE 3.22Å; D37-R39 PolarHBondContact OD2-NE 2.82Å; D37-R39 IonicContact OD2-NH2 2.7Å; D37-R39 PolarHBondContact OD2-NH2 3.32Å; R39-T41 HydrophobicContact CB-CG2 4.48Å; R39-T41 PolarHBondContact O-N 3.4Å
40F59.8Low70.9Confident138 Ų138139.2 Ų139.261%0.60569%0.687SS**  trans-68.861.5178.7-62.9-75.9000112.5L38 K42 F43L38-F40 VanDerWaalsContact C-N 3.28Å; L38-F40 HydrophobicContact CB-CD2 4.25Å; L38-F40 HydrophobicContact CB-CE1 4.47Å; L38-F40 HydrophobicContact CB-CE2 3.7Å; L38-F40 HydrophobicContact CB-CZ 3.84Å; L38-F40 HydrophobicContact CD1-CE2 4.34Å; L38-F40 HydrophobicContact CD1-CZ 3.97Å; L38-F40 HydrophobicContact CD2-CE1 4.35Å; L38-F40 HydrophobicContact CD2-CZ 4.17Å; L38-F40 HydrophobicContact CG-CZ 4.22Å; L38-F40 WeakPolarHBondContact O-CD2 3.46Å; L38-F40 PolarHBondContact O-N 3.18Å; F40-K42 PolarHBondContact O-N 3.23Å; F40-K42 VanDerWaalsContact O-N 3.09Å; F40-F43 HydrophobicContact CD1-CD2 4.15Å
41T58Low71.7Confident135 Ų135137.9 Ų137.983%0.82868%0.679SS**THydrogen-bonded Turntrans-70.52.4174560000113.7R39R39-T41 HydrophobicContact CB-CG2 4.48Å; R39-T41 PolarHBondContact O-N 3.4Å
42K58.8Low72.3Confident187 Ų187138 Ų13881%0.81367%0.668SS**THydrogen-bonded Turntrans-121.41.3-171.7-143-178.3-175.3-179.10114.7F40F40-K42 PolarHBondContact O-N 3.23Å; F40-K42 VanDerWaalsContact O-N 3.09Å
43F57.6Low73.2Confident169 Ų169130.2 Ų130.274%0.74164%0.644SS**  trans-125.263.5174.3-68.3-75.3000109.4F40 Y45F40-F43 HydrophobicContact CD1-CD2 4.15Å; F43-Y45 PolarHBondContact O-N 2.94Å
44E67.6Low73.6Confident187 Ų187130.1 Ų130.187%0.87464%0.635SS**  trans-67.1113.2164.8-171.9166.3-155.400107.9S46E44-S46 PolarHBondContact O-N 2.94Å
45Y70.8Confident74.5Confident181 Ų181125.8 Ų125.871%0.7162%0.615SS**  trans-76108.3-177.3-175.2-92.2000109.4F43 F47F43-Y45 PolarHBondContact O-N 2.94Å; Y45-F47 HydrophobicContact CD1-CE1 4.31Å; Y45-F47 HydrophobicContact CD1-CZ 4.33Å; Y45-F47 HydrophobicContact CE1-CD1 4.43Å; Y45-F47 HydrophobicContact CE1-CE1 4.34Å
46S80.7Confident75.1Confident75 Ų75124.9 Ų124.952%0.52461%0.607SS.*  trans-81.1124.6-178.560.80000111.7E44 E48E44-S46 PolarHBondContact O-N 2.94Å; S46-E48 PolarHBondContact O-N 3.33Å
47F83.1Confident75.5Confident126 Ų126126.2 Ų126.255%0.55360%0.604SS**THydrogen-bonded Turntrans-74.93179.1-68.8-84.8000114.2Y45 A49 E50 T51Y45-F47 HydrophobicContact CD1-CE1 4.31Å; Y45-F47 HydrophobicContact CD1-CZ 4.33Å; Y45-F47 HydrophobicContact CE1-CD1 4.43Å; Y45-F47 HydrophobicContact CE1-CE1 4.34Å; F47-A49 PolarHBondContact O-N 3.44Å; F47-A49 VanDerWaalsContact O-N 3.11Å; F47-E50 WeakPolarHBondContact CD1-OE2 3.26Å; F47-E50 WeakPolarHBondContact O-CA 3.1Å; F47-E50 WeakPolarHBondContact O-CB 3.24Å; F47-E50 PolarHBondContact O-N 2.93Å; F47-T51 PolarHBondContact O-N 2.9Å; F47-T51 PolarHBondContact O-OG1 3.12Å
48E85.3Confident76.2Confident133 Ų133124.9 Ų124.962%0.62160%0.596SS**Hα-helixtrans-52.4-37.3-176.4-65.8-176.4-175.200114S46 R52S46-E48 PolarHBondContact O-N 3.33Å; E48-R52 WeakPolarHBondContact O-CB 3.22Å; E48-R52 PolarHBondContact O-N 3.07Å
49A82.1Confident77.1Confident73 Ų73126.2 Ų126.260%0.60360%0.597SS**Hα-helixtrans-69.2-37.4177.600000112.2F47 A53F47-A49 PolarHBondContact O-N 3.44Å; F47-A49 VanDerWaalsContact O-N 3.11Å; A49-A53 WeakPolarHBondContact O-CB 3.4Å; A49-A53 PolarHBondContact O-N 3.35Å; A49-A53 VanDerWaalsContact O-N 3.1Å
50E88.4Confident77.7Confident80 Ų80124.8 Ų124.837%0.37460%0.599SS.*Hα-helixtrans-71.8-44176.9-171.5-179.3158.500111F47 R52 A53 R54F47-E50 WeakPolarHBondContact CD1-OE2 3.26Å; F47-E50 WeakPolarHBondContact O-CA 3.1Å; F47-E50 WeakPolarHBondContact O-CB 3.24Å; F47-E50 PolarHBondContact O-N 2.93Å; E50-R52 VanDerWaalsContact C-N 3.33Å; E50-R52 PolarHBondContact O-N 3.01Å; E50-A53 PolarHBondContact O-N 3.35Å; E50-R54 PolarHBondContact O-N 2.88Å; E50-R54 IonicContact OE1-CZ 2.63Å; E50-R54 IonicContact OE1-NH1 2.75Å; E50-R54 PolarHBondContact OE1-NH1 3.3Å; E50-R54 IonicContact OE1-NH2 3.95Å; E50-R54 PolarHBondContact OE1-NH2 2.23Å
51T88.1Confident78.2Confident75 Ų75122.9 Ų122.946%0.4660%0.595SS.*Hα-helixtrans-58.3-45.9175.4-50.10000111F47 A53 R54 E55F47-T51 PolarHBondContact O-N 2.9Å; F47-T51 PolarHBondContact O-OG1 3.12Å; T51-A53 VanDerWaalsContact C-N 3.35Å; T51-A53 PolarHBondContact O-N 3.04Å; T51-R54 PolarHBondContact O-N 2.63Å; T51-E55 PolarHBondContact O-N 3.38Å
52R87.8Confident78.7Confident154 Ų154123 Ų12358%0.58159%0.586SS**Hα-helixtrans-62.6-39.8176.9-172.4-177.4-58.9160.87.2112.5E48 E50 Q56E48-R52 WeakPolarHBondContact O-CB 3.22Å; E48-R52 PolarHBondContact O-N 3.07Å; E50-R52 VanDerWaalsContact C-N 3.33Å; E50-R52 PolarHBondContact O-N 3.01Å; R52-Q56 WeakPolarHBondContact O-CG 3.44Å; R52-Q56 PolarHBondContact O-N 3.49Å
53A86.6Confident78.7Confident54 Ų54118.5 Ų118.545%0.44658%0.576SS.*Hα-helixtrans-65.9-39.4176.600000111.7A49 E50 T51 Q56 F57A49-A53 WeakPolarHBondContact O-CB 3.4Å; A49-A53 PolarHBondContact O-N 3.35Å; A49-A53 VanDerWaalsContact O-N 3.1Å; E50-A53 PolarHBondContact O-N 3.35Å; T51-A53 VanDerWaalsContact C-N 3.35Å; T51-A53 PolarHBondContact O-N 3.04Å; A53-Q56 PolarHBondContact O-N 2.89Å; A53-F57 PolarHBondContact O-N 2.89Å
54R82.6Confident78.5Confident137 Ų137117.6 Ų117.652%0.51758%0.577SS.*Hα-helixtrans-63.1-49.9175.4-147.1101.776.8-147.4-3.5111.2E50 T51 Q56 F57 D58E50-R54 PolarHBondContact O-N 2.88Å; E50-R54 IonicContact OE1-CZ 2.63Å; E50-R54 IonicContact OE1-NH1 2.75Å; E50-R54 PolarHBondContact OE1-NH1 3.3Å; E50-R54 IonicContact OE1-NH2 3.95Å; E50-R54 PolarHBondContact OE1-NH2 2.23Å; T51-R54 PolarHBondContact O-N 2.63Å; R54-Q56 VanDerWaalsContact C-N 3.27Å; R54-Q56 PolarHBondContact O-N 3.49Å; R54-F57 WeakPolarHBondContact O-CB 3.37Å; R54-F57 PolarHBondContact O-N 2.89Å; R54-F57 VanDerWaalsContact O-N 3.09Å; R54-D58 VanDerWaalsContact O-CG 3.25Å; R54-D58 PolarHBondContact O-N 3.05Å
55E86.9Confident77.8Confident95 Ų95114.8 Ų114.844%0.44457%0.573SS.*Hα-helixtrans-57.1-37.7175.4-77.2-173.7-146.400113.5T51 K59T51-E55 PolarHBondContact O-N 3.38Å; E55-K59 VanDerWaalsContact O-CB 3.27Å; E55-K59 WeakPolarHBondContact O-CB 3.45Å; E55-K59 VanDerWaalsContact O-CD 3.31Å; E55-K59 WeakPolarHBondContact O-CD 3.26Å; E55-K59 WeakPolarHBondContact O-CG 3.34Å; E55-K59 PolarHBondContact O-N 2.88Å; E55-K59 IonicContact OE2-NZ 2.7Å; E55-K59 PolarHBondContact OE2-NZ 2.94Å
56Q84.9Confident76.7Confident116 Ų116112.7 Ų112.754%0.54257%0.573SS.*Hα-helixtrans-68.4-39.3177.7-77.6179-29.800111.8R52 A53 R54 Q60R52-Q56 WeakPolarHBondContact O-CG 3.44Å; R52-Q56 PolarHBondContact O-N 3.49Å; A53-Q56 PolarHBondContact O-N 2.89Å; R54-Q56 VanDerWaalsContact C-N 3.27Å; R54-Q56 PolarHBondContact O-N 3.49Å; Q56-Q60 VanDerWaalsContact O-CG 3.3Å; Q56-Q60 WeakPolarHBondContact O-CG 3.4Å; Q56-Q60 PolarHBondContact O-N 2.99Å
57F82.3Confident74.9Confident126 Ų126116.5 Ų116.555%0.55359%0.587SS**Hα-helixtrans-65.4-45.3174.6-179.7-95.9000111.6A53 R54 Q60 N61A53-F57 PolarHBondContact O-N 2.89Å; R54-F57 WeakPolarHBondContact O-CB 3.37Å; R54-F57 PolarHBondContact O-N 2.89Å; R54-F57 VanDerWaalsContact O-N 3.09Å; F57-Q60 PolarHBondContact O-N 3.39Å; F57-N61 WeakPolarHBondContact CD1-ND2 3.31Å; F57-N61 WeakPolarHBondContact CE1-ND2 3.31Å; F57-N61 WeakPolarHBondContact CE2-ND2 3.17Å; F57-N61 WeakPolarHBondContact CZ-ND2 3.33Å; F57-N61 PolarHBondContact O-N 3.3Å; F57-N61 VanDerWaalsContact O-N 3.12Å; F57-N61 PolarHBondContact O-ND2 2.85Å
58D83.1Confident72.9Confident82 Ų82115.1 Ų115.144%0.43959%0.593SS.*Hα-helixtrans-64.6-45.9179.3-61.1-26.4000110.6R54 Q60 N61 E62R54-D58 VanDerWaalsContact O-CG 3.25Å; R54-D58 PolarHBondContact O-N 3.05Å; D58-Q60 PolarHBondContact O-N 2.8Å; D58-Q60 VanDerWaalsContact O-N 3.15Å; D58-N61 CarbonylContact O-C 3.51Å; D58-N61 PolarHBondContact O-N 3.11Å; D58-E62 PolarHBondContact O-N 2.98Å
59K81.2Confident70.6Confident139 Ų139115.3 Ų115.360%0.60460%0.604SS**Hα-helixtrans-60.6-23174.7-75164.3-177.8156.50114.4E55E55-K59 VanDerWaalsContact O-CB 3.27Å; E55-K59 WeakPolarHBondContact O-CB 3.45Å; E55-K59 VanDerWaalsContact O-CD 3.31Å; E55-K59 WeakPolarHBondContact O-CD 3.26Å; E55-K59 WeakPolarHBondContact O-CG 3.34Å; E55-K59 PolarHBondContact O-N 2.88Å; E55-K59 IonicContact OE2-NZ 2.7Å; E55-K59 PolarHBondContact OE2-NZ 2.94Å
60Q75.3Confident68.3Low159 Ų159116.2 Ų116.274%0.74361%0.606SS**Hα-helixtrans-87.7-20.6174.9-75.7177.6-9.300113.1Q56 F57 D58Q56-Q60 VanDerWaalsContact O-CG 3.3Å; Q56-Q60 WeakPolarHBondContact O-CG 3.4Å; Q56-Q60 PolarHBondContact O-N 2.99Å; F57-Q60 PolarHBondContact O-N 3.39Å; D58-Q60 PolarHBondContact O-N 2.8Å; D58-Q60 VanDerWaalsContact O-N 3.15Å
61N71.1Confident65.7Low97 Ų97119.4 Ų119.452%0.51963%0.631SS.*Hα-helixtrans-104.9-1.7-179.9-70-48.1000113.8F57 D58 P63F57-N61 WeakPolarHBondContact CD1-ND2 3.31Å; F57-N61 WeakPolarHBondContact CE1-ND2 3.31Å; F57-N61 WeakPolarHBondContact CE2-ND2 3.17Å; F57-N61 WeakPolarHBondContact CZ-ND2 3.33Å; F57-N61 PolarHBondContact O-N 3.3Å; F57-N61 VanDerWaalsContact O-N 3.12Å; F57-N61 PolarHBondContact O-ND2 2.85Å; D58-N61 CarbonylContact O-C 3.51Å; D58-N61 PolarHBondContact O-N 3.11Å; N61-P63 WeakPolarHBondContact O-CD 3.4Å; N61-P63 VanDerWaalsContact O-N 3.13Å
62E67.8Low63.3Low137 Ų137124.3 Ų124.364%0.6465%0.646SS**SBendtrans-53116166.6-83-63.516200109.5D58 I64D58-E62 PolarHBondContact O-N 2.98Å; E62-I64 PolarHBondContact O-N 3.27Å
63P59.7Low60.6Low93 Ų93124.2 Ų124.260%0.60466%0.663SS**  trans-63.9131.7178.726.9-33000108.5N61 V65N61-P63 WeakPolarHBondContact O-CD 3.4Å; N61-P63 VanDerWaalsContact O-N 3.13Å; P63-V65 VanDerWaalsContact C-N 3.25Å; P63-V65 PolarHBondContact O-N 2.85Å
64I53.9Low58Low151 Ų151127.1 Ų127.177%0.77468%0.675SS**  trans-66.788.2177.3-57.3173000108.5E62 L66E62-I64 PolarHBondContact O-N 3.27Å; I64-L66 HydrophobicContact CG2-CB 4.44Å; I64-L66 HydrophobicContact CG2-CD1 3.91Å; I64-L66 HydrophobicContact CG2-CG 3.8Å; I64-L66 PolarHBondContact O-N 3.42Å
65V51.7Low55.5Low128 Ų128126.7 Ų126.778%0.77669%0.688SS**  trans-74.278.5167.4-174.90000107.1P63 D67P63-V65 VanDerWaalsContact C-N 3.25Å; P63-V65 PolarHBondContact O-N 2.85Å; V65-D67 PolarHBondContact O-N 3.41Å
66L47.4Very low52.8Low136 Ų136128.4 Ų128.471%0.71271%0.705SS**  trans-66102.6165.8-98.4159.1000107.9I64 S68I64-L66 HydrophobicContact CG2-CB 4.44Å; I64-L66 HydrophobicContact CG2-CD1 3.91Å; I64-L66 HydrophobicContact CG2-CG 3.8Å; I64-L66 PolarHBondContact O-N 3.42Å; L66-S68 PolarHBondContact O-N 2.93Å
67D44.2Very low50.2Low155 Ų155127.3 Ų127.383%0.82972%0.716SS**  trans-60.6104.9170.7-140.5-9.2000108V65V65-D67 PolarHBondContact O-N 3.41Å
68S40.3Very low48Very low97 Ų97126.7 Ų126.768%0.67873%0.727SS**  trans-148.1107.1-179.2-79.30000109.4L66 S70L66-S68 PolarHBondContact O-N 2.93Å; S68-S70 PolarHBondContact O-N 3.41Å
69T38.4Very low46Very low137 Ų137128.8 Ų128.884%0.8475%0.745SS**  trans-66.3122.1-168.4-46.50000112.7
70S33.8Very low44.3Very low93 Ų93128.2 Ų128.265%0.6576%0.756SS**  trans52.8114.9152.51770000119.3S68S68-S70 PolarHBondContact O-N 3.41Å
71T32.4Very low42.1Very low146 Ų146124.6 Ų124.690%0.89676%0.761SS**  -151139.7118-3.10000112.3
72K38.5Very low40Very low178 Ų178123.8 Ų123.877%0.77478%0.775SS**  trans-78.3145.8-179.4-67.7168.6172.8171.30111.9
73T31.6Very low38.1Very low152 Ų152125 Ų12593%0.93379%0.787SS**  trans-130.7132.1135.141.40000109.8
74T30.4Very low36.9Very low115 Ų115129.3 Ų129.371%0.70680%0.796SS**  trans-113.9135-169.4-460000110.1
75T30.6Very low35.8Very low129 Ų129130.3 Ų130.379%0.79180%0.803SS**  trans165.2148.6148.339.10000109.1
76T29.7Very low35Very low130 Ų130130.1 Ų130.180%0.79881%0.807SS**  cis-171.1147.7-20.224.40000105.9
77A30.6Very low34.2Very low94 Ų94127.4 Ų127.478%0.77781%0.812SS**  cis-163.2165.4-9.500000109.5
78S36Very low33.7Very low113 Ų113128.7 Ų128.779%0.7981%0.813SS**  trans-80.7167.1172.7-40.20000111.9
79P42.5Very low33.3Very low125 Ų125129.3 Ų129.381%0.81281%0.812SS**  -145.4166.681.536.7-18.8000116
80P44.3Very low32.9Very low128 Ų128133.9 Ų133.983%0.83181%0.814SS**  trans-93.3155.3176.337-33000112.9
81G28.4Very low32.9Very low82 Ų82135.3 Ų135.385%0.84582%0.819SS**  trans-167.7117.8170.600000110.8
82G27.6Very low33Very low80 Ų80133.1 Ų133.183%0.82581%0.81SS**  trans-92.8164.4-179.100000112.7
83N28.9Very low32.8Very low164 Ų164133.6 Ų133.688%0.87781%0.814SS**  trans-150.1155.1144.1-139.1-12.5000112.4
84K33.5Very low32.8Very low183 Ų183131 Ų13180%0.79680%0.802SS**  trans-81.5154179.8-60.3163.4179.9173.90109.9
85N31.4Very low33Very low172 Ų172135.6 Ų135.692%0.9281%0.807SS**  trans-160.9118.7136.2-97.2-20000111.2
86S34.8Very low33.1Very low123 Ų123137.9 Ų137.986%0.8681%0.809SS**  trans-85.8144.6169.647.10000110.5
87G30.2Very low33.3Very low79 Ų79136.5 Ų136.581%0.81481%0.805SS**  trans-158.845.6-173.800000114.8
88E33.2Very low33.5Very low182 Ų182138.5 Ų138.585%0.8581%0.807SS**  trans-51.2151.4155.7-117.5-178.2164.700109.9
89V31.7Very low33.5Very low111 Ų111139 Ų13967%0.67381%0.81SS**  cis-160.8153.121.9-165.40000107.5
90R31.8Very low33.2Very low233 Ų233135.7 Ų135.788%0.87980%0.799SS**  166.2130.9121.9-89.8172.4-173.9-165.70.4116.4
91T32.7Very low32.9Very low123 Ų123140.7 Ų140.776%0.75580%0.803SS**  trans-37.2158.8154.551.70000114.6
92S35.6Very low33.6Very low100 Ų100144.8 Ų144.870%0.69981%0.806SS**  cis-168.3157.330.91.80000112.6
93E33.4Very low34.6Very low187 Ų187147.6 Ų147.687%0.87480%0.801SS**  trans45.1128.7151.1-54.1-173.9147.700120.1
94S31.3Very low35.4Very low97 Ų97146.5 Ų146.568%0.67880%0.8SS**  177.7142.259.3-167.60000113.8
95R33.9Very low36.2Very low213 Ų213145.8 Ų145.880%0.80481%0.805SS**  trans60.4117.9153.4-72.4173.3-179.9-170.6-1.8123.3
96Q34.2Very low37.3Very low176 Ų176141.8 Ų141.882%0.82279%0.79SS**  trans60.4140.9133.6-70.5164.1-44.800118.7
97S32.3Very low38.3Very low102 Ų102143.7 Ų143.771%0.71379%0.785SS**  cis-168.114112.430.90000112.8
98V36.7Very low39.3Very low136 Ų136147.4 Ų147.482%0.82479%0.787SS**  trans64.1140.8147.9-172.70000120.7
99S35.8Very low40.2Very low122 Ų122145 Ų14585%0.85378%0.784SS**  trans70.9126.9170.465.10000116.8
100G35.3Very low41Very low57 Ų57147.4 Ų147.459%0.58879%0.792SS**  trans-136.9167.4176.400000111.1
101Y39.1Very low42.5Very low233 Ų233142.3 Ų142.391%0.91479%0.787SS**  trans71.270.3164.1-42.5-69.8000117.2
102D42Very low43.4Very low168 Ų168142.1 Ų142.190%0.89879%0.787SS**  trans-126.687.7152.5-96.7-40.3000109.2
103D48.9Very low43.5Very low138 Ų138142.8 Ų142.874%0.73879%0.791SS**  trans-163.551159.6-154.47.9000114.7
104V46.3Very low44.3Very low141 Ų141140 Ų14086%0.85579%0.789SS**SBendtrans-142.542.8174-155.50000113.5
105L49.7Very low44.8Very low169 Ų169141.4 Ų141.489%0.88579%0.793SS**  trans-137.511.3177.4-74.3178.5000115.2
106S55.4Low45.3Very low87 Ų87139.3 Ų139.361%0.60880%0.798SS**SBendtrans-96.53-167.554.20000116.4
107Q54Low45.6Very low163 Ų163135.8 Ų135.876%0.76279%0.793SS**SBendtrans-131.6128.6176.3-82.2129.524.100112.2
108N52.4Low45.8Very low158 Ų158138.2 Ų138.285%0.84580%0.798SS**  trans104.137.4177.8-54.2-31.7000117.9
109V52.1Low46.1Very low131 Ų131137.3 Ų137.379%0.79480%0.795SS**PPolyproline II helixtrans-85.4117.8158.2-1770000109V111V109-V111 PolarHBondContact O-N 2.98Å
110L48.8Very low46.3Very low162 Ų162136.3 Ų136.385%0.84879%0.788SS**PPolyproline II helixtrans-63.8129.8173.3-9381.7000110.6
111V61.9Low46.5Very low126 Ų126141.7 Ų141.776%0.76480%0.799SS**PPolyproline II helixtrans-86.3130.3174-176.90000109.6V109 C113V109-V111 PolarHBondContact O-N 2.98Å; V111-C113 PolarHBondContact O-N 2.92Å
112P51.6Low46.3Very low118 Ų118136.6 Ų136.677%0.76679%0.793SS**PPolyproline II helixtrans-64.7130.3174.8-21.733.4000112.4
113C39.5Very low46.2Very low115 Ų115134 Ų13478%0.77779%0.788SS**PPolyproline II helixtrans-78.8139.8172.8-61.80000111.5V111V111-C113 PolarHBondContact O-N 2.92Å
114P50.2Low45.5Very low128 Ų128133.1 Ų133.183%0.83179%0.792SS**PPolyproline II helixtrans-72.2136.4173.229.9-33.6000111.3
115V41.1Very low44.9Very low126 Ų126131.5 Ų131.576%0.76479%0.787SS**PPolyproline II helixtrans-86.7116.9178.5-178.40000110S117V115-S117 PolarHBondContact O-N 2.73Å; V115-S117 VanDerWaalsContact O-N 3.12Å
116N45.1Very low44.4Very low169 Ų169129.3 Ų129.390%0.90478%0.781SS**  trans-72.599.1168.2-96.5-13.3000110N118N116-N118 PolarHBondContact O-N 2.88Å
117S39Very low43.5Very low103 Ų103134.9 Ų134.972%0.7279%0.794SS**  trans-85.6106.1174.4-630000111V115V115-S117 PolarHBondContact O-N 2.73Å; V115-S117 VanDerWaalsContact O-N 3.12Å
118N37Very low42.7Very low152 Ų152133 Ų13381%0.81380%0.797SS**  trans-157.2101.6162.9-143.829.7000113.3N116N116-N118 PolarHBondContact O-N 2.88Å
119P43.2Very low41.9Very low118 Ų118131 Ų13177%0.76679%0.794SS**  trans-91.4115.4156.931.1-23.3000109.5M121P119-M121 PolarHBondContact O-N 3.47Å
120S40.1Very low41.1Very low100 Ų100131 Ų13170%0.69980%0.795SS**  trans-70.7118.2170.2-177.40000109.9
121M38.4Very low40.4Very low170 Ų170128 Ų12884%0.83779%0.788SS**  trans-142.4143.4160.8-92.7-63.310300111P119P119-M121 PolarHBondContact O-N 3.47Å
122T36.3Very low39Very low127 Ų127130.1 Ų130.178%0.77980%0.795SS**  trans-82.9156.7-164.442.50000113.9
123S38.8Very low38.6Very low113 Ų113131.1 Ų131.179%0.7980%0.798SS**  trans-72.5146.4-17445.40000115.1
124S35.7Very low38.5Very low119 Ų119131.2 Ų131.283%0.83280%0.8SS**  -175.6139.3118.242.70000115.8
125S32.8Very low38Very low107 Ų107128.8 Ų128.875%0.74879%0.792SS**  trans78.580148.8-138.60000123.4
126T38.5Very low38.2Very low123 Ų123130.7 Ų130.776%0.75579%0.794SS**  44.6104.612863.90000122.6
127K36.1Very low38.3Very low204 Ų204128.4 Ų128.489%0.88779%0.786SS**  -175.415696.2-100.5-179.3179.61780111.6
128P38.4Very low38.8Very low125 Ų125129.7 Ų129.781%0.81278%0.78SS**  trans-99.6146.1-166.536.9-33.3000114.7
129S35.2Very low39.6Very low114 Ų114125.2 Ų125.280%0.79776%0.761SS**  trans-156.7108.9155.4-170.20000111.7
130V35.9Very low40.2Very low132 Ų132126 Ų12680%0.876%0.758SS**  trans43.7111159.8-161.90000118.9
131S33.3Very low41.3Very low100 Ų100127.9 Ų127.970%0.69976%0.755SS**  trans-72.4135.8167.253.20000113
132N32.8Very low42.6Very low170 Ų170125.3 Ų125.391%0.90974%0.741SS**  trans-136.5103.6152.7-112.8-6.4000108.8
133T43.9Very low43.6Very low138 Ų138126 Ų12685%0.84773%0.734SS**  trans-97111.117546.30000110.1
134S36.3Very low44.9Very low117 Ų117128 Ų12882%0.81873%0.73SS**  trans-154.8128156.2-167.90000111
135A41Very low46.4Very low78 Ų78126 Ų12665%0.64572%0.717SS**  trans48.3106.1168.300000118V137A135-V137 HydrophobicContact CB-CG2 4.33Å; A135-V137 PolarHBondContact O-N 3.04Å
136M45.3Very low48Very low166 Ų166125 Ų12582%0.81871%0.706SS**  trans-60.687.6150.9-87.4-179.3147.800109.5H138M136-H138 VanDerWaalsContact C-N 3.25Å; M136-H138 PolarHBondContact O-N 2.89Å; M136-H138 VanDerWaalsContact O-N 3.16Å
137V46.8Very low49.4Very low120 Ų120125.7 Ų125.773%0.72771%0.705SS**  trans-78.586.8156.5-175.50000105.9A135 S139A135-V137 HydrophobicContact CB-CG2 4.33Å; A135-V137 PolarHBondContact O-N 3.04Å; V137-S139 PolarHBondContact O-N 3.36Å
138H49.2Very low51Low131 Ų131118.3 Ų118.361%0.60668%0.675SS**  trans-60.897.1162.8-75.4-60.2000107.1M136 L140M136-H138 VanDerWaalsContact C-N 3.25Å; M136-H138 PolarHBondContact O-N 2.89Å; M136-H138 VanDerWaalsContact O-N 3.16Å; H138-L140 PolarHBondContact O-N 3.04Å
139S53.3Low52.4Low58 Ų58117.4 Ų117.441%0.40667%0.667SS.*  trans-62.3129.9176-175.10000107.4V137 H141 E142 F143V137-S139 PolarHBondContact O-N 3.36Å; S139-H141 PolarHBondContact O-N 3.34Å; S139-H141 WeakPolarHBondContact OG-CB 3.44Å; S139-H141 PolarHBondContact OG-N 3.49Å; S139-E142 WeakPolarHBondContact O-CB 3.31Å; S139-E142 PolarHBondContact O-N 2.87Å; S139-F143 PolarHBondContact O-N 2.72Å
140L56.2Low53.8Low133 Ų133119.6 Ų119.670%0.69666%0.663SS**Hα-helixtrans-50.8-29.7170.2-86.9161.9000111.4H138 E142 F143 E144H138-L140 PolarHBondContact O-N 3.04Å; L140-E142 VanDerWaalsContact C-N 3.33Å; L140-E142 PolarHBondContact O-N 3.48Å; L140-F143 PolarHBondContact O-N 2.97Å; L140-E144 WeakPolarHBondContact O-CB 3.27Å; L140-E144 WeakPolarHBondContact O-CG 3.11Å; L140-E144 PolarHBondContact O-N 3.25Å
141H62Low55.3Low141 Ų141119.1 Ų119.165%0.65366%0.656SS**Hα-helixtrans-62.1-34.5174.8-165.842000113.8S139 S145S139-H141 PolarHBondContact O-N 3.34Å; S139-H141 WeakPolarHBondContact OG-CB 3.44Å; S139-H141 PolarHBondContact OG-N 3.49Å; H141-S145 WeakPolarHBondContact O-CB 3.31Å; H141-S145 PolarHBondContact O-N 3.39Å; H141-S145 VanDerWaalsContact O-N 3.1Å; H141-S145 PolarHBondContact O-OG 3.32Å
142E65.7Low57Low115 Ų115119.9 Ų119.954%0.53765%0.652SS.*Hα-helixtrans-70.2-45.1176.6-170.2178-170.600110.1S139 L140 E144 S145 T146S139-E142 WeakPolarHBondContact O-CB 3.31Å; S139-E142 PolarHBondContact O-N 2.87Å; L140-E142 VanDerWaalsContact C-N 3.33Å; L140-E142 PolarHBondContact O-N 3.48Å; E142-E144 VanDerWaalsContact C-N 3.33Å; E142-E144 PolarHBondContact O-N 3.25Å; E142-S145 WeakPolarHBondContact CA-OG 3.27Å; E142-S145 PolarHBondContact O-N 3.05Å; E142-S145 PolarHBondContact O-OG 3.18Å; E142-T146 PolarHBondContact O-N 3.04Å
143F57.5Low58.8Low142 Ų142116.1 Ų116.162%0.62363%0.631SS**Hα-helixtrans-67.1-29.3178.8-154.8-87000113.6S139 L140S139-F143 PolarHBondContact O-N 2.72Å; L140-F143 PolarHBondContact O-N 2.97Å
144E66.6Low59.9Low154 Ų154117.6 Ų117.672%0.7263%0.628SS**THydrogen-bonded Turntrans-83.7-12.7171.4-71.5179.1-173.900113.4L140 E142L140-E144 WeakPolarHBondContact O-CB 3.27Å; L140-E144 WeakPolarHBondContact O-CG 3.11Å; L140-E144 PolarHBondContact O-N 3.25Å; E142-E144 VanDerWaalsContact C-N 3.33Å; E142-E144 PolarHBondContact O-N 3.25Å
145S66.5Low61.3Low79 Ų79119.3 Ų119.355%0.55263%0.627SS**THydrogen-bonded Turntrans-94.4-17.1-175.7700000114.8H141 E142H141-S145 WeakPolarHBondContact O-CB 3.31Å; H141-S145 PolarHBondContact O-N 3.39Å; H141-S145 VanDerWaalsContact O-N 3.1Å; H141-S145 PolarHBondContact O-OG 3.32Å; E142-S145 WeakPolarHBondContact CA-OG 3.27Å; E142-S145 PolarHBondContact O-N 3.05Å; E142-S145 PolarHBondContact O-OG 3.18Å
146T67.3Low62.4Low84 Ų84122.6 Ų122.652%0.51563%0.632SS.*SBendtrans-92.5130.817351.60000109.2E142 N148E142-T146 PolarHBondContact O-N 3.04Å; T146-N148 PolarHBondContact O-N 2.9Å
147N67.8Low63.2Low139 Ų139119.1 Ų119.174%0.74363%0.63SS**  trans-54.4113.6171.6-94.830.2000108.6
148N70.3Confident63.7Low48 Ų48120.6 Ų120.626%0.25763%0.633SS.*  trans-80.4141179-125.7-50.5000108.2T146 F150 D151T146-N148 PolarHBondContact O-N 2.9Å; N148-F150 PolarHBondContact O-N 3.21Å; N148-D151 VanDerWaalsContact CB-OD2 3.25Å; N148-D151 WeakPolarHBondContact CB-OD2 3.16Å; N148-D151 PolarHBondContact N-OD2 3.15Å; N148-D151 VanDerWaalsContact N-OD2 3.15Å; N148-D151 WeakPolarHBondContact O-CB 3.33Å; N148-D151 PolarHBondContact O-N 3.2Å
149V68.3Low64.5Low106 Ų106119.2 Ų119.264%0.64263%0.63SS**Hα-helixtrans-58.5-23.5178-178.90000111.1I153V149-I153 WeakPolarHBondContact O-CG1 3.26Å; V149-I153 PolarHBondContact O-N 2.92Å
150F63.4Low65.3Low160 Ų160121.6 Ų121.670%0.70264%0.638SS**Hα-helixtrans-73.3-21.2174.5-61.9-78.1000115N148 I153N148-F150 PolarHBondContact O-N 3.21Å; F150-I153 HydrophobicContact CD1-CD1 4.11Å
151D68.6Low65.9Low122 Ų122124.1 Ų124.165%0.65264%0.639SS**Hα-helixtrans-75.4-31.5175.1-62.6-50.1000111.6N148 I153N148-D151 VanDerWaalsContact CB-OD2 3.25Å; N148-D151 WeakPolarHBondContact CB-OD2 3.16Å; N148-D151 PolarHBondContact N-OD2 3.15Å; N148-D151 VanDerWaalsContact N-OD2 3.15Å; N148-D151 WeakPolarHBondContact O-CB 3.33Å; N148-D151 PolarHBondContact O-N 3.2Å; D151-I153 VanDerWaalsContact C-N 3.35Å
152D67.7Low66.1Low117 Ų117124.3 Ų124.363%0.62664%0.638SS**Hα-helixtrans-79.6-15.6174.8-72.3-35.3000112.8Q154D152-Q154 PolarHBondContact O-N 3.32Å
153I71.9Confident66.1Low91 Ų91121.4 Ų121.447%0.46763%0.634SS.*  trans-7791.1175.6-67.5167.5000109.3V149 F150 D151 I155V149-I153 WeakPolarHBondContact O-CG1 3.26Å; V149-I153 PolarHBondContact O-N 2.92Å; F150-I153 HydrophobicContact CD1-CD1 4.11Å; D151-I153 VanDerWaalsContact C-N 3.35Å; I153-I155 HydrophobicContact CG2-CG1 4.2Å; I153-I155 PolarHBondContact O-N 2.74Å
154Q66.4Low66.4Low168 Ų168119.8 Ų119.879%0.78563%0.631SS**  trans-65.297.9166.1-66.2-17510.200109.7D152 L156D152-Q154 PolarHBondContact O-N 3.32Å; Q154-L156 VanDerWaalsContact C-N 3.27Å; Q154-L156 PolarHBondContact O-N 3.11Å
155I65.6Low66.4Low153 Ų153118 Ų11879%0.78562%0.623SS**  trans-67.491.1169.1-55.1178.3000107.8I153 A157I153-I155 HydrophobicContact CG2-CG1 4.2Å; I153-I155 PolarHBondContact O-N 2.74Å; I155-A157 PolarHBondContact O-N 3.05Å
156L64.8Low66.3Low147 Ų147120.3 Ų120.377%0.7763%0.625SS**  trans-62.5102166.9-74.9167.1000107.9Q154 L158Q154-L156 VanDerWaalsContact C-N 3.27Å; Q154-L156 PolarHBondContact O-N 3.11Å; L156-L158 PolarHBondContact O-N 3.07Å
157A61.4Low66Low93 Ų93123 Ų12377%0.76963%0.631SS**  trans-58.7114.5167.600000108.2I155 D159I155-A157 PolarHBondContact O-N 3.05Å; A157-D159 PolarHBondContact O-N 3.43Å; A157-D159 VanDerWaalsContact O-N 3.12Å
158L58Low65.5Low151 Ų151123.6 Ų123.679%0.79163%0.63SS**  trans-61.5114.9169.7-72.9167.4000107.4L156 D160L156-L158 PolarHBondContact O-N 3.07Å; L158-D160 PolarHBondContact O-N 2.98Å
159D65.3Low64.8Low102 Ų102129.7 Ų129.755%0.54565%0.654SS.*  trans-74.982.8170.2-178.717.3000107.9A157 R161 K162 A163A157-D159 PolarHBondContact O-N 3.43Å; A157-D159 VanDerWaalsContact O-N 3.12Å; D159-R161 PolarHBondContact O-N 3.37Å; D159-R161 WeakPolarHBondContact OD1-CB 3.33Å; D159-R161 PolarHBondContact OD1-N 3.24Å; D159-K162 HydrophobicContact CB-CB 4.39Å; D159-K162 WeakPolarHBondContact O-CB 3.24Å; D159-K162 PolarHBondContact O-N 3.2Å; D159-A163 PolarHBondContact O-N 3.25Å
160D69.8Low63.9Low108 Ų108132.3 Ų132.358%0.57866%0.659SS**Hα-helixtrans-50.5-29.1179.6-67.3-27.5000111.8L158 K162 A163 L164L158-D160 PolarHBondContact O-N 2.98Å; D160-K162 VanDerWaalsContact C-N 3.25Å; D160-K162 PolarHBondContact O-N 3.1Å; D160-A163 PolarHBondContact O-N 3.18Å; D160-L164 WeakPolarHBondContact O-CB 3.43Å; D160-L164 VanDerWaalsContact O-CG 3.24Å; D160-L164 WeakPolarHBondContact O-CG 3.38Å; D160-L164 PolarHBondContact O-N 3.18Å
161R69.8Low63.2Low187 Ų187132.8 Ų132.871%0.70666%0.663SS**Hα-helixtrans-61.5-32.7176.1-161.5179.6-175.1168.13.9112.7D159 Q165D159-R161 PolarHBondContact O-N 3.37Å; D159-R161 WeakPolarHBondContact OD1-CB 3.33Å; D159-R161 PolarHBondContact OD1-N 3.24Å; R161-Q165 WeakPolarHBondContact O-CG 3.33Å; R161-Q165 PolarHBondContact O-N 3.45Å; R161-Q165 VanDerWaalsContact O-N 3.14Å
162K65.8Low61.8Low144 Ų144134.6 Ų134.663%0.62667%0.668SS**Hα-helixtrans-79.3-40.3178-157.9-174.2-179.3-163.60111.4D159 D160 Q165 E166D159-K162 HydrophobicContact CB-CB 4.39Å; D159-K162 WeakPolarHBondContact O-CB 3.24Å; D159-K162 PolarHBondContact O-N 3.2Å; D160-K162 VanDerWaalsContact C-N 3.25Å; D160-K162 PolarHBondContact O-N 3.1Å; K162-Q165 PolarHBondContact O-N 3.25Å; K162-E166 PolarHBondContact O-N 2.97Å
163A66.1Low60.6Low55 Ų55134.5 Ų134.546%0.45567%0.674SS.*Hα-helixtrans-62.1-42.8172.800000111.7D159 D160 E166 Q167D159-A163 PolarHBondContact O-N 3.25Å; D160-A163 PolarHBondContact O-N 3.18Å; A163-E166 PolarHBondContact O-N 2.93Å; A163-Q167 PolarHBondContact O-N 3.09Å
164L63.3Low59.1Low108 Ų108137.3 Ų137.357%0.56569%0.688SS**Hα-helixtrans-63.5-39.2174.2-73.1167.2000112.4D160 E166 Q167 Q168D160-L164 WeakPolarHBondContact O-CB 3.43Å; D160-L164 VanDerWaalsContact O-CG 3.24Å; D160-L164 WeakPolarHBondContact O-CG 3.38Å; D160-L164 PolarHBondContact O-N 3.18Å; L164-E166 VanDerWaalsContact C-N 3.33Å; L164-E166 PolarHBondContact O-N 2.99Å; L164-Q167 PolarHBondContact O-N 3.25Å; L164-Q168 WeakPolarHBondContact O-CB 3.3Å; L164-Q168 PolarHBondContact O-N 2.88Å
165Q66.4Low57.6Low117 Ų117136.7 Ų136.755%0.54769%0.69SS.*Hα-helixtrans-67-31.1173.6-81.7-174.3-3.400113.5R161 K162 Q168 K169R161-Q165 WeakPolarHBondContact O-CG 3.33Å; R161-Q165 PolarHBondContact O-N 3.45Å; R161-Q165 VanDerWaalsContact O-N 3.14Å; K162-Q165 PolarHBondContact O-N 3.25Å; Q165-Q168 PolarHBondContact O-N 2.94Å; Q165-K169 PolarHBondContact O-N 2.84Å; Q165-K169 VanDerWaalsContact O-N 3.14Å
166E64.3Low56.2Low127 Ų127135.4 Ų135.459%0.59369%0.685SS**Hα-helixtrans-73-40.9176.2-169.9153.6-154.500111.4K162 A163 L164 Q168 K169 Q170K162-E166 PolarHBondContact O-N 2.97Å; A163-E166 PolarHBondContact O-N 2.93Å; L164-E166 VanDerWaalsContact C-N 3.33Å; L164-E166 PolarHBondContact O-N 2.99Å; E166-Q168 VanDerWaalsContact C-N 3.32Å; E166-Q168 PolarHBondContact O-N 3.43Å; E166-K169 PolarHBondContact O-N 3.45Å; E166-K169 VanDerWaalsContact O-N 3.17Å; E166-Q170 PolarHBondContact O-N 3.38Å
167Q60.8Low54.8Low140 Ų140136.1 Ų136.165%0.65469%0.689SS**Hα-helixtrans-61.9-38.1169.5-71.5-165.7-21.400112.5A163 L164 K169 Q170A163-Q167 PolarHBondContact O-N 3.09Å; L164-Q167 PolarHBondContact O-N 3.25Å; Q167-K169 VanDerWaalsContact C-N 3.27Å; Q167-K169 PolarHBondContact O-N 3.15Å; Q167-Q170 PolarHBondContact O-N 2.77Å
168Q56.9Low53.7Low152 Ų152138.6 Ų138.671%0.7169%0.69SS**Hα-helixtrans-65.9-28.2175.5-130.2175.13.600113.1L164 Q165 E166L164-Q168 WeakPolarHBondContact O-CB 3.3Å; L164-Q168 PolarHBondContact O-N 2.88Å; Q165-Q168 PolarHBondContact O-N 2.94Å; E166-Q168 VanDerWaalsContact C-N 3.32Å; E166-Q168 PolarHBondContact O-N 3.43Å
169K55.7Low52.5Low175 Ų175138.6 Ų138.676%0.76169%0.69SS**Hα-helixtrans-79.7-20.1176.5-86.7-176171.2-174.50114.7Q165 E166 Q167 H171Q165-K169 PolarHBondContact O-N 2.84Å; Q165-K169 VanDerWaalsContact O-N 3.14Å; E166-K169 PolarHBondContact O-N 3.45Å; E166-K169 VanDerWaalsContact O-N 3.17Å; Q167-K169 VanDerWaalsContact C-N 3.27Å; Q167-K169 PolarHBondContact O-N 3.15Å; K169-H171 PolarHBondContact O-N 3.28Å
170Q50.1Low51.3Low161 Ų161139.1 Ų139.175%0.75270%0.698SS**THydrogen-bonded Turntrans-78.6-0.8177.5-72-169.3-6.500113.7E166 Q167E166-Q170 PolarHBondContact O-N 3.38Å; Q167-Q170 PolarHBondContact O-N 2.77Å
171H48.2Very low49.7Very low171 Ų171141.1 Ų141.179%0.79270%0.703SS**THydrogen-bonded Turntrans-12110.9-175-123.3-68.8000115.8K169K169-H171 PolarHBondContact O-N 3.28Å
172E40.3Very low48Very low160 Ų160139.9 Ų139.975%0.74871%0.708SS**PPolyproline II helixtrans-89.5122.1171.8-79.1-89.1117.600110.7
173P41.3Very low46.5Very low115 Ų115142.5 Ų142.575%0.74772%0.719SS**PPolyproline II helixtrans-70.4134.9173.128.6-32.6000111N175P173-N175 PolarHBondContact O-N 3.27Å
174I40.5Very low45.5Very low149 Ų149145.4 Ų145.476%0.76473%0.733SS**PPolyproline II helixtrans-57.3122.3-178.5-61.4161.8000110.7
175N34.5Very low44.3Very low155 Ų155150.5 Ų150.583%0.82975%0.751SS**  trans-124.6106.5157.8-164.84.1000109.7P173P173-N175 PolarHBondContact O-N 3.27Å
176N36.9Very low43.2Very low127 Ų127153.9 Ų153.968%0.67976%0.764SS**  trans-75.1130.2179.5-76-29000110.5
177N34.8Very low42.2Very low162 Ų162156.4 Ų156.487%0.86678%0.78SS**  trans-152.1131.8140.1-101.8-36.5000111.1
178N38.5Very low41.2Very low145 Ų145158.5 Ų158.578%0.77579%0.79SS**  trans-78.6146.1-178.6-63.5-45.4000110.8
179N34Very low40.4Very low150 Ų150160 Ų16080%0.80279%0.794SS**  -170.3132.1118.3-90.3-17.9000113
180T39.9Very low39.6Very low114 Ų114155.5 Ų155.570%0.69979%0.789SS**  trans-18.7150.3142.239.60000116.3
181E35Very low39.3Very low150 Ų150153.9 Ų153.970%0.70178%0.782SS**  cis-164.7176.4-2.5-139.2-178.1123.700110.4
182M33.8Very low39.1Very low161 Ų161154.2 Ų154.279%0.79378%0.781SS**  trans64.5103.7154.3-63.6-89.3-160.200120.5
183K36Very low39.3Very low199 Ų199151.5 Ų151.587%0.86578%0.775SS**  trans-58.4172.4146.8-94.3176.6-177.9166.10111.7
184P43.4Very low39.6Very low116 Ų116148.6 Ų148.675%0.75376%0.761SS**  cis-136.8141.415.232.3-10.9000117.5
185K39.7Very low40Very low215 Ų215146.7 Ų146.794%0.93575%0.747SS**  trans-120.695.8148.3-82.5-175.2176.2178.10109.5
186K42.5Very low41Very low188 Ų188144.2 Ų144.282%0.81773%0.734SS**  trans-16075.1169.6-138.7-177.3-174.1-170.80114
187L43.9Very low42.2Very low179 Ų179140.9 Ų140.994%0.93772%0.721SS**SBendtrans-146.170.3168.7-106.5161.6000109.2
188E40.3Very low43.6Very low185 Ų185136.5 Ų136.586%0.86470%0.697SS**SBendtrans-171.7-31.5168.3-123-167.3132.600112.6A190E188-A190 VanDerWaalsContact C-N 3.29Å; E188-A190 PolarHBondContact O-N 3.32Å
189K38.6Very low45.2Very low184 Ų184135.9 Ų135.980%0.869%0.69SS**THydrogen-bonded Turntrans-8928.8-170.7-146.4175-174.6177.90115.1
190A40.1Very low47.2Very low79 Ų79135.2 Ų135.265%0.65368%0.682SS**THydrogen-bonded Turntrans-106.4-26.9177.500000113.2E188E188-A190 VanDerWaalsContact C-N 3.29Å; E188-A190 PolarHBondContact O-N 3.32Å
191E43.3Very low49Very low128 Ų128136.2 Ų136.260%0.59868%0.679SS**Hα-helixtrans-85.8-16.6-170.3-145-160.1130.200114.4K195E191-K195 WeakPolarHBondContact O-CD 3.34Å; E191-K195 WeakPolarHBondContact O-CG 3.27Å; E191-K195 VanDerWaalsContact OE1-CE 3.32Å; E191-K195 WeakPolarHBondContact OE1-CE 3.46Å; E191-K195 IonicContact OE1-NZ 2.61Å; E191-K195 PolarHBondContact OE1-NZ 2.78Å
192K44Very low51.2Low177 Ų177133.2 Ų133.277%0.7766%0.664SS**Hα-helixtrans-88.5-24.1-179.1-76.6-178.7175.5173.60114.1
193T43.9Very low53.6Low103 Ų103130.3 Ų130.363%0.63265%0.649SS**Hα-helixtrans-79.5-37.1179.212.20000112.8K195 N196T193-K195 VanDerWaalsContact C-N 3.34Å; T193-K195 PolarHBondContact O-N 3.04Å; T193-N196 PolarHBondContact O-N 3.04Å
194A47.4Very low55.9Low54 Ų54127 Ų12745%0.44664%0.637SS.*Hα-helixtrans-68.6-29.4178.700000113.5N196 S197 D198A194-N196 VanDerWaalsContact C-N 3.34Å; A194-N196 PolarHBondContact O-N 3.16Å; A194-S197 PolarHBondContact O-OG 3.1Å; A194-D198 PolarHBondContact O-N 3.06Å
195K50Low57.9Low109 Ų109123.6 Ų123.647%0.47461%0.612SS.*Hα-helixtrans-68.7-32.7178.8-69.3176.2-173.6176.50112.4E191 T193 Q199E191-K195 WeakPolarHBondContact O-CD 3.34Å; E191-K195 WeakPolarHBondContact O-CG 3.27Å; E191-K195 VanDerWaalsContact OE1-CE 3.32Å; E191-K195 WeakPolarHBondContact OE1-CE 3.46Å; E191-K195 IonicContact OE1-NZ 2.61Å; E191-K195 PolarHBondContact OE1-NZ 2.78Å; T193-K195 VanDerWaalsContact C-N 3.34Å; T193-K195 PolarHBondContact O-N 3.04Å; K195-Q199 WeakPolarHBondContact O-CB 3.38Å; K195-Q199 VanDerWaalsContact O-CG 3.25Å; K195-Q199 WeakPolarHBondContact O-CG 3.29Å; K195-Q199 PolarHBondContact O-N 3.31Å
196N55.4Low60.2Low104 Ų104118 Ų11856%0.55659%0.585SS**Hα-helixtrans-72-41.5176.5-76.58.6000112.2T193 A194 Q199 Q200T193-N196 PolarHBondContact O-N 3.04Å; A194-N196 VanDerWaalsContact C-N 3.34Å; A194-N196 PolarHBondContact O-N 3.16Å; N196-Q199 PolarHBondContact O-N 3.14Å; N196-Q200 VanDerWaalsContact O-CB 3.24Å; N196-Q200 WeakPolarHBondContact O-CB 3.46Å; N196-Q200 PolarHBondContact O-N 3.17Å
197S60.9Low62.4Low57 Ų57114.7 Ų114.740%0.39957%0.57SS.*Hα-helixtrans-64.5-42.717850.20000112.3A194 Q200 Q201A194-S197 PolarHBondContact O-OG 3.1Å; S197-Q200 PolarHBondContact O-N 2.94Å; S197-Q201 WeakPolarHBondContact O-CG 3.43Å; S197-Q201 PolarHBondContact O-N 3.2Å
198D65.1Low64.6Low70 Ų70114.1 Ų114.137%0.37456%0.556SS.*Hα-helixtrans-62-43.7176.3-83.824000111.9A194 H202 K228A194-D198 PolarHBondContact O-N 3.06Å; D198-H202 VanDerWaalsContact O-CB 3.26Å; D198-H202 WeakPolarHBondContact O-CB 3.2Å; D198-H202 PolarHBondContact O-N 3.41Å; D198-K228 IonicContact OD2-NZ 3.07Å; D198-K228 PolarHBondContact OD2-NZ 3.41Å
199Q72.1Confident66.9Low131 Ų131105.3 Ų105.361%0.61252%0.515SS*.Hα-helixtrans-66-40.2177.1-75.8175-8.700111.8K195 N196 H202 E203K195-Q199 WeakPolarHBondContact O-CB 3.38Å; K195-Q199 VanDerWaalsContact O-CG 3.25Å; K195-Q199 WeakPolarHBondContact O-CG 3.29Å; K195-Q199 PolarHBondContact O-N 3.31Å; N196-Q199 PolarHBondContact O-N 3.14Å; Q199-H202 PolarHBondContact O-N 3.25Å; Q199-E203 WeakPolarHBondContact O-CB 3.32Å; Q199-E203 PolarHBondContact O-N 2.93Å
200Q75.1Confident69.3Low137 Ų13799.8 Ų99.864%0.6449%0.493SS*.Hα-helixtrans-66.8-43.2179.2-169.4168.6-2.500111.7N196 S197 H202 E203 E204N196-Q200 VanDerWaalsContact O-CB 3.24Å; N196-Q200 WeakPolarHBondContact O-CB 3.46Å; N196-Q200 PolarHBondContact O-N 3.17Å; S197-Q200 PolarHBondContact O-N 2.94Å; Q200-H202 VanDerWaalsContact C-N 3.34Å; Q200-H202 PolarHBondContact O-N 3.39Å; Q200-E203 PolarHBondContact O-N 2.93Å; Q200-E204 WeakPolarHBondContact O-CB 3.48Å; Q200-E204 PolarHBondContact O-N 2.65Å
201Q77.7Confident71.7Confident135 Ų135102.1 Ų102.163%0.63150%0.499SS*.Hα-helixtrans-64.4-36.8172.5-73.7-170.8-9.200112.5S197 E204 L205S197-Q201 WeakPolarHBondContact O-CG 3.43Å; S197-Q201 PolarHBondContact O-N 3.2Å; Q201-E204 PolarHBondContact O-N 2.93Å; Q201-L205 VanDerWaalsContact O-CB 3.26Å; Q201-L205 WeakPolarHBondContact O-CB 3.1Å; Q201-L205 PolarHBondContact O-N 3.4Å
202H81.5Confident73.7Confident86 Ų86101 Ų10140%0.39849%0.493SS..Hα-helixtrans-68.2-38176.9-167.6-96.9000112D198 Q199 Q200 R206 L223D198-H202 VanDerWaalsContact O-CB 3.26Å; D198-H202 WeakPolarHBondContact O-CB 3.2Å; D198-H202 PolarHBondContact O-N 3.41Å; Q199-H202 PolarHBondContact O-N 3.25Å; Q200-H202 VanDerWaalsContact C-N 3.34Å; Q200-H202 PolarHBondContact O-N 3.39Å; H202-R206 WeakPolarHBondContact O-CB 3.17Å; H202-R206 PolarHBondContact O-N 3.26Å; H202-L223 WeakPolarHBondContact CE1-CB 3.31Å; H202-L223 WeakPolarHBondContact NE2-CA 3.26Å; H202-L223 WeakPolarHBondContact NE2-CB 3.33Å; H202-L223 PolarHBondContact NE2-O 3.06Å
203E84Confident75.7Confident100 Ų10095.6 Ų95.647%0.46749%0.487SS..Hα-helixtrans-71.6-38174.1-162.4-169.913900112.4Q199 Q200 R206 K207Q199-E203 WeakPolarHBondContact O-CB 3.32Å; Q199-E203 PolarHBondContact O-N 2.93Å; Q200-E203 PolarHBondContact O-N 2.93Å; E203-R206 WeakPolarHBondContact O-CB 3.08Å; E203-R206 PolarHBondContact O-N 3.35Å; E203-K207 WeakPolarHBondContact O-CG 3.26Å; E203-K207 PolarHBondContact O-N 3.03Å; E203-K207 WeakPolarHBondContact OE1-CE 3.43Å; E203-K207 IonicContact OE1-NZ 2.93Å; E203-K207 PolarHBondContact OE1-NZ 3.46Å
204E85.4Confident77.9Confident131 Ų13193 Ų9361%0.61247%0.466SS*.Hα-helixtrans-64.6-43.7173.7-172.5175.6-179.600111.4Q200 Q201 R206 K207 R208Q200-E204 WeakPolarHBondContact O-CB 3.48Å; Q200-E204 PolarHBondContact O-N 2.65Å; Q201-E204 PolarHBondContact O-N 2.93Å; E204-R206 VanDerWaalsContact C-N 3.35Å; E204-R206 PolarHBondContact O-N 2.69Å; E204-K207 PolarHBondContact O-N 2.96Å; E204-R208 WeakPolarHBondContact O-CB 3.17Å; E204-R208 PolarHBondContact O-N 2.92Å
205L85.6Confident79.8Confident44 Ų4495.9 Ų95.923%0.2347%0.465CS..Hα-helixtrans-59.6-43.9171.6-178.660.5000111.2Q201 K207 R208 L209 L223 L231 I234Q201-L205 VanDerWaalsContact O-CB 3.26Å; Q201-L205 WeakPolarHBondContact O-CB 3.1Å; Q201-L205 PolarHBondContact O-N 3.4Å; L205-K207 PolarHBondContact O-N 3.34Å; L205-R208 PolarHBondContact O-N 2.65Å; L205-L209 HydrophobicContact CD1-CD1 4.23Å; L205-L209 HydrophobicContact CD1-CG 4.29Å; L205-L209 HydrophobicContact CG-CD1 4.08Å; L205-L209 VanDerWaalsContact O-CG 3.24Å; L205-L209 WeakPolarHBondContact O-CG 3.22Å; L205-L209 PolarHBondContact O-N 3.09Å; L205-L223 HydrophobicContact CD2-CD2 3.9Å; L205-L223 HydrophobicContact CG-CD2 4.26Å; L205-L231 HydrophobicContact CD2-CB 4.48Å; L205-I234 HydrophobicContact CD1-CG2 4.36Å; L205-I234 HydrophobicContact CD2-CG2 4.35Å
206R88.3Confident81.5Confident97 Ų9793.2 Ų93.237%0.36646%0.464SS..Hα-helixtrans-56.8-49.4173.7-172.8-175.2-174.5171.69.1111.5H202 E203 E204 L209 L210 V219 E220 L223H202-R206 WeakPolarHBondContact O-CB 3.17Å; H202-R206 PolarHBondContact O-N 3.26Å; E203-R206 WeakPolarHBondContact O-CB 3.08Å; E203-R206 PolarHBondContact O-N 3.35Å; E204-R206 VanDerWaalsContact C-N 3.35Å; E204-R206 PolarHBondContact O-N 2.69Å; R206-L209 PolarHBondContact O-N 3.08Å; R206-L210 HydrophobicContact CG-CD1 4.13Å; R206-L210 WeakPolarHBondContact O-CG 3.35Å; R206-L210 PolarHBondContact O-N 2.7Å; R206-V219 HydrophobicContact CG-CG1 3.97Å; R206-E220 IonicContact CZ-OE2 2.65Å; R206-E220 IonicContact NH2-OE2 3.54Å; R206-E220 PolarHBondContact NH2-OE2 3.02Å; R206-L223 HydrophobicContact CB-CD1 3.64Å; R206-L223 HydrophobicContact CG-CD1 3.86Å
207K88.3Confident82.9Confident118 Ų11891 Ų9151%0.51345%0.451SS..Hα-helixtrans-59.5-48.5177.8-73.8170.6-174.4165.90110.8E203 E204 L205 L209 L210 T211E203-K207 WeakPolarHBondContact O-CG 3.26Å; E203-K207 PolarHBondContact O-N 3.03Å; E203-K207 WeakPolarHBondContact OE1-CE 3.43Å; E203-K207 IonicContact OE1-NZ 2.93Å; E203-K207 PolarHBondContact OE1-NZ 3.46Å; E204-K207 PolarHBondContact O-N 2.96Å; L205-K207 PolarHBondContact O-N 3.34Å; K207-L209 VanDerWaalsContact C-N 3.33Å; K207-L209 PolarHBondContact O-N 3.32Å; K207-L210 PolarHBondContact O-N 3.06Å; K207-T211 PolarHBondContact O-N 3.34Å; K207-T211 PolarHBondContact O-OG1 3.09Å; K207-T211 VanDerWaalsContact O-OG1 3.04Å
208R89.1Confident84.1Confident168 Ų16888.6 Ų88.663%0.63443%0.434SS*.Hα-helixtrans-58.1-41.2178.5-166.3176.4-167.6176.63.5112.9E204 L205 K212E204-R208 WeakPolarHBondContact O-CB 3.17Å; E204-R208 PolarHBondContact O-N 2.92Å; L205-R208 PolarHBondContact O-N 2.65Å; R208-K212 WeakPolarHBondContact O-CG 3.39Å; R208-K212 PolarHBondContact O-N 3.21Å; R208-K212 VanDerWaalsContact O-N 3.09Å
209L89.1Confident85.2Confident0 Ų085.3 Ų85.30%042%0.417CS..Hα-helixtrans-68.9-39.3177.4-67.8169.1000112.3L205 R206 K207 K212 Y214 V219 I234 E235 M238L205-L209 HydrophobicContact CD1-CD1 4.23Å; L205-L209 HydrophobicContact CD1-CG 4.29Å; L205-L209 HydrophobicContact CG-CD1 4.08Å; L205-L209 VanDerWaalsContact O-CG 3.24Å; L205-L209 WeakPolarHBondContact O-CG 3.22Å; L205-L209 PolarHBondContact O-N 3.09Å; R206-L209 PolarHBondContact O-N 3.08Å; K207-L209 VanDerWaalsContact C-N 3.33Å; K207-L209 PolarHBondContact O-N 3.32Å; L209-K212 PolarHBondContact O-N 3.37Å; L209-Y214 HydrophobicContact CB-CD2 4.37Å; L209-Y214 HydrophobicContact CD2-CD2 4.03Å; L209-Y214 HydrophobicContact CD2-CE2 4.06Å; L209-Y214 WeakPolarHBondContact O-CD2 3.21Å; L209-Y214 PolarHBondContact O-N 2.93Å; L209-V219 HydrophobicContact CB-CG1 4.11Å; L209-V219 HydrophobicContact CB-CG2 3.84Å; L209-V219 HydrophobicContact CD1-CG1 4.12Å; L209-I234 HydrophobicContact CD1-CD1 4.09Å; L209-I234 HydrophobicContact CD1-CG2 4.09Å; L209-I234 HydrophobicContact CD2-CG2 4.38Å; L209-E235 HydrophobicContact CD2-CG 3.49Å; L209-E235 VanDerWaalsContact CD2-CG 3.49Å; L209-M238 HydrophobicContact CB-CE 4.48Å; L209-M238 HydrophobicContact CD1-SD 3.96Å; L209-M238 HydrophobicContact CD2-CE 4.14Å; L209-M238 HydrophobicContact CD2-SD 4.09Å
210L89.4Confident86Confident68 Ų6883.4 Ų83.436%0.35641%0.408SS..Hα-helixtrans-66.7-43.3175.2-68.2171000111.6R206 K207 K212 G213 A216 V219R206-L210 HydrophobicContact CG-CD1 4.13Å; R206-L210 WeakPolarHBondContact O-CG 3.35Å; R206-L210 PolarHBondContact O-N 2.7Å; K207-L210 PolarHBondContact O-N 3.06Å; L210-K212 PolarHBondContact O-N 3.12Å; L210-G213 PolarHBondContact O-N 3.05Å; L210-A216 HydrophobicContact CD2-CB 3.78Å; L210-V219 HydrophobicContact CD2-CG2 4.33Å
211T89.1Confident86.5Confident127 Ų12780 Ų8078%0.77939%0.391SS*.Hα-helixtrans-62.4-30.7175.3-53.60000112.5K207 G213K207-T211 PolarHBondContact O-N 3.34Å; K207-T211 PolarHBondContact O-OG1 3.09Å; K207-T211 VanDerWaalsContact O-OG1 3.04Å; T211-G213 PolarHBondContact O-N 2.98Å
212K86.9Confident87Confident106 Ų10673.6 Ų73.646%0.46136%0.361SS..THydrogen-bonded Turntrans-70.2-0.4170.7-80.5-177.5168.5-173.80114.4R208 L209 L210 Y214 E235R208-K212 WeakPolarHBondContact O-CG 3.39Å; R208-K212 PolarHBondContact O-N 3.21Å; R208-K212 VanDerWaalsContact O-N 3.09Å; L209-K212 PolarHBondContact O-N 3.37Å; L210-K212 PolarHBondContact O-N 3.12Å; K212-Y214 HydrophobicContact CB-CD2 3.86Å; K212-Y214 HydrophobicContact CB-CE2 3.96Å; K212-Y214 HydrophobicContact CD-CE2 4.17Å; K212-E235 IonicContact NZ-OE1 3.17Å; K212-E235 PolarHBondContact NZ-OE1 2.88Å; K212-E235 IonicContact NZ-OE2 2.7Å; K212-E235 PolarHBondContact NZ-OE2 2.73Å
213G86.3Confident87.2Confident62 Ų6269.7 Ų69.764%0.63934%0.343SS*.THydrogen-bonded Turntrans78.719.5177.500000114.7L210 T211L210-G213 PolarHBondContact O-N 3.05Å; T211-G213 PolarHBondContact O-N 2.98Å
214Y88.5Confident87.3Confident49 Ų4974.9 Ų74.919%0.19236%0.358CS..  trans-76.4144.2169.7-67.2-74000111L209 K212 E235 M238L209-Y214 HydrophobicContact CB-CD2 4.37Å; L209-Y214 HydrophobicContact CD2-CD2 4.03Å; L209-Y214 HydrophobicContact CD2-CE2 4.06Å; L209-Y214 WeakPolarHBondContact O-CD2 3.21Å; L209-Y214 PolarHBondContact O-N 2.93Å; K212-Y214 HydrophobicContact CB-CD2 3.86Å; K212-Y214 HydrophobicContact CB-CE2 3.96Å; K212-Y214 HydrophobicContact CD-CE2 4.17Å; Y214-E235 HydrophobicContact CE2-CG 4.27Å; Y214-M238 HydrophobicContact CD1-CB 4.48Å; Y214-M238 HydrophobicContact CD1-CE 3.49Å; Y214-M238 VanDerWaalsContact CD1-CE 3.49Å; Y214-M238 HydrophobicContact CD2-CE 3.54Å; Y214-M238 HydrophobicContact CE1-CB 4.39Å; Y214-M238 HydrophobicContact CE1-CE 4.09Å; Y214-M238 HydrophobicContact CE2-CE 4.14Å; Y214-M238 HydrophobicContact CG-CE 3.18Å
215R87.3Confident87.2Confident114 Ų11471.8 Ų71.843%0.4335%0.351SS..  trans-62.8138.2178.1-66.3162.645.8174.11.4111.2D217 I218 V219 E245R215-D217 VanDerWaalsContact C-N 3.31Å; R215-D217 WeakPolarHBondContact CB-OD1 3.48Å; R215-D217 IonicContact CZ-OD1 2.73Å; R215-D217 IonicContact CZ-OD2 2.71Å; R215-D217 IonicContact NE-OD1 3.5Å; R215-D217 PolarHBondContact NE-OD1 2.89Å; R215-D217 IonicContact NE-OD2 3.32Å; R215-D217 IonicContact NH2-OD1 3.52Å; R215-D217 IonicContact NH2-OD2 3.98Å; R215-D217 PolarHBondContact NH2-OD2 2.71Å; R215-D217 PolarHBondContact O-N 2.92Å; R215-I218 HydrophobicContact CB-CB 4.47Å; R215-I218 HydrophobicContact CB-CD1 4.16Å; R215-I218 HydrophobicContact CB-CG1 4.25Å; R215-I218 HydrophobicContact CG-CD1 4.46Å; R215-I218 PolarHBondContact O-N 3.24Å; R215-V219 WeakPolarHBondContact O-CG2 3.45Å; R215-V219 PolarHBondContact O-N 3.09Å; R215-E245 IonicContact CZ-OE1 3.98Å; R215-E245 IonicContact CZ-OE2 3.14Å; R215-E245 IonicContact NH1-OE1 2.75Å; R215-E245 PolarHBondContact NH1-OE1 3.3Å; R215-E245 IonicContact NH1-OE2 2.72Å; R215-E245 PolarHBondContact NH1-OE2 3.28Å; R215-E245 IonicContact NH2-OE1 2.97Å
216A85.5Confident87.2Confident54 Ų5470.3 Ų70.345%0.44634%0.343SS..Hα-helixtrans-62.1-34.6-176.600000113.8L210 V219 E220L210-A216 HydrophobicContact CD2-CB 3.78Å; A216-V219 PolarHBondContact O-N 2.77Å; A216-E220 VanDerWaalsContact O-CB 3.31Å; A216-E220 WeakPolarHBondContact O-CB 3.48Å; A216-E220 PolarHBondContact O-N 3.47Å
217D86.6Confident87Confident56 Ų5668.2 Ų68.230%0.29934%0.342SS..Hα-helixtrans-67.3-40.7177.968.7-43.6000112.4R215 K221R215-D217 VanDerWaalsContact C-N 3.31Å; R215-D217 WeakPolarHBondContact CB-OD1 3.48Å; R215-D217 IonicContact CZ-OD1 2.73Å; R215-D217 IonicContact CZ-OD2 2.71Å; R215-D217 IonicContact NE-OD1 3.5Å; R215-D217 PolarHBondContact NE-OD1 2.89Å; R215-D217 IonicContact NE-OD2 3.32Å; R215-D217 IonicContact NH2-OD1 3.52Å; R215-D217 IonicContact NH2-OD2 3.98Å; R215-D217 PolarHBondContact NH2-OD2 2.71Å; R215-D217 PolarHBondContact O-N 2.92Å; D217-K221 WeakPolarHBondContact O-CB 3.43Å; D217-K221 VanDerWaalsContact O-CG 3.27Å; D217-K221 WeakPolarHBondContact O-CG 3.4Å; D217-K221 PolarHBondContact O-N 3.02Å
218I85.6Confident86.7Confident8 Ų869.8 Ų69.84%0.04135%0.349CS..Hα-helixtrans-63.5-47.4172.8-64.8175.6000110.2R215 A222 M238 I252R215-I218 HydrophobicContact CB-CB 4.47Å; R215-I218 HydrophobicContact CB-CD1 4.16Å; R215-I218 HydrophobicContact CB-CG1 4.25Å; R215-I218 HydrophobicContact CG-CD1 4.46Å; R215-I218 PolarHBondContact O-N 3.24Å; I218-A222 WeakPolarHBondContact O-CB 3.36Å; I218-A222 PolarHBondContact O-N 3.36Å; I218-M238 HydrophobicContact CG2-CB 3.87Å; I218-M238 HydrophobicContact CG2-CE 4.23Å; I218-M238 HydrophobicContact CG2-CG 3.71Å; I218-I252 HydrophobicContact CD1-CD1 3.87Å; I218-I252 HydrophobicContact CD1-CG1 4.28Å; I218-I252 HydrophobicContact CG1-CD1 3.4Å; I218-I252 VanDerWaalsContact CG1-CD1 3.4Å; I218-I252 HydrophobicContact CG1-CG1 3.93Å; I218-I252 HydrophobicContact CG1-CG2 4.35Å
219V88.6Confident86.3Confident0 Ų066.5 Ų66.50%035%0.351CS..Hα-helixtrans-60.5-47.9-179.71720000110.9R206 L209 L210 R215 A216 A222 L223 M238R206-V219 HydrophobicContact CG-CG1 3.97Å; L209-V219 HydrophobicContact CB-CG1 4.11Å; L209-V219 HydrophobicContact CB-CG2 3.84Å; L209-V219 HydrophobicContact CD1-CG1 4.12Å; L210-V219 HydrophobicContact CD2-CG2 4.33Å; R215-V219 WeakPolarHBondContact O-CG2 3.45Å; R215-V219 PolarHBondContact O-N 3.09Å; A216-V219 PolarHBondContact O-N 2.77Å; V219-A222 PolarHBondContact O-N 2.73Å; V219-L223 HydrophobicContact CG1-CD1 3.66Å; V219-L223 HydrophobicContact CG1-CG 4.38Å; V219-L223 VanDerWaalsContact O-CB 3.27Å; V219-L223 WeakPolarHBondContact O-CB 3.35Å; V219-L223 VanDerWaalsContact O-CG 3.26Å; V219-L223 WeakPolarHBondContact O-CG 3.29Å; V219-L223 PolarHBondContact O-N 3.17Å; V219-M238 HydrophobicContact CG2-CE 3.49Å; V219-M238 VanDerWaalsContact CG2-CE 3.49Å; V219-M238 HydrophobicContact CG2-SD 4.3Å
220E87.9Confident86Confident91 Ų9167.6 Ų67.643%0.42536%0.356SS..Hα-helixtrans-67.8-42.1-177.6-171.6165.1161.300112.3R206 A216 R224R206-E220 IonicContact CZ-OE2 2.65Å; R206-E220 IonicContact NH2-OE2 3.54Å; R206-E220 PolarHBondContact NH2-OE2 3.02Å; A216-E220 VanDerWaalsContact O-CB 3.31Å; A216-E220 WeakPolarHBondContact O-CB 3.48Å; A216-E220 PolarHBondContact O-N 3.47Å; E220-R224 VanDerWaalsContact O-CB 3.22Å; E220-R224 WeakPolarHBondContact O-CB 3.15Å; E220-R224 PolarHBondContact O-N 3.23Å
221K86.5Confident85.8Confident65 Ų6565.8 Ų65.828%0.28335%0.346SS..Hα-helixtrans-65.5-44.4174.4-71.6174-179.4-179.50111.9D217 R224 C225 I252 D253 L256D217-K221 WeakPolarHBondContact O-CB 3.43Å; D217-K221 VanDerWaalsContact O-CG 3.27Å; D217-K221 WeakPolarHBondContact O-CG 3.4Å; D217-K221 PolarHBondContact O-N 3.02Å; K221-R224 PolarHBondContact O-N 3.26Å; K221-C225 VanDerWaalsContact O-CB 3.31Å; K221-C225 WeakPolarHBondContact O-CB 3.39Å; K221-C225 PolarHBondContact O-N 3.02Å; K221-C225 PolarHBondContact O-SG 3.49Å; K221-C225 VanDerWaalsContact O-SG 3.41Å; K221-I252 HydrophobicContact CD-CG2 4.37Å; K221-D253 VanDerWaalsContact CD-OD1 3.31Å; K221-D253 WeakPolarHBondContact CD-OD1 3.5Å; K221-D253 WeakPolarHBondContact CE-OD1 3.37Å; K221-D253 IonicContact NZ-OD1 3.69Å; K221-D253 PolarHBondContact NZ-OD1 3.32Å; K221-D253 IonicContact NZ-OD2 3.62Å; K221-D253 PolarHBondContact NZ-OD2 2.96Å; K221-L256 HydrophobicContact CB-CD2 4.05Å
222A87.1Confident85.6Confident1 Ų165.4 Ų65.41%0.00834%0.344CS..Hα-helixtrans-60.4-49.517700000111.5I218 V219 R224 C225 L226 I234 M238 L256I218-A222 WeakPolarHBondContact O-CB 3.36Å; I218-A222 PolarHBondContact O-N 3.36Å; V219-A222 PolarHBondContact O-N 2.73Å; A222-R224 VanDerWaalsContact C-N 3.29Å; A222-R224 PolarHBondContact O-N 3.32Å; A222-C225 PolarHBondContact O-N 3.37Å; A222-L226 WeakPolarHBondContact O-CB 3.25Å; A222-L226 PolarHBondContact O-N 3.05Å; A222-I234 HydrophobicContact CB-CD1 3.89Å; A222-I234 HydrophobicContact CB-CG1 3.91Å; A222-M238 HydrophobicContact CB-CG 3.85Å; A222-M238 HydrophobicContact CB-SD 4.21Å; A222-L256 HydrophobicContact CB-CD2 4.44Å
223L86.8Confident85.7Confident5 Ų563 Ų633%0.02633%0.334CS..Hα-helixtrans-64.4-29.2179.3-76.7172.5000114H202 L205 R206 V219 L231 I234H202-L223 WeakPolarHBondContact CE1-CB 3.31Å; H202-L223 WeakPolarHBondContact NE2-CA 3.26Å; H202-L223 WeakPolarHBondContact NE2-CB 3.33Å; H202-L223 PolarHBondContact NE2-O 3.06Å; L205-L223 HydrophobicContact CD2-CD2 3.9Å; L205-L223 HydrophobicContact CG-CD2 4.26Å; R206-L223 HydrophobicContact CB-CD1 3.64Å; R206-L223 HydrophobicContact CG-CD1 3.86Å; V219-L223 HydrophobicContact CG1-CD1 3.66Å; V219-L223 HydrophobicContact CG1-CG 4.38Å; V219-L223 VanDerWaalsContact O-CB 3.27Å; V219-L223 WeakPolarHBondContact O-CB 3.35Å; V219-L223 VanDerWaalsContact O-CG 3.26Å; V219-L223 WeakPolarHBondContact O-CG 3.29Å; V219-L223 PolarHBondContact O-N 3.17Å; L223-L231 HydrophobicContact CD2-CD2 4.2Å; L223-I234 HydrophobicContact CD2-CD1 3.48Å; L223-I234 VanDerWaalsContact CD2-CD1 3.48Å; L223-I234 HydrophobicContact CG-CD1 3.74Å
224R85.8Confident85.9Confident208 Ų20860.1 Ų60.179%0.78530%0.304SS*.Hα-helixtrans-83.8-31.6179.3-168.8175.4-171.21621113.2E220 K221 A222E220-R224 VanDerWaalsContact O-CB 3.22Å; E220-R224 WeakPolarHBondContact O-CB 3.15Å; E220-R224 PolarHBondContact O-N 3.23Å; K221-R224 PolarHBondContact O-N 3.26Å; A222-R224 VanDerWaalsContact C-N 3.29Å; A222-R224 PolarHBondContact O-N 3.32Å
225C83.9Confident86Confident67 Ų6760.2 Ų60.245%0.45331%0.306SS..Hα-helixtrans-101-23.4-174.4-62.70000114.3K221 A222 L256 I260K221-C225 VanDerWaalsContact O-CB 3.31Å; K221-C225 WeakPolarHBondContact O-CB 3.39Å; K221-C225 PolarHBondContact O-N 3.02Å; K221-C225 PolarHBondContact O-SG 3.49Å; K221-C225 VanDerWaalsContact O-SG 3.41Å; A222-C225 PolarHBondContact O-N 3.37Å; C225-L256 HydrophobicContact CB-CD2 4.24Å; C225-I260 HydrophobicContact CB-CD1 3.75Å
226L85.2Confident86.3Confident13 Ų1357.9 Ų57.97%0.06830%0.297CS..SBendtrans-72.1137.3177.7-106.170.3000112.2A222 R230 L231 I234 Y237 L256 I260A222-L226 WeakPolarHBondContact O-CB 3.25Å; A222-L226 PolarHBondContact O-N 3.05Å; L226-R230 HydrophobicContact CD2-CB 4.24Å; L226-R230 WeakPolarHBondContact CD2-O 3.39Å; L226-R230 HydrophobicContact CG-CB 4.45Å; L226-L231 HydrophobicContact CB-CD2 3.88Å; L226-L231 HydrophobicContact CD2-CD2 4.33Å; L226-I234 HydrophobicContact CD2-CB 4.03Å; L226-I234 HydrophobicContact CD2-CG1 4.08Å; L226-Y237 HydrophobicContact CD1-CD1 4.4Å; L226-Y237 HydrophobicContact CD1-CD2 4.36Å; L226-Y237 HydrophobicContact CD1-CG 4.09Å; L226-Y237 HydrophobicContact CD2-CD2 3.74Å; L226-Y237 HydrophobicContact CD2-CE2 4.21Å; L226-Y237 HydrophobicContact CD2-CG 4.27Å; L226-Y237 HydrophobicContact CG-CD2 4.45Å; L226-L256 HydrophobicContact CD1-CD1 3.88Å; L226-I260 HydrophobicContact CD1-CD1 4.11Å; L226-I260 HydrophobicContact CD1-CG1 4.08Å
227P83.6Confident86.5Confident53 Ų5355.3 Ų55.334%0.34428%0.276SS..  trans-59.9143.5163.5-21.833.3000111.6S229 R230 L231P227-S229 PolarHBondContact O-N 2.83Å; P227-S229 VanDerWaalsContact O-N 3.11Å; P227-R230 PolarHBondContact O-N 2.9Å; P227-L231 PolarHBondContact O-N 3.25Å
228K82.2Confident86.7Confident150 Ų15052.7 Ų52.765%0.65226%0.262SS*.G310 helixtrans-49.5-41179.6-71.7-170.8176.7-175.60113.4D198 R230 L231D198-K228 IonicContact OD2-NZ 3.07Å; D198-K228 PolarHBondContact OD2-NZ 3.41Å; K228-R230 PolarHBondContact O-N 3.32Å; K228-L231 WeakPolarHBondContact O-CB 3.44Å; K228-L231 PolarHBondContact O-N 3.45Å
229S81.4Confident87.1Confident99 Ų9957.6 Ų57.669%0.69228%0.283SS*.G310 helixtrans-62.4-24.2178.451.60000114.5P227P227-S229 PolarHBondContact O-N 2.83Å; P227-S229 VanDerWaalsContact O-N 3.11Å
230R81.8Confident87.2Confident24 Ų2457.6 Ų57.69%0.09128%0.283CS..G310 helixtrans-99.9-4.3-178.1-67.2166.885-170.1-3.4112.8L226 P227 K228 V232 H233 Y237 L259 I260 N263 L264L226-R230 HydrophobicContact CD2-CB 4.24Å; L226-R230 WeakPolarHBondContact CD2-O 3.39Å; L226-R230 HydrophobicContact CG-CB 4.45Å; P227-R230 PolarHBondContact O-N 2.9Å; K228-R230 PolarHBondContact O-N 3.32Å; R230-V232 PolarHBondContact O-N 2.74Å; R230-H233 PolarHBondContact O-N 3.37Å; R230-Y237 PolarHBondContact NE-OH 3.23Å; R230-Y237 VanDerWaalsContact NE-OH 3.16Å; R230-Y237 PolarHBondContact NH2-OH 3.03Å; R230-L259 PolarHBondContact NH2-O 3.14Å; R230-I260 PolarHBondContact NH1-O 3.24Å; R230-I260 PolarHBondContact NH2-O 2.93Å; R230-N263 PolarHBondContact NH1-OD1 3.02Å; R230-L264 PolarHBondContact NE-O 3.06Å; R230-L264 PolarHBondContact NH2-O 2.9Å; R230-L264 VanDerWaalsContact NH2-O 3.17Å
231L84.4Confident87.4Confident30 Ų3053.3 Ų53.316%0.15726%0.263CS..G310 helixtrans-59.3-27.5176.5-68.8176.6000112.8L205 L223 L226 P227 K228 H233 I234L205-L231 HydrophobicContact CD2-CB 4.48Å; L223-L231 HydrophobicContact CD2-CD2 4.2Å; L226-L231 HydrophobicContact CB-CD2 3.88Å; L226-L231 HydrophobicContact CD2-CD2 4.33Å; P227-L231 PolarHBondContact O-N 3.25Å; K228-L231 WeakPolarHBondContact O-CB 3.44Å; K228-L231 PolarHBondContact O-N 3.45Å; L231-H233 PolarHBondContact O-N 3.32Å; L231-H233 VanDerWaalsContact O-N 3.1Å; L231-I234 HydrophobicContact CD2-CD1 3.98Å; L231-I234 WeakPolarHBondContact O-CB 3.39Å; L231-I234 WeakPolarHBondContact O-CG2 3.5Å; L231-I234 PolarHBondContact O-N 3.48Å
232V86.5Confident87.6Confident119 Ų11957 Ų5772%0.72128%0.275SS*.G310 helixtrans-54.7-27.2171.7-172.80000112.3R230R230-V232 PolarHBondContact O-N 2.74Å
233H88.6Confident87.8Confident54 Ų5458.8 Ų58.825%0.2529%0.286CS..G310 helixtrans-111.413.8-179.1-59.4-31.4000113.4R230 L231 E235 Y236 Y237 S265 I270R230-H233 PolarHBondContact O-N 3.37Å; L231-H233 PolarHBondContact O-N 3.32Å; L231-H233 VanDerWaalsContact O-N 3.1Å; H233-E235 VanDerWaalsContact C-N 3.26Å; H233-E235 PolarHBondContact O-N 3.37Å; H233-Y236 HydrophobicContact CB-CD2 4.06Å; H233-Y236 WeakPolarHBondContact O-CA 3.49Å; H233-Y236 WeakPolarHBondContact O-CB 3.32Å; H233-Y236 PolarHBondContact O-N 2.7Å; H233-Y237 HydrophobicContact CB-CD2 4.45Å; H233-Y237 HydrophobicContact CB-CE2 4.12Å; H233-Y237 VanDerWaalsContact O-CD2 3.31Å; H233-Y237 WeakPolarHBondContact O-CD2 3.15Å; H233-Y237 PolarHBondContact O-N 2.94Å; H233-S265 PolarHBondContact CD2-O 2.7Å; H233-S265 VanDerWaalsContact CD2-O 3.23Å; H233-S265 PolarHBondContact NE2-O 3.22Å; H233-I270 HydrophobicContact CB-CD1 4Å
234I90Very high88Confident3 Ų358.6 Ų58.62%0.01529%0.285CS..Hα-helixtrans-53.7-39.8-175.5-167.6167.2000113.2L205 L209 A222 L223 L226 L231 Y236 Y237 M238L205-I234 HydrophobicContact CD1-CG2 4.36Å; L205-I234 HydrophobicContact CD2-CG2 4.35Å; L209-I234 HydrophobicContact CD1-CD1 4.09Å; L209-I234 HydrophobicContact CD1-CG2 4.09Å; L209-I234 HydrophobicContact CD2-CG2 4.38Å; A222-I234 HydrophobicContact CB-CD1 3.89Å; A222-I234 HydrophobicContact CB-CG1 3.91Å; L223-I234 HydrophobicContact CD2-CD1 3.48Å; L223-I234 VanDerWaalsContact CD2-CD1 3.48Å; L223-I234 HydrophobicContact CG-CD1 3.74Å; L226-I234 HydrophobicContact CD2-CB 4.03Å; L226-I234 HydrophobicContact CD2-CG1 4.08Å; L231-I234 HydrophobicContact CD2-CD1 3.98Å; L231-I234 WeakPolarHBondContact O-CB 3.39Å; L231-I234 WeakPolarHBondContact O-CG2 3.5Å; L231-I234 PolarHBondContact O-N 3.48Å; I234-Y236 PolarHBondContact O-N 2.83Å; I234-Y237 PolarHBondContact O-N 2.87Å; I234-Y237 VanDerWaalsContact O-N 3.14Å; I234-M238 HydrophobicContact CD1-SD 4.39Å; I234-M238 HydrophobicContact CG1-CG 4.28Å; I234-M238 HydrophobicContact CG1-SD 3.84Å; I234-M238 VanDerWaalsContact O-CG 3.26Å; I234-M238 WeakPolarHBondContact O-CG 3.16Å; I234-M238 PolarHBondContact O-N 3.49Å
235E91Very high88.2Confident50 Ų5051 Ų5123%0.23426%0.259CS..Hα-helixtrans-59.7-33.9177.2-69-169.1-145.300112.5L209 K212 Y214 H233 K239L209-E235 HydrophobicContact CD2-CG 3.49Å; L209-E235 VanDerWaalsContact CD2-CG 3.49Å; K212-E235 IonicContact NZ-OE1 3.17Å; K212-E235 PolarHBondContact NZ-OE1 2.88Å; K212-E235 IonicContact NZ-OE2 2.7Å; K212-E235 PolarHBondContact NZ-OE2 2.73Å; Y214-E235 HydrophobicContact CE2-CG 4.27Å; H233-E235 VanDerWaalsContact C-N 3.26Å; H233-E235 PolarHBondContact O-N 3.37Å; E235-K239 VanDerWaalsContact O-CB 3.26Å; E235-K239 WeakPolarHBondContact O-CB 3.43Å; E235-K239 PolarHBondContact O-N 2.86Å
236Y92.4Very high88.5Confident65 Ų6555.6 Ų55.626%0.25527%0.271SS..Hα-helixtrans-75.8-36.1177.5-55.6-63.3000112H233 I234 K239 A240 K267 L271H233-Y236 HydrophobicContact CB-CD2 4.06Å; H233-Y236 WeakPolarHBondContact O-CA 3.49Å; H233-Y236 WeakPolarHBondContact O-CB 3.32Å; H233-Y236 PolarHBondContact O-N 2.7Å; I234-Y236 PolarHBondContact O-N 2.83Å; Y236-K239 PolarHBondContact O-N 2.97Å; Y236-A240 WeakPolarHBondContact O-CB 3.35Å; Y236-A240 PolarHBondContact O-N 2.75Å; Y236-K267 HydrophobicContact CD1-CD 4.39Å; Y236-K267 HydrophobicContact CD1-CG 3.81Å; Y236-K267 HydrophobicContact CD2-CB 3.94Å; Y236-K267 HydrophobicContact CD2-CD 4.48Å; Y236-K267 HydrophobicContact CD2-CG 3.96Å; Y236-K267 HydrophobicContact CE1-CD 3.74Å; Y236-K267 HydrophobicContact CE1-CG 3.67Å; Y236-K267 HydrophobicContact CE2-CB 4.01Å; Y236-K267 HydrophobicContact CE2-CD 3.85Å; Y236-K267 HydrophobicContact CE2-CG 3.83Å; Y236-K267 HydrophobicContact CG-CB 4.25Å; Y236-K267 HydrophobicContact CG-CG 3.95Å; Y236-K267 VanDerWaalsContact CZ-CD 3.43Å; Y236-K267 WeakPolarHBondContact OH-CD 3.42Å; Y236-K267 WeakPolarHBondContact OH-CE 3.38Å; Y236-K267 PolarHBondContact OH-NZ 3.06Å; Y236-L271 HydrophobicContact CD1-CD1 4.18Å; Y236-L271 HydrophobicContact CD1-CD2 4.5Å; Y236-L271 HydrophobicContact CD1-CG 4.47Å
237Y90.9Very high88.6Confident0 Ų056.3 Ų56.30%028%0.276CS..Hα-helixtrans-62.1-43.4169.6-74.5-83.1000111.9L226 R230 H233 I234 A240 C241 L259 L264 I270L226-Y237 HydrophobicContact CD1-CD1 4.4Å; L226-Y237 HydrophobicContact CD1-CD2 4.36Å; L226-Y237 HydrophobicContact CD1-CG 4.09Å; L226-Y237 HydrophobicContact CD2-CD2 3.74Å; L226-Y237 HydrophobicContact CD2-CE2 4.21Å; L226-Y237 HydrophobicContact CD2-CG 4.27Å; L226-Y237 HydrophobicContact CG-CD2 4.45Å; R230-Y237 PolarHBondContact NE-OH 3.23Å; R230-Y237 VanDerWaalsContact NE-OH 3.16Å; R230-Y237 PolarHBondContact NH2-OH 3.03Å; H233-Y237 HydrophobicContact CB-CD2 4.45Å; H233-Y237 HydrophobicContact CB-CE2 4.12Å; H233-Y237 VanDerWaalsContact O-CD2 3.31Å; H233-Y237 WeakPolarHBondContact O-CD2 3.15Å; H233-Y237 PolarHBondContact O-N 2.94Å; I234-Y237 PolarHBondContact O-N 2.87Å; I234-Y237 VanDerWaalsContact O-N 3.14Å; Y237-A240 WeakPolarHBondContact O-CB 3.25Å; Y237-A240 PolarHBondContact O-N 2.9Å; Y237-C241 WeakPolarHBondContact O-CB 3.48Å; Y237-C241 PolarHBondContact O-N 2.72Å; Y237-C241 PolarHBondContact O-SG 2.97Å; Y237-L259 HydrophobicContact CD1-CB 3.87Å; Y237-L259 HydrophobicContact CD1-CD1 4.45Å; Y237-L259 HydrophobicContact CE1-CB 3.92Å; Y237-L264 PolarHBondContact OH-O 2.95Å; Y237-I270 HydrophobicContact CD1-CG2 4.34Å; Y237-I270 HydrophobicContact CD2-CD1 4.13Å; Y237-I270 HydrophobicContact CE1-CD1 4.39Å; Y237-I270 HydrophobicContact CE1-CG1 4.24Å; Y237-I270 HydrophobicContact CE1-CG2 4.39Å; Y237-I270 HydrophobicContact CE2-CD1 3.41Å; Y237-I270 VanDerWaalsContact CE2-CD1 3.41Å; Y237-I270 HydrophobicContact CE2-CG1 4.15Å; Y237-I270 HydrophobicContact CG-CG2 4.45Å; Y237-I270 WeakPolarHBondContact OH-CD1 3.25Å
238M91.1Very high88.6Confident2 Ų257.3 Ų57.31%0.0130%0.296CS..Hα-helixtrans-67.7-40.2178.9-65171.542.100111.5L209 Y214 I218 V219 A222 I234 C241 R242L209-M238 HydrophobicContact CB-CE 4.48Å; L209-M238 HydrophobicContact CD1-SD 3.96Å; L209-M238 HydrophobicContact CD2-CE 4.14Å; L209-M238 HydrophobicContact CD2-SD 4.09Å; Y214-M238 HydrophobicContact CD1-CB 4.48Å; Y214-M238 HydrophobicContact CD1-CE 3.49Å; Y214-M238 VanDerWaalsContact CD1-CE 3.49Å; Y214-M238 HydrophobicContact CD2-CE 3.54Å; Y214-M238 HydrophobicContact CE1-CB 4.39Å; Y214-M238 HydrophobicContact CE1-CE 4.09Å; Y214-M238 HydrophobicContact CE2-CE 4.14Å; Y214-M238 HydrophobicContact CG-CE 3.18Å; I218-M238 HydrophobicContact CG2-CB 3.87Å; I218-M238 HydrophobicContact CG2-CE 4.23Å; I218-M238 HydrophobicContact CG2-CG 3.71Å; V219-M238 HydrophobicContact CG2-CE 3.49Å; V219-M238 VanDerWaalsContact CG2-CE 3.49Å; V219-M238 HydrophobicContact CG2-SD 4.3Å; A222-M238 HydrophobicContact CB-CG 3.85Å; A222-M238 HydrophobicContact CB-SD 4.21Å; I234-M238 HydrophobicContact CD1-SD 4.39Å; I234-M238 HydrophobicContact CG1-CG 4.28Å; I234-M238 HydrophobicContact CG1-SD 3.84Å; I234-M238 VanDerWaalsContact O-CG 3.26Å; I234-M238 WeakPolarHBondContact O-CG 3.16Å; I234-M238 PolarHBondContact O-N 3.49Å; M238-C241 PolarHBondContact O-N 2.75Å; M238-R242 WeakPolarHBondContact O-CB 3.36Å; M238-R242 PolarHBondContact O-N 3.49Å
239K92.4Very high88.6Confident111 Ų11155.2 Ų55.248%0.48329%0.287SS..Hα-helixtrans-63.5-43.8172.8-172.7173.4178.7-176.30111.5E235 Y236 R242 T243 L271E235-K239 VanDerWaalsContact O-CB 3.26Å; E235-K239 WeakPolarHBondContact O-CB 3.43Å; E235-K239 PolarHBondContact O-N 2.86Å; Y236-K239 PolarHBondContact O-N 2.97Å; K239-R242 PolarHBondContact O-N 3.07Å; K239-T243 PolarHBondContact O-N 3.15Å; K239-T243 PolarHBondContact O-OG1 3Å; K239-T243 VanDerWaalsContact O-OG1 3.1Å; K239-L271 HydrophobicContact CB-CD2 4.18Å; K239-L271 HydrophobicContact CD-CD2 3.89Å; K239-L271 HydrophobicContact CG-CD2 3.98Å
240A92.2Very high88.8Confident0 Ų051 Ų510%026%0.257CS..Hα-helixtrans-59.9-47.8175.200000112.5Y236 Y237 R242 T243 V244 L259 I270 S274Y236-A240 WeakPolarHBondContact O-CB 3.35Å; Y236-A240 PolarHBondContact O-N 2.75Å; Y237-A240 WeakPolarHBondContact O-CB 3.25Å; Y237-A240 PolarHBondContact O-N 2.9Å; A240-R242 VanDerWaalsContact C-N 3.3Å; A240-R242 PolarHBondContact O-N 2.86Å; A240-T243 WeakPolarHBondContact O-CB 3.26Å; A240-T243 PolarHBondContact O-N 2.87Å; A240-T243 VanDerWaalsContact O-N 3.16Å; A240-V244 PolarHBondContact O-N 2.98Å; A240-V244 VanDerWaalsContact O-N 3.12Å; A240-L259 HydrophobicContact CB-CD1 3.62Å; A240-I270 HydrophobicContact CB-CG2 3.87Å; A240-S274 VanDerWaalsContact CA-CB 3.44Å
241C91.7Very high89Confident1 Ų151.8 Ų51.81%0.00727%0.267CS..Hα-helixtrans-57.1-44174.1-670000111.1Y237 M238 T243 V244 E245Y237-C241 WeakPolarHBondContact O-CB 3.48Å; Y237-C241 PolarHBondContact O-N 2.72Å; Y237-C241 PolarHBondContact O-SG 2.97Å; M238-C241 PolarHBondContact O-N 2.75Å; C241-T243 PolarHBondContact O-N 3.5Å; C241-V244 PolarHBondContact O-N 3.28Å; C241-E245 VanDerWaalsContact O-CB 3.25Å; C241-E245 WeakPolarHBondContact O-CB 3.49Å; C241-E245 PolarHBondContact O-N 3.43Å
242R90.9Very high89.1Confident141 Ų14150.7 Ų50.753%0.53226%0.261SS..Hα-helixtrans-65.1-35.8176.9-166.5178.5-175.5-175.82.5113M238 K239 A240 V244 K246M238-R242 WeakPolarHBondContact O-CB 3.36Å; M238-R242 PolarHBondContact O-N 3.49Å; K239-R242 PolarHBondContact O-N 3.07Å; A240-R242 VanDerWaalsContact C-N 3.3Å; A240-R242 PolarHBondContact O-N 2.86Å; R242-V244 VanDerWaalsContact C-N 3.34Å; R242-K246 WeakPolarHBondContact O-CB 3.46Å; R242-K246 VanDerWaalsContact O-CG 3.24Å; R242-K246 WeakPolarHBondContact O-CG 3.1Å; R242-K246 PolarHBondContact O-N 3.43Å
243T91.6Very high89Confident39 Ų3949.4 Ų49.424%0.23925%0.25CC..Hα-helixtrans-65.1-36.5175.9-63.40000112.4K239 A240 C241 S278K239-T243 PolarHBondContact O-N 3.15Å; K239-T243 PolarHBondContact O-OG1 3Å; K239-T243 VanDerWaalsContact O-OG1 3.1Å; A240-T243 WeakPolarHBondContact O-CB 3.26Å; A240-T243 PolarHBondContact O-N 2.87Å; A240-T243 VanDerWaalsContact O-N 3.16Å; C241-T243 PolarHBondContact O-N 3.5Å; T243-S278 PolarHBondContact O-OG 3.1Å; T243-S278 VanDerWaalsContact O-OG 3.1Å
244V90.4Very high88.9Confident1 Ų150.3 Ų50.31%0.00625%0.254CS..Hα-helixtrans-78.9-45.1176.7173.20000111.2A240 C241 R242 K246 T247 T255 S274 C277 L281A240-V244 PolarHBondContact O-N 2.98Å; A240-V244 VanDerWaalsContact O-N 3.12Å; C241-V244 PolarHBondContact O-N 3.28Å; R242-V244 VanDerWaalsContact C-N 3.34Å; V244-K246 VanDerWaalsContact C-N 3.27Å; V244-K246 PolarHBondContact O-N 3.48Å; V244-T247 WeakPolarHBondContact O-CB 3.23Å; V244-T247 WeakPolarHBondContact O-CG2 3.33Å; V244-T247 PolarHBondContact O-N 3.01Å; V244-T247 PolarHBondContact O-OG1 3.03Å; V244-T255 HydrophobicContact CB-CG2 3.79Å; V244-T255 HydrophobicContact CG1-CG2 3.81Å; V244-T255 WeakPolarHBondContact CG1-OG1 3.24Å; V244-T255 HydrophobicContact CG2-CG2 3.9Å; V244-S274 WeakPolarHBondContact CG2-O 3.39Å; V244-C277 HydrophobicContact CG2-CB 3.97Å; V244-L281 HydrophobicContact CG1-CD1 3.7Å
245E90.6Very high88.9Confident50 Ų5050.1 Ų50.123%0.23425%0.253CS..Hα-helixtrans-59.1-36177.8-173.9-177.1-143.800112.2R215 C241 T247 G248 I252R215-E245 IonicContact CZ-OE1 3.98Å; R215-E245 IonicContact CZ-OE2 3.14Å; R215-E245 IonicContact NH1-OE1 2.75Å; R215-E245 PolarHBondContact NH1-OE1 3.3Å; R215-E245 IonicContact NH1-OE2 2.72Å; R215-E245 PolarHBondContact NH1-OE2 3.28Å; R215-E245 IonicContact NH2-OE1 2.97Å; C241-E245 VanDerWaalsContact O-CB 3.25Å; C241-E245 WeakPolarHBondContact O-CB 3.49Å; C241-E245 PolarHBondContact O-N 3.43Å; E245-T247 PolarHBondContact O-N 3.44Å; E245-G248 PolarHBondContact O-N 2.86Å; E245-I252 VanDerWaalsContact OE1-CD1 3.22Å; E245-I252 WeakPolarHBondContact OE1-CD1 3.44Å
246K90.2Very high88.8Confident163 Ų16348 Ų4871%0.70924%0.244SC*.THydrogen-bonded Turntrans-54.7-17.7172.9-86.9178.4178.1-169.80114.9R242 V244 G248R242-K246 WeakPolarHBondContact O-CB 3.46Å; R242-K246 VanDerWaalsContact O-CG 3.24Å; R242-K246 WeakPolarHBondContact O-CG 3.1Å; R242-K246 PolarHBondContact O-N 3.43Å; V244-K246 VanDerWaalsContact C-N 3.27Å; V244-K246 PolarHBondContact O-N 3.48Å; K246-G248 VanDerWaalsContact C-N 3.29Å
247T87.1Confident88.7Confident28 Ų2848 Ų4817%0.17225%0.251CS..THydrogen-bonded Turntrans-76.7-15.1174.566.70000113.5V244 E245 K249 S278 L281 K282V244-T247 WeakPolarHBondContact O-CB 3.23Å; V244-T247 WeakPolarHBondContact O-CG2 3.33Å; V244-T247 PolarHBondContact O-N 3.01Å; V244-T247 PolarHBondContact O-OG1 3.03Å; E245-T247 PolarHBondContact O-N 3.44Å; T247-K249 PolarHBondContact O-N 2.99Å; T247-K249 PolarHBondContact OG1-N 2.87Å; T247-S278 VanDerWaalsContact CG2-OG 3.25Å; T247-S278 WeakPolarHBondContact CG2-OG 3.39Å; T247-L281 HydrophobicContact CG2-CB 4.11Å; T247-L281 HydrophobicContact CG2-CD1 4.47Å; T247-K282 HydrophobicContact CG2-CG 4.36Å
248G83.3Confident88.7Confident74 Ų7448.5 Ų48.576%0.76325%0.254SS*.SBendtrans70.4-0.9-173.100000115E245 K246E245-G248 PolarHBondContact O-N 2.86Å; K246-G248 VanDerWaalsContact C-N 3.29Å
249K83.1Confident88.6Confident106 Ų10648.4 Ų48.446%0.46125%0.253SS..SBendtrans-107.61.7-171.8-65.3179.7-174.4-175.30114.7T247 L281T247-K249 PolarHBondContact O-N 2.99Å; T247-K249 PolarHBondContact OG1-N 2.87Å; K249-L281 HydrophobicContact CB-CB 4.49Å; K249-L281 HydrophobicContact CB-CD2 3.95Å; K249-L281 HydrophobicContact CD-CB 4.47Å; K249-L281 WeakPolarHBondContact CD-O 3.13Å; K249-L281 WeakPolarHBondContact CE-O 3.33Å; K249-L281 PolarHBondContact NZ-O 3.42Å
250S84.4Confident88.5Confident10 Ų1044.6 Ų44.67%0.0724%0.238CC..  trans-151.9137.9-177.2-73.40000110.8L281 R287S250-L281 VanDerWaalsContact OG-CD1 3.25Å; S250-L281 WeakPolarHBondContact OG-CD1 3.25Å; S250-R287 WeakPolarHBondContact OG-CD 3.45Å; S250-R287 VanDerWaalsContact OG-CG 3.32Å; S250-R287 WeakPolarHBondContact OG-CG 3.45Å
251S86.7Confident88.3Confident41 Ų4151.9 Ų51.929%0.28727%0.272SS..  trans-90.4164.1176.969.40000112.8D253 E254 T255S251-D253 VanDerWaalsContact C-N 3.27Å; S251-D253 PolarHBondContact O-N 2.98Å; S251-E254 WeakPolarHBondContact CB-OE2 3.43Å; S251-E254 PolarHBondContact N-OE2 3.02Å; S251-E254 VanDerWaalsContact N-OE2 3.08Å; S251-E254 PolarHBondContact O-N 3.39Å; S251-E254 VanDerWaalsContact OG-CD 3.24Å; S251-E254 WeakPolarHBondContact OG-CG 3.23Å; S251-E254 PolarHBondContact OG-N 3.26Å; S251-E254 PolarHBondContact OG-OE2 3.28Å; S251-T255 WeakPolarHBondContact O-CB 3.47Å; S251-T255 PolarHBondContact O-N 3.18Å; S251-T255 PolarHBondContact O-OG1 3.09Å
252I85Confident88.1Confident7 Ų753 Ų534%0.03628%0.279CS..Hα-helixtrans-60.8-38.9171.5-61.5143.4000110.7I218 K221 E245 E254 T255 L256I218-I252 HydrophobicContact CD1-CD1 3.87Å; I218-I252 HydrophobicContact CD1-CG1 4.28Å; I218-I252 HydrophobicContact CG1-CD1 3.4Å; I218-I252 VanDerWaalsContact CG1-CD1 3.4Å; I218-I252 HydrophobicContact CG1-CG1 3.93Å; I218-I252 HydrophobicContact CG1-CG2 4.35Å; K221-I252 HydrophobicContact CD-CG2 4.37Å; E245-I252 VanDerWaalsContact OE1-CD1 3.22Å; E245-I252 WeakPolarHBondContact OE1-CD1 3.44Å; I252-E254 PolarHBondContact O-N 3.29Å; I252-T255 PolarHBondContact O-N 3.45Å; I252-L256 VanDerWaalsContact O-CB 3.26Å; I252-L256 WeakPolarHBondContact O-CB 3.33Å; I252-L256 PolarHBondContact O-N 3.34Å
253D85.1Confident87.7Confident91 Ų9152.4 Ų52.449%0.48729%0.287SS..Hα-helixtrans-64.6-24.1-177.8-68.2-59.5000113.5K221 S251 P257K221-D253 VanDerWaalsContact CD-OD1 3.31Å; K221-D253 WeakPolarHBondContact CD-OD1 3.5Å; K221-D253 WeakPolarHBondContact CE-OD1 3.37Å; K221-D253 IonicContact NZ-OD1 3.69Å; K221-D253 PolarHBondContact NZ-OD1 3.32Å; K221-D253 IonicContact NZ-OD2 3.62Å; K221-D253 PolarHBondContact NZ-OD2 2.96Å; S251-D253 VanDerWaalsContact C-N 3.27Å; S251-D253 PolarHBondContact O-N 2.98Å; D253-P257 WeakPolarHBondContact O-CD 3.38Å; D253-P257 WeakPolarHBondContact O-CG 3.43Å
254E86.8Confident87.5Confident73 Ų7350.9 Ų50.934%0.34128%0.277SS..Hα-helixtrans-97.5-36.1177.1-61.6160127.800111.4S251 I252 R287 F291S251-E254 WeakPolarHBondContact CB-OE2 3.43Å; S251-E254 PolarHBondContact N-OE2 3.02Å; S251-E254 VanDerWaalsContact N-OE2 3.08Å; S251-E254 PolarHBondContact O-N 3.39Å; S251-E254 VanDerWaalsContact OG-CD 3.24Å; S251-E254 WeakPolarHBondContact OG-CG 3.23Å; S251-E254 PolarHBondContact OG-N 3.26Å; S251-E254 PolarHBondContact OG-OE2 3.28Å; I252-E254 PolarHBondContact O-N 3.29Å; E254-R287 VanDerWaalsContact CD-NH2 3.34Å; E254-R287 IonicContact OE1-CZ 3.51Å; E254-R287 IonicContact OE1-NE 2.96Å; E254-R287 PolarHBondContact OE1-NE 3.18Å; E254-R287 IonicContact OE1-NH2 2.61Å; E254-R287 PolarHBondContact OE1-NH2 3.18Å; E254-R287 IonicContact OE2-CZ 2.85Å; E254-R287 IonicContact OE2-NE 2.8Å; E254-R287 PolarHBondContact OE2-NE 3.05Å; E254-F291 HydrophobicContact CB-CE2 4.23Å
255T89.3Confident87Confident0 Ų055.5 Ų55.50%031%0.31CS..Hα-helixtrans-74.8-41.7-176.5-52.50000112.2V244 S251 I252 F258 L259V244-T255 HydrophobicContact CB-CG2 3.79Å; V244-T255 HydrophobicContact CG1-CG2 3.81Å; V244-T255 WeakPolarHBondContact CG1-OG1 3.24Å; V244-T255 HydrophobicContact CG2-CG2 3.9Å; S251-T255 WeakPolarHBondContact O-CB 3.47Å; S251-T255 PolarHBondContact O-N 3.18Å; S251-T255 PolarHBondContact O-OG1 3.09Å; I252-T255 PolarHBondContact O-N 3.45Å; T255-F258 PolarHBondContact O-N 3.11Å; T255-L259 HydrophobicContact CG2-CD1 4Å; T255-L259 HydrophobicContact CG2-CG 4.39Å; T255-L259 WeakPolarHBondContact O-CG 3.2Å; T255-L259 PolarHBondContact O-N 2.94Å
256L90.1Very high86.9Confident5 Ų556.6 Ų56.63%0.02632%0.317CS..Hα-helixtrans-65.7-47.5-176.7177.667000112.1K221 A222 C225 L226 I252 F258 L259 I260K221-L256 HydrophobicContact CB-CD2 4.05Å; A222-L256 HydrophobicContact CB-CD2 4.44Å; C225-L256 HydrophobicContact CB-CD2 4.24Å; L226-L256 HydrophobicContact CD1-CD1 3.88Å; I252-L256 VanDerWaalsContact O-CB 3.26Å; I252-L256 WeakPolarHBondContact O-CB 3.33Å; I252-L256 PolarHBondContact O-N 3.34Å; L256-F258 VanDerWaalsContact C-N 3.32Å; L256-F258 PolarHBondContact O-N 3.33Å; L256-L259 PolarHBondContact O-N 3.25Å; L256-I260 HydrophobicContact CD1-CD1 4.12Å; L256-I260 HydrophobicContact CD1-CG1 4.45Å; L256-I260 HydrophobicContact CG-CD1 3.93Å; L256-I260 WeakPolarHBondContact O-CD1 3.41Å; L256-I260 VanDerWaalsContact O-CG1 3.29Å; L256-I260 WeakPolarHBondContact O-CG1 3.33Å; L256-I260 PolarHBondContact O-N 3.49Å
257P89.8Confident86.9Confident64 Ų6452.9 Ų52.942%0.41630%0.301SS..Hα-helixtrans-60.7-38.5174.8-25.837.5000113.3D253 I260 Q261D253-P257 WeakPolarHBondContact O-CD 3.38Å; D253-P257 WeakPolarHBondContact O-CG 3.43Å; P257-I260 PolarHBondContact O-N 2.68Å; P257-Q261 WeakPolarHBondContact O-CB 3.22Å; P257-Q261 PolarHBondContact O-N 3.1Å
258F90.9Very high87Confident11 Ų1157.3 Ų57.35%0.04832%0.321CS..Hα-helixtrans-58.6-50.5174.5159-105000111.9T255 L256 I260 Q261 C262 Y273 C277 F291 V294 A295T255-F258 PolarHBondContact O-N 3.11Å; L256-F258 VanDerWaalsContact C-N 3.32Å; L256-F258 PolarHBondContact O-N 3.33Å; F258-I260 VanDerWaalsContact C-N 3.26Å; F258-I260 PolarHBondContact O-N 3.47Å; F258-Q261 PolarHBondContact O-N 3.16Å; F258-Q261 VanDerWaalsContact O-N 3.15Å; F258-C262 WeakPolarHBondContact CE2-SG 3.26Å; F258-C262 PolarHBondContact O-N 3.33Å; F258-C262 PolarHBondContact O-SG 2.67Å; F258-C262 VanDerWaalsContact O-SG 3.32Å; F258-Y273 HydrophobicContact CZ-CD1 4.23Å; F258-C277 VanDerWaalsContact CE1-SG 3.54Å; F258-F291 HydrophobicContact CB-CD2 3.83Å; F258-F291 HydrophobicContact CB-CE2 4.14Å; F258-F291 HydrophobicContact CB-CG 4.33Å; F258-F291 HydrophobicContact CD1-CD1 4.22Å; F258-F291 HydrophobicContact CD1-CD2 4.39Å; F258-F291 HydrophobicContact CD1-CE1 4.4Å; F258-F291 HydrophobicContact CD1-CG 4.22Å; F258-F291 HydrophobicContact CD2-CB 3.68Å; F258-F291 HydrophobicContact CD2-CD2 4.29Å; F258-F291 AromaticContact CD2-CG 3.97Å; F258-F291 HydrophobicContact CD2-CG 3.97Å; F258-F291 HydrophobicContact CE1-CD1 4.33Å; F258-F291 HydrophobicContact CE2-CB 3.92Å; F258-F291 HydrophobicContact CE2-CG 4.35Å; F258-F291 WeakPolarHBondContact CE2-O 3.39Å; F258-F291 HydrophobicContact CG-CB 4.14Å; F258-F291 HydrophobicContact CG-CD1 4.35Å; F258-F291 AromaticContact CG-CD2 3.9Å; F258-F291 HydrophobicContact CG-CD2 3.9Å; F258-F291 HydrophobicContact CG-CE2 4.38Å; F258-F291 AromaticContact CG-CG 3.89Å; F258-F291 HydrophobicContact CG-CG 3.89Å; F258-V294 HydrophobicContact CZ-CB 4.12Å; F258-V294 HydrophobicContact CZ-CG1 3.9Å; F258-A295 HydrophobicContact CE2-CB 4.12Å
259L89.5Confident87.4Confident1 Ų156.4 Ų56.41%0.00530%0.3CS..Hα-helixtrans-63.9-31.6178.2-67.1170.8000112.6R230 Y237 A240 T255 L256 L264R230-L259 PolarHBondContact NH2-O 3.14Å; Y237-L259 HydrophobicContact CD1-CB 3.87Å; Y237-L259 HydrophobicContact CD1-CD1 4.45Å; Y237-L259 HydrophobicContact CE1-CB 3.92Å; A240-L259 HydrophobicContact CB-CD1 3.62Å; T255-L259 HydrophobicContact CG2-CD1 4Å; T255-L259 HydrophobicContact CG2-CG 4.39Å; T255-L259 WeakPolarHBondContact O-CG 3.2Å; T255-L259 PolarHBondContact O-N 2.94Å; L256-L259 PolarHBondContact O-N 3.25Å; L259-L264 HydrophobicContact CD2-CD1 4.12Å
260I89.4Confident87.8Confident30 Ų3051.3 Ų51.315%0.15428%0.278CS..Hα-helixtrans-67.5-50172.1-65.9161.1000109.8C225 L226 R230 L256 P257 F258 C262 N263C225-I260 HydrophobicContact CB-CD1 3.75Å; L226-I260 HydrophobicContact CD1-CD1 4.11Å; L226-I260 HydrophobicContact CD1-CG1 4.08Å; R230-I260 PolarHBondContact NH1-O 3.24Å; R230-I260 PolarHBondContact NH2-O 2.93Å; L256-I260 HydrophobicContact CD1-CD1 4.12Å; L256-I260 HydrophobicContact CD1-CG1 4.45Å; L256-I260 HydrophobicContact CG-CD1 3.93Å; L256-I260 WeakPolarHBondContact O-CD1 3.41Å; L256-I260 VanDerWaalsContact O-CG1 3.29Å; L256-I260 WeakPolarHBondContact O-CG1 3.33Å; L256-I260 PolarHBondContact O-N 3.49Å; P257-I260 PolarHBondContact O-N 2.68Å; F258-I260 VanDerWaalsContact C-N 3.26Å; F258-I260 PolarHBondContact O-N 3.47Å; I260-C262 VanDerWaalsContact C-N 3.28Å; I260-C262 PolarHBondContact O-N 3.12Å; I260-N263 PolarHBondContact O-N 2.98Å; I260-N263 PolarHBondContact O-OD1 3.3Å
261Q88.8Confident88.2Confident154 Ų15452.4 Ų52.472%0.7228%0.283SS*.Hα-helixtrans-57.9-36.4-179.3-175.8177.3-0.100113P257 F258 N263P257-Q261 WeakPolarHBondContact O-CB 3.22Å; P257-Q261 PolarHBondContact O-N 3.1Å; F258-Q261 PolarHBondContact O-N 3.16Å; F258-Q261 VanDerWaalsContact O-N 3.15Å; Q261-N263 PolarHBondContact O-N 2.92Å; Q261-N263 VanDerWaalsContact O-N 3.09Å
262C86.3Confident88.5Confident24 Ų2453 Ų5316%0.16229%0.287CS..THydrogen-bonded Turntrans-67.8-2.7176.7-660000114.7F258 I260 L264 Y273F258-C262 WeakPolarHBondContact CE2-SG 3.26Å; F258-C262 PolarHBondContact O-N 3.33Å; F258-C262 PolarHBondContact O-SG 2.67Å; F258-C262 VanDerWaalsContact O-SG 3.32Å; I260-C262 VanDerWaalsContact C-N 3.28Å; I260-C262 PolarHBondContact O-N 3.12Å; C262-L264 HydrophobicContact CB-CD1 4.38Å; C262-L264 HydrophobicContact CB-CD2 3.72Å; C262-L264 HydrophobicContact CB-CG 3.88Å; C262-L264 WeakPolarHBondContact O-CD2 3.49Å; C262-L264 PolarHBondContact O-N 3.2Å; C262-Y273 HydrophobicContact CB-CD1 4.28Å; C262-Y273 HydrophobicContact CB-CE1 3.84Å
263N83.7Confident88.9Confident128 Ų12853.3 Ų53.368%0.68429%0.288SS*.THydrogen-bonded Turntrans52.828.6173.9-74.8-32.7000116.1R230 I260 Q261 S265R230-N263 PolarHBondContact NH1-OD1 3.02Å; I260-N263 PolarHBondContact O-N 2.98Å; I260-N263 PolarHBondContact O-OD1 3.3Å; Q261-N263 PolarHBondContact O-N 2.92Å; Q261-N263 VanDerWaalsContact O-N 3.09Å; N263-S265 PolarHBondContact O-N 2.96Å
264L86.1Confident89.3Confident8 Ų849.1 Ų49.14%0.04227%0.266CS..  trans-57.7125.5176.6-43.1-178.1000111.2R230 Y237 L259 C262 V269 I270 Y273R230-L264 PolarHBondContact NE-O 3.06Å; R230-L264 PolarHBondContact NH2-O 2.9Å; R230-L264 VanDerWaalsContact NH2-O 3.17Å; Y237-L264 PolarHBondContact OH-O 2.95Å; L259-L264 HydrophobicContact CD2-CD1 4.12Å; C262-L264 HydrophobicContact CB-CD1 4.38Å; C262-L264 HydrophobicContact CB-CD2 3.72Å; C262-L264 HydrophobicContact CB-CG 3.88Å; C262-L264 WeakPolarHBondContact O-CD2 3.49Å; C262-L264 PolarHBondContact O-N 3.2Å; L264-V269 HydrophobicContact CD2-CG1 3.93Å; L264-I270 HydrophobicContact CB-CG1 3.64Å; L264-I270 HydrophobicContact CD1-CB 4.39Å; L264-I270 HydrophobicContact CD1-CG1 4.01Å; L264-I270 HydrophobicContact CG-CG1 4.46Å; L264-Y273 HydrophobicContact CD1-CD1 3.95Å; L264-Y273 HydrophobicContact CD1-CD2 4.23Å; L264-Y273 HydrophobicContact CD1-CE1 4.4Å; L264-Y273 HydrophobicContact CD1-CG 3.83Å; L264-Y273 HydrophobicContact CD2-CD1 4.06Å; L264-Y273 HydrophobicContact CD2-CD2 4.17Å; L264-Y273 HydrophobicContact CD2-CE1 3.66Å; L264-Y273 HydrophobicContact CD2-CE2 3.78Å; L264-Y273 HydrophobicContact CD2-CG 4.28Å; L264-Y273 VanDerWaalsContact CD2-CZ 3.46Å
265S80.7Confident89.7Confident98 Ų9851.4 Ų51.469%0.68528%0.276SS*.  trans-106.3-14.7178.8520000113.9H233 N263H233-S265 PolarHBondContact CD2-O 2.7Å; H233-S265 VanDerWaalsContact CD2-O 3.23Å; H233-S265 PolarHBondContact NE2-O 3.22Å; N263-S265 PolarHBondContact O-N 2.96Å
266D88.1Confident89.9Confident73 Ų7351.9 Ų51.939%0.3928%0.279SS..SBendtrans-113.5133.2-175.7173.88.2000111.7M268 V269 I270D266-M268 VanDerWaalsContact C-N 3.28Å; D266-M268 PolarHBondContact O-N 3.2Å; D266-M268 PolarHBondContact OD1-N 2.99Å; D266-V269 HydrophobicContact CB-CB 4.29Å; D266-V269 HydrophobicContact CB-CG2 3.9Å; D266-V269 PolarHBondContact O-N 3.05Å; D266-I270 WeakPolarHBondContact O-CD1 3.4Å; D266-I270 VanDerWaalsContact O-CG1 3.25Å; D266-I270 WeakPolarHBondContact O-CG1 3.24Å; D266-I270 PolarHBondContact O-N 3.28Å
267K90.3Very high90.1Very high85 Ų8551.6 Ų51.637%0.3728%0.278SS..Hα-helixtrans-37.4-53.2165.8164.7-177.6178.8171.70113.3Y236 I270 L271Y236-K267 HydrophobicContact CD1-CD 4.39Å; Y236-K267 HydrophobicContact CD1-CG 3.81Å; Y236-K267 HydrophobicContact CD2-CB 3.94Å; Y236-K267 HydrophobicContact CD2-CD 4.48Å; Y236-K267 HydrophobicContact CD2-CG 3.96Å; Y236-K267 HydrophobicContact CE1-CD 3.74Å; Y236-K267 HydrophobicContact CE1-CG 3.67Å; Y236-K267 HydrophobicContact CE2-CB 4.01Å; Y236-K267 HydrophobicContact CE2-CD 3.85Å; Y236-K267 HydrophobicContact CE2-CG 3.83Å; Y236-K267 HydrophobicContact CG-CB 4.25Å; Y236-K267 HydrophobicContact CG-CG 3.95Å; Y236-K267 VanDerWaalsContact CZ-CD 3.43Å; Y236-K267 WeakPolarHBondContact OH-CD 3.42Å; Y236-K267 WeakPolarHBondContact OH-CE 3.38Å; Y236-K267 PolarHBondContact OH-NZ 3.06Å; K267-I270 PolarHBondContact O-N 2.96Å; K267-L271 WeakPolarHBondContact O-CG 3.18Å; K267-L271 PolarHBondContact O-N 3.18Å
268M90.1Very high90.3Very high121 Ų12148.8 Ų48.860%0.59626%0.26SS*.Hα-helixtrans-71.2-39.2-171.2-66.1-56.6-68.300111D266 L271 S272D266-M268 VanDerWaalsContact C-N 3.28Å; D266-M268 PolarHBondContact O-N 3.2Å; D266-M268 PolarHBondContact OD1-N 2.99Å; M268-L271 PolarHBondContact O-N 2.92Å; M268-S272 WeakPolarHBondContact O-CB 3.34Å; M268-S272 PolarHBondContact O-N 3.41Å
269V91.1Very high90.4Very high54 Ų5450.3 Ų50.333%0.32727%0.268SS..Hα-helixtrans-65.2-41.7175.2-173.40000111.3L264 D266 L271 S272 Y273L264-V269 HydrophobicContact CD2-CG1 3.93Å; D266-V269 HydrophobicContact CB-CB 4.29Å; D266-V269 HydrophobicContact CB-CG2 3.9Å; D266-V269 PolarHBondContact O-N 3.05Å; V269-L271 VanDerWaalsContact C-N 3.32Å; V269-L271 PolarHBondContact O-N 3.1Å; V269-S272 PolarHBondContact O-N 3.1Å; V269-Y273 HydrophobicContact CG1-CD2 3.71Å; V269-Y273 HydrophobicContact CG1-CE2 3.41Å; V269-Y273 VanDerWaalsContact CG1-CE2 3.41Å; V269-Y273 VanDerWaalsContact O-CD2 3.23Å; V269-Y273 WeakPolarHBondContact O-CD2 3.41Å; V269-Y273 PolarHBondContact O-N 3.01Å
270I91.7Very high90.5Very high0 Ų050.2 Ų50.20%027%0.268CS..Hα-helixtrans-57.4-44.6175.3-65.6156.6000111.6H233 Y237 A240 L264 D266 K267 S274H233-I270 HydrophobicContact CB-CD1 4Å; Y237-I270 HydrophobicContact CD1-CG2 4.34Å; Y237-I270 HydrophobicContact CD2-CD1 4.13Å; Y237-I270 HydrophobicContact CE1-CD1 4.39Å; Y237-I270 HydrophobicContact CE1-CG1 4.24Å; Y237-I270 HydrophobicContact CE1-CG2 4.39Å; Y237-I270 HydrophobicContact CE2-CD1 3.41Å; Y237-I270 VanDerWaalsContact CE2-CD1 3.41Å; Y237-I270 HydrophobicContact CE2-CG1 4.15Å; Y237-I270 HydrophobicContact CG-CG2 4.45Å; Y237-I270 WeakPolarHBondContact OH-CD1 3.25Å; A240-I270 HydrophobicContact CB-CG2 3.87Å; L264-I270 HydrophobicContact CB-CG1 3.64Å; L264-I270 HydrophobicContact CD1-CB 4.39Å; L264-I270 HydrophobicContact CD1-CG1 4.01Å; L264-I270 HydrophobicContact CG-CG1 4.46Å; D266-I270 WeakPolarHBondContact O-CD1 3.4Å; D266-I270 VanDerWaalsContact O-CG1 3.25Å; D266-I270 WeakPolarHBondContact O-CG1 3.24Å; D266-I270 PolarHBondContact O-N 3.28Å; K267-I270 PolarHBondContact O-N 2.96Å; I270-S274 PolarHBondContact O-N 3.42Å
271L92.6Very high90.6Very high33 Ų3348.9 Ų48.917%0.17326%0.261CS..Hα-helixtrans-69.9-44178.9-64.8176.6000111.6Y236 K239 K267 M268 V269 Y273 S274 E275Y236-L271 HydrophobicContact CD1-CD1 4.18Å; Y236-L271 HydrophobicContact CD1-CD2 4.5Å; Y236-L271 HydrophobicContact CD1-CG 4.47Å; K239-L271 HydrophobicContact CB-CD2 4.18Å; K239-L271 HydrophobicContact CD-CD2 3.89Å; K239-L271 HydrophobicContact CG-CD2 3.98Å; K267-L271 WeakPolarHBondContact O-CG 3.18Å; K267-L271 PolarHBondContact O-N 3.18Å; M268-L271 PolarHBondContact O-N 2.92Å; V269-L271 VanDerWaalsContact C-N 3.32Å; V269-L271 PolarHBondContact O-N 3.1Å; L271-Y273 PolarHBondContact O-N 2.92Å; L271-S274 WeakPolarHBondContact O-CB 3.38Å; L271-S274 PolarHBondContact O-N 2.95Å; L271-S274 VanDerWaalsContact O-N 3.11Å; L271-S274 PolarHBondContact O-OG 2.92Å; L271-E275 PolarHBondContact O-N 3.09Å
272S93.3Very high90.7Very high52 Ų5247.7 Ų47.736%0.36425%0.253SS..Hα-helixtrans-56.5-49.1176.7176.20000112.2M268 V269 S274 E275 V276M268-S272 WeakPolarHBondContact O-CB 3.34Å; M268-S272 PolarHBondContact O-N 3.41Å; V269-S272 PolarHBondContact O-N 3.1Å; S272-S274 VanDerWaalsContact C-N 3.25Å; S272-S274 PolarHBondContact O-N 3.24Å; S272-E275 PolarHBondContact O-N 3.35Å; S272-E275 VanDerWaalsContact O-N 3.09Å; S272-V276 WeakPolarHBondContact O-CG2 3.46Å; S272-V276 PolarHBondContact O-N 2.93Å
273Y93.8Very high91Very high15 Ų1551 Ų516%0.05927%0.268CS..Hα-helixtrans-56.9-40.5175.9-87.4-125000112F258 C262 L264 V269 L271 E275 C277 V294 K298F258-Y273 HydrophobicContact CZ-CD1 4.23Å; C262-Y273 HydrophobicContact CB-CD1 4.28Å; C262-Y273 HydrophobicContact CB-CE1 3.84Å; L264-Y273 HydrophobicContact CD1-CD1 3.95Å; L264-Y273 HydrophobicContact CD1-CD2 4.23Å; L264-Y273 HydrophobicContact CD1-CE1 4.4Å; L264-Y273 HydrophobicContact CD1-CG 3.83Å; L264-Y273 HydrophobicContact CD2-CD1 4.06Å; L264-Y273 HydrophobicContact CD2-CD2 4.17Å; L264-Y273 HydrophobicContact CD2-CE1 3.66Å; L264-Y273 HydrophobicContact CD2-CE2 3.78Å; L264-Y273 HydrophobicContact CD2-CG 4.28Å; L264-Y273 VanDerWaalsContact CD2-CZ 3.46Å; V269-Y273 HydrophobicContact CG1-CD2 3.71Å; V269-Y273 HydrophobicContact CG1-CE2 3.41Å; V269-Y273 VanDerWaalsContact CG1-CE2 3.41Å; V269-Y273 VanDerWaalsContact O-CD2 3.23Å; V269-Y273 WeakPolarHBondContact O-CD2 3.41Å; V269-Y273 PolarHBondContact O-N 3.01Å; L271-Y273 PolarHBondContact O-N 2.92Å; Y273-E275 VanDerWaalsContact C-N 3.33Å; Y273-E275 PolarHBondContact O-N 3.36Å; Y273-C277 WeakPolarHBondContact O-CB 3.26Å; Y273-C277 PolarHBondContact O-N 2.93Å; Y273-C277 PolarHBondContact O-SG 3.44Å; Y273-C277 VanDerWaalsContact O-SG 3.34Å; Y273-V294 HydrophobicContact CD1-CG1 3.79Å; Y273-V294 HydrophobicContact CE1-CG1 4.25Å; Y273-V294 HydrophobicContact CG-CG1 4.28Å; Y273-K298 WeakPolarHBondContact CE2-O 3.41Å; Y273-K298 WeakPolarHBondContact OH-CA 3.44Å; Y273-K298 PolarHBondContact OH-O 3.32Å; Y273-K298 VanDerWaalsContact OH-O 3.07Å
274S93.9Very high91.2Very high3 Ų347.3 Ų47.32%0.02126%0.259CS..Hα-helixtrans-67.6-34.4179.384.50000113.1A240 V244 I270 L271 S272 S278A240-S274 VanDerWaalsContact CA-CB 3.44Å; V244-S274 WeakPolarHBondContact CG2-O 3.39Å; I270-S274 PolarHBondContact O-N 3.42Å; L271-S274 WeakPolarHBondContact O-CB 3.38Å; L271-S274 PolarHBondContact O-N 2.95Å; L271-S274 VanDerWaalsContact O-N 3.11Å; L271-S274 PolarHBondContact O-OG 2.92Å; S272-S274 VanDerWaalsContact C-N 3.25Å; S272-S274 PolarHBondContact O-N 3.24Å; S274-S278 VanDerWaalsContact O-CB 3.22Å; S274-S278 WeakPolarHBondContact O-CB 3.17Å; S274-S278 PolarHBondContact O-N 3.41Å
275E94Very high91.4Very high120 Ų12048.9 Ų48.956%0.56127%0.266SS*.Hα-helixtrans-74.9-43.8179.4-174.7158.4-14600111L271 S272 Y273 S278 N279L271-E275 PolarHBondContact O-N 3.09Å; S272-E275 PolarHBondContact O-N 3.35Å; S272-E275 VanDerWaalsContact O-N 3.09Å; Y273-E275 VanDerWaalsContact C-N 3.33Å; Y273-E275 PolarHBondContact O-N 3.36Å; E275-S278 WeakPolarHBondContact O-CB 3.19Å; E275-S278 PolarHBondContact O-N 2.84Å; E275-S278 VanDerWaalsContact O-N 3.17Å; E275-N279 WeakPolarHBondContact O-CB 3.5Å; E275-N279 PolarHBondContact O-N 3.17Å; E275-N279 PolarHBondContact O-ND2 3.01Å
276V94.3Very high91.8Very high10 Ų1047.2 Ų47.26%0.06125%0.253CS..Hα-helixtrans-61-47.3172.9174.60000111.1S272 S278 N279 L280 V294 G299 Q301S272-V276 WeakPolarHBondContact O-CG2 3.46Å; S272-V276 PolarHBondContact O-N 2.93Å; V276-S278 VanDerWaalsContact C-N 3.34Å; V276-S278 PolarHBondContact O-N 3.47Å; V276-N279 PolarHBondContact O-N 3.34Å; V276-L280 HydrophobicContact CG1-CD1 3.81Å; V276-L280 HydrophobicContact CG1-CG 4.42Å; V276-L280 WeakPolarHBondContact O-CB 3.24Å; V276-L280 VanDerWaalsContact O-CG 3.28Å; V276-L280 WeakPolarHBondContact O-CG 3.49Å; V276-L280 PolarHBondContact O-N 3.3Å; V276-V294 HydrophobicContact CG1-CG2 3.88Å; V276-G299 WeakPolarHBondContact CG2-O 3.48Å; V276-Q301 HydrophobicContact CB-CB 4.5Å; V276-Q301 HydrophobicContact CG1-CB 3.87Å; V276-Q301 HydrophobicContact CG1-CG 4.09Å; V276-Q301 HydrophobicContact CG2-CB 3.9Å
277C93.3Very high91.9Very high0 Ų046.9 Ų46.90%025%0.246CC..Hα-helixtrans-58.1-44.1172-76.40000112.2V244 F258 Y273 N279 L280 L281 I290 F291V244-C277 HydrophobicContact CG2-CB 3.97Å; F258-C277 VanDerWaalsContact CE1-SG 3.54Å; Y273-C277 WeakPolarHBondContact O-CB 3.26Å; Y273-C277 PolarHBondContact O-N 2.93Å; Y273-C277 PolarHBondContact O-SG 3.44Å; Y273-C277 VanDerWaalsContact O-SG 3.34Å; C277-N279 VanDerWaalsContact C-N 3.33Å; C277-N279 PolarHBondContact O-N 3.46Å; C277-L280 PolarHBondContact O-N 2.77Å; C277-L281 WeakPolarHBondContact O-CB 3.41Å; C277-L281 WeakPolarHBondContact O-CD1 3.49Å; C277-L281 WeakPolarHBondContact O-CG 3.25Å; C277-L281 PolarHBondContact O-N 2.74Å; C277-I290 HydrophobicContact CB-CG2 4.48Å; C277-F291 HydrophobicContact CB-CE1 4.45Å
278S93.8Very high91.9Very high5 Ų546.6 Ų46.64%0.03525%0.253CS..Hα-helixtrans-61-41.2177.7-168.60000111.8T243 T247 S274 E275 V276 K282T243-S278 PolarHBondContact O-OG 3.1Å; T243-S278 VanDerWaalsContact O-OG 3.1Å; T247-S278 VanDerWaalsContact CG2-OG 3.25Å; T247-S278 WeakPolarHBondContact CG2-OG 3.39Å; S274-S278 VanDerWaalsContact O-CB 3.22Å; S274-S278 WeakPolarHBondContact O-CB 3.17Å; S274-S278 PolarHBondContact O-N 3.41Å; E275-S278 WeakPolarHBondContact O-CB 3.19Å; E275-S278 PolarHBondContact O-N 2.84Å; E275-S278 VanDerWaalsContact O-N 3.17Å; V276-S278 VanDerWaalsContact C-N 3.34Å; V276-S278 PolarHBondContact O-N 3.47Å; S278-K282 WeakPolarHBondContact O-CD 3.37Å; S278-K282 WeakPolarHBondContact O-CG 3.5Å; S278-K282 PolarHBondContact O-N 3.45Å; S278-K282 WeakPolarHBondContact OG-CE 3.44Å; S278-K282 PolarHBondContact OG-NZ 2.98Å
279N94.1Very high91.9Very high42 Ų4245.6 Ų45.623%0.22525%0.247CC..Hα-helixtrans-69-44.8178.9-67.4-16.3000112.2E275 V276 C277 L281 K282 M283 Q301E275-N279 WeakPolarHBondContact O-CB 3.5Å; E275-N279 PolarHBondContact O-N 3.17Å; E275-N279 PolarHBondContact O-ND2 3.01Å; V276-N279 PolarHBondContact O-N 3.34Å; C277-N279 VanDerWaalsContact C-N 3.33Å; C277-N279 PolarHBondContact O-N 3.46Å; N279-L281 VanDerWaalsContact C-N 3.34Å; N279-L281 PolarHBondContact O-N 3.25Å; N279-K282 WeakPolarHBondContact O-CB 3.28Å; N279-K282 PolarHBondContact O-N 3.4Å; N279-K282 PolarHBondContact OD1-NZ 3.1Å; N279-M283 HydrophobicContact CB-CE 4.19Å; N279-M283 WeakPolarHBondContact O-CE 3.41Å; N279-M283 WeakPolarHBondContact O-CG 3.2Å; N279-M283 PolarHBondContact O-N 3.15Å; N279-Q301 PolarHBondContact ND2-OE1 3.49Å
280L91.6Very high92Very high0 Ų043 Ų430%023%0.231CC..Hα-helixtrans-64-38.1176.1-65.9170.4000111.9V276 C277 M283 G284 F285 I290 V294 A304 L305 L308V276-L280 HydrophobicContact CG1-CD1 3.81Å; V276-L280 HydrophobicContact CG1-CG 4.42Å; V276-L280 WeakPolarHBondContact O-CB 3.24Å; V276-L280 VanDerWaalsContact O-CG 3.28Å; V276-L280 WeakPolarHBondContact O-CG 3.49Å; V276-L280 PolarHBondContact O-N 3.3Å; C277-L280 PolarHBondContact O-N 2.77Å; L280-M283 HydrophobicContact CD2-CE 3.9Å; L280-M283 HydrophobicContact CG-CE 4.49Å; L280-M283 PolarHBondContact O-N 3.45Å; L280-G284 PolarHBondContact O-N 2.79Å; L280-F285 HydrophobicContact CD2-CD2 4.37Å; L280-I290 HydrophobicContact CB-CB 4.43Å; L280-I290 HydrophobicContact CB-CD1 3.83Å; L280-I290 HydrophobicContact CB-CG1 3.9Å; L280-I290 HydrophobicContact CB-CG2 3.7Å; L280-I290 HydrophobicContact CD1-CG2 3.83Å; L280-I290 HydrophobicContact CG-CG2 4.42Å; L280-V294 HydrophobicContact CD1-CG2 3.48Å; L280-V294 VanDerWaalsContact CD1-CG2 3.48Å; L280-A304 HydrophobicContact CD1-CB 4.04Å; L280-L305 HydrophobicContact CD2-CD2 3.43Å; L280-L305 VanDerWaalsContact CD2-CD2 3.43Å; L280-L305 HydrophobicContact CD2-CG 3.72Å; L280-L308 HydrophobicContact CD1-CD1 4.09Å; L280-L308 HydrophobicContact CD2-CD1 3.82Å; L280-L308 HydrophobicContact CG-CD1 4.42Å
281L91.6Very high92Very high2 Ų243.8 Ų43.81%0.0123%0.234CC..Hα-helixtrans-65.6-41.4173.3-74.2164.4000111.6V244 T247 K249 S250 C277 N279 M283 G284 R287 I290V244-L281 HydrophobicContact CG1-CD1 3.7Å; T247-L281 HydrophobicContact CG2-CB 4.11Å; T247-L281 HydrophobicContact CG2-CD1 4.47Å; K249-L281 HydrophobicContact CB-CB 4.49Å; K249-L281 HydrophobicContact CB-CD2 3.95Å; K249-L281 HydrophobicContact CD-CB 4.47Å; K249-L281 WeakPolarHBondContact CD-O 3.13Å; K249-L281 WeakPolarHBondContact CE-O 3.33Å; K249-L281 PolarHBondContact NZ-O 3.42Å; S250-L281 VanDerWaalsContact OG-CD1 3.25Å; S250-L281 WeakPolarHBondContact OG-CD1 3.25Å; C277-L281 WeakPolarHBondContact O-CB 3.41Å; C277-L281 WeakPolarHBondContact O-CD1 3.49Å; C277-L281 WeakPolarHBondContact O-CG 3.25Å; C277-L281 PolarHBondContact O-N 2.74Å; N279-L281 VanDerWaalsContact C-N 3.34Å; N279-L281 PolarHBondContact O-N 3.25Å; L281-M283 VanDerWaalsContact C-N 3.32Å; L281-M283 PolarHBondContact O-N 3.42Å; L281-G284 PolarHBondContact O-N 3.42Å; L281-G284 VanDerWaalsContact O-N 3.1Å; L281-R287 HydrophobicContact CD2-CB 4.16Å; L281-R287 HydrophobicContact CD2-CG 4.41Å; L281-I290 HydrophobicContact CB-CD1 4.33Å; L281-I290 HydrophobicContact CD2-CD1 3.6Å; L281-I290 HydrophobicContact CG-CD1 3.71Å
282K91.6Very high91.9Very high128 Ų12847.9 Ų47.956%0.55725%0.253SS*.Hα-helixtrans-59.1-43.3173.7-71.1162.9-158.5159.90111.4T247 S278 N279 G284T247-K282 HydrophobicContact CG2-CG 4.36Å; S278-K282 WeakPolarHBondContact O-CD 3.37Å; S278-K282 WeakPolarHBondContact O-CG 3.5Å; S278-K282 PolarHBondContact O-N 3.45Å; S278-K282 WeakPolarHBondContact OG-CE 3.44Å; S278-K282 PolarHBondContact OG-NZ 2.98Å; N279-K282 WeakPolarHBondContact O-CB 3.28Å; N279-K282 PolarHBondContact O-N 3.4Å; N279-K282 PolarHBondContact OD1-NZ 3.1Å; K282-G284 PolarHBondContact O-N 3.02Å; K282-G284 VanDerWaalsContact O-N 3.15Å
283M90.9Very high91.8Very high95 Ų9545.5 Ų45.547%0.46824%0.236SC..Hα-helixtrans-62.7-16176-73.2-177.5-10200114.2N279 L280 L281 F285 L305N279-M283 HydrophobicContact CB-CE 4.19Å; N279-M283 WeakPolarHBondContact O-CE 3.41Å; N279-M283 WeakPolarHBondContact O-CG 3.2Å; N279-M283 PolarHBondContact O-N 3.15Å; L280-M283 HydrophobicContact CD2-CE 3.9Å; L280-M283 HydrophobicContact CG-CE 4.49Å; L280-M283 PolarHBondContact O-N 3.45Å; L281-M283 VanDerWaalsContact C-N 3.32Å; L281-M283 PolarHBondContact O-N 3.42Å; M283-F285 HydrophobicContact CB-CD2 3.85Å; M283-F285 HydrophobicContact CB-CE2 3.85Å; M283-F285 HydrophobicContact SD-CE2 4.3Å; M283-L305 HydrophobicContact CE-CD1 4.28Å; M283-L305 HydrophobicContact CE-CD2 4.05Å; M283-L305 HydrophobicContact SD-CD1 4.48Å; M283-L305 HydrophobicContact SD-CD2 3.8Å
284G89.1Confident91.8Very high49 Ų4944.8 Ų44.851%0.50523%0.234SC..THydrogen-bonded Turntrans96.35.2170.900000115.5L280 L281 K282L280-G284 PolarHBondContact O-N 2.79Å; L281-G284 PolarHBondContact O-N 3.42Å; L281-G284 VanDerWaalsContact O-N 3.1Å; K282-G284 PolarHBondContact O-N 3.02Å; K282-G284 VanDerWaalsContact O-N 3.15Å
285F90Very high91.7Very high42 Ų4246.6 Ų46.618%0.18425%0.249CC..  trans-61.2149.7170.4-63.6-78.7000111L280 M283 I290 L305 L308 L309L280-F285 HydrophobicContact CD2-CD2 4.37Å; M283-F285 HydrophobicContact CB-CD2 3.85Å; M283-F285 HydrophobicContact CB-CE2 3.85Å; M283-F285 HydrophobicContact SD-CE2 4.3Å; F285-I290 HydrophobicContact CB-CD1 3.81Å; F285-I290 HydrophobicContact CB-CG1 3.68Å; F285-I290 VanDerWaalsContact O-CD1 3.26Å; F285-I290 WeakPolarHBondContact O-CD1 3.39Å; F285-L305 HydrophobicContact CE2-CD2 3.65Å; F285-L305 HydrophobicContact CZ-CD2 4.08Å; F285-L308 HydrophobicContact CB-CD1 4.41Å; F285-L308 HydrophobicContact CD1-CB 3.9Å; F285-L308 HydrophobicContact CD1-CD1 4.45Å; F285-L308 HydrophobicContact CD2-CD1 4.31Å; F285-L308 HydrophobicContact CE1-CB 3.84Å; F285-L308 HydrophobicContact CG-CB 4.42Å; F285-L308 HydrophobicContact CG-CD1 4.15Å; F285-L308 HydrophobicContact CZ-CB 4.32Å; F285-L309 HydrophobicContact CE1-CD2 4.16Å; F285-L309 HydrophobicContact CZ-CD2 3.92Å; F285-L309 HydrophobicContact CZ-CG 4.31Å
286P89.7Confident91.5Very high62 Ų6244.3 Ų44.340%0.40324%0.243SC..  trans-73.2133.2-179.529.6-34.5000111.2P288 Q289 I290P286-P288 VanDerWaalsContact C-CD 3.47Å; P286-Q289 HydrophobicContact CG-CB 4.11Å; P286-Q289 VanDerWaalsContact CG-CD 3.4Å; P286-Q289 HydrophobicContact CG-CG 3.87Å; P286-Q289 PolarHBondContact O-N 2.91Å; P286-Q289 VanDerWaalsContact O-N 3.09Å; P286-I290 PolarHBondContact O-N 3.32Å
287R89.6Confident91.4Very high67 Ų6745 Ų4525%0.25325%0.245SC..Hα-helixtrans-40.5-51.1-178.6-172.2-172.366.859.9-2.6115.6S250 E254 L281 Q289 I290 F291S250-R287 WeakPolarHBondContact OG-CD 3.45Å; S250-R287 VanDerWaalsContact OG-CG 3.32Å; S250-R287 WeakPolarHBondContact OG-CG 3.45Å; E254-R287 VanDerWaalsContact CD-NH2 3.34Å; E254-R287 IonicContact OE1-CZ 3.51Å; E254-R287 IonicContact OE1-NE 2.96Å; E254-R287 PolarHBondContact OE1-NE 3.18Å; E254-R287 IonicContact OE1-NH2 2.61Å; E254-R287 PolarHBondContact OE1-NH2 3.18Å; E254-R287 IonicContact OE2-CZ 2.85Å; E254-R287 IonicContact OE2-NE 2.8Å; E254-R287 PolarHBondContact OE2-NE 3.05Å; L281-R287 HydrophobicContact CD2-CB 4.16Å; L281-R287 HydrophobicContact CD2-CG 4.41Å; R287-Q289 PolarHBondContact O-N 3.47Å; R287-I290 PolarHBondContact O-N 2.92Å; R287-F291 HydrophobicContact CG-CD1 4.35Å; R287-F291 HydrophobicContact CG-CD2 4.18Å; R287-F291 HydrophobicContact CG-CE1 3.96Å; R287-F291 HydrophobicContact CG-CE2 3.78Å; R287-F291 HydrophobicContact CG-CG 4.46Å; R287-F291 HydrophobicContact CG-CZ 3.65Å; R287-F291 PolarHBondContact O-N 2.97Å
288P89.7Confident91.2Very high78 Ų7852.8 Ų52.851%0.50628%0.279SS..Hα-helixtrans-62-42-177.322.6-33.9000112.9P286 I290 F291 E292P286-P288 VanDerWaalsContact C-CD 3.47Å; P288-I290 VanDerWaalsContact C-N 3.35Å; P288-I290 PolarHBondContact O-N 3.04Å; P288-F291 PolarHBondContact O-N 3.29Å; P288-E292 WeakPolarHBondContact O-CB 3.4Å; P288-E292 PolarHBondContact O-N 2.87Å
289Q90.6Very high90.9Very high101 Ų10153 Ų5347%0.47228%0.282SS..Hα-helixtrans-66.5-38.1178.1-63.3177.8-8.300111.2P286 R287 E292 A293 L308P286-Q289 HydrophobicContact CG-CB 4.11Å; P286-Q289 VanDerWaalsContact CG-CD 3.4Å; P286-Q289 HydrophobicContact CG-CG 3.87Å; P286-Q289 PolarHBondContact O-N 2.91Å; P286-Q289 VanDerWaalsContact O-N 3.09Å; R287-Q289 PolarHBondContact O-N 3.47Å; Q289-E292 PolarHBondContact O-N 3.45Å; Q289-A293 VanDerWaalsContact O-CB 3.26Å; Q289-A293 WeakPolarHBondContact O-CB 3.14Å; Q289-A293 PolarHBondContact O-N 2.89Å; Q289-L308 HydrophobicContact CB-CD2 3.56Å
290I92.1Very high90.7Very high0 Ų054 Ų540%029%0.287CS..Hα-helixtrans-60-51.3175-64.1171.4000110.5C277 L280 L281 F285 P286 R287 P288 E292 A293 V294 L308C277-I290 HydrophobicContact CB-CG2 4.48Å; L280-I290 HydrophobicContact CB-CB 4.43Å; L280-I290 HydrophobicContact CB-CD1 3.83Å; L280-I290 HydrophobicContact CB-CG1 3.9Å; L280-I290 HydrophobicContact CB-CG2 3.7Å; L280-I290 HydrophobicContact CD1-CG2 3.83Å; L280-I290 HydrophobicContact CG-CG2 4.42Å; L281-I290 HydrophobicContact CB-CD1 4.33Å; L281-I290 HydrophobicContact CD2-CD1 3.6Å; L281-I290 HydrophobicContact CG-CD1 3.71Å; F285-I290 HydrophobicContact CB-CD1 3.81Å; F285-I290 HydrophobicContact CB-CG1 3.68Å; F285-I290 VanDerWaalsContact O-CD1 3.26Å; F285-I290 WeakPolarHBondContact O-CD1 3.39Å; P286-I290 PolarHBondContact O-N 3.32Å; R287-I290 PolarHBondContact O-N 2.92Å; P288-I290 VanDerWaalsContact C-N 3.35Å; P288-I290 PolarHBondContact O-N 3.04Å; I290-E292 VanDerWaalsContact C-N 3.32Å; I290-E292 PolarHBondContact O-N 2.84Å; I290-A293 PolarHBondContact O-N 3.02Å; I290-V294 HydrophobicContact CG2-CG2 4.13Å; I290-V294 WeakPolarHBondContact O-CB 3.46Å; I290-V294 VanDerWaalsContact O-CG2 3.24Å; I290-V294 WeakPolarHBondContact O-CG2 3.21Å; I290-V294 PolarHBondContact O-N 3.35Å; I290-L308 HydrophobicContact CG1-CD1 4.29Å
291F92.5Very high90.7Very high15 Ų1556.9 Ų56.97%0.06630%0.301CS..Hα-helixtrans-64-39.9-177.3-71.22.6000111E254 F258 C277 R287 P288 A295E254-F291 HydrophobicContact CB-CE2 4.23Å; F258-F291 HydrophobicContact CB-CD2 3.83Å; F258-F291 HydrophobicContact CB-CE2 4.14Å; F258-F291 HydrophobicContact CB-CG 4.33Å; F258-F291 HydrophobicContact CD1-CD1 4.22Å; F258-F291 HydrophobicContact CD1-CD2 4.39Å; F258-F291 HydrophobicContact CD1-CE1 4.4Å; F258-F291 HydrophobicContact CD1-CG 4.22Å; F258-F291 HydrophobicContact CD2-CB 3.68Å; F258-F291 HydrophobicContact CD2-CD2 4.29Å; F258-F291 AromaticContact CD2-CG 3.97Å; F258-F291 HydrophobicContact CD2-CG 3.97Å; F258-F291 HydrophobicContact CE1-CD1 4.33Å; F258-F291 HydrophobicContact CE2-CB 3.92Å; F258-F291 HydrophobicContact CE2-CG 4.35Å; F258-F291 WeakPolarHBondContact CE2-O 3.39Å; F258-F291 HydrophobicContact CG-CB 4.14Å; F258-F291 HydrophobicContact CG-CD1 4.35Å; F258-F291 AromaticContact CG-CD2 3.9Å; F258-F291 HydrophobicContact CG-CD2 3.9Å; F258-F291 HydrophobicContact CG-CE2 4.38Å; F258-F291 AromaticContact CG-CG 3.89Å; F258-F291 HydrophobicContact CG-CG 3.89Å; C277-F291 HydrophobicContact CB-CE1 4.45Å; R287-F291 HydrophobicContact CG-CD1 4.35Å; R287-F291 HydrophobicContact CG-CD2 4.18Å; R287-F291 HydrophobicContact CG-CE1 3.96Å; R287-F291 HydrophobicContact CG-CE2 3.78Å; R287-F291 HydrophobicContact CG-CG 4.46Å; R287-F291 HydrophobicContact CG-CZ 3.65Å; R287-F291 PolarHBondContact O-N 2.97Å; P288-F291 PolarHBondContact O-N 3.29Å; F291-A295 VanDerWaalsContact O-CB 3.29Å; F291-A295 WeakPolarHBondContact O-CB 3.3Å; F291-A295 PolarHBondContact O-N 3.23Å
292E91.3Very high90.7Very high119 Ų11962.1 Ų62.156%0.55633%0.329SS*.Hα-helixtrans-61.5-51.6172.6-169.9-173.9157.200112P288 Q289 I290 V294 A295 V296P288-E292 WeakPolarHBondContact O-CB 3.4Å; P288-E292 PolarHBondContact O-N 2.87Å; Q289-E292 PolarHBondContact O-N 3.45Å; I290-E292 VanDerWaalsContact C-N 3.32Å; I290-E292 PolarHBondContact O-N 2.84Å; E292-V294 PolarHBondContact O-N 3.01Å; E292-A295 PolarHBondContact O-N 3.39Å; E292-V296 WeakPolarHBondContact O-CG2 3.4Å; E292-V296 PolarHBondContact O-N 3.17Å
293A91.3Very high90.7Very high3 Ų362.9 Ų62.93%0.02533%0.328CS..Hα-helixtrans-62.3-42.3-178.300000112.6Q289 I290 V296 E297 A304 L308Q289-A293 VanDerWaalsContact O-CB 3.26Å; Q289-A293 WeakPolarHBondContact O-CB 3.14Å; Q289-A293 PolarHBondContact O-N 2.89Å; I290-A293 PolarHBondContact O-N 3.02Å; A293-V296 PolarHBondContact O-N 2.83Å; A293-E297 WeakPolarHBondContact O-CB 3.35Å; A293-E297 WeakPolarHBondContact O-CG 3.4Å; A293-E297 PolarHBondContact O-N 3.46Å; A293-A304 HydrophobicContact CB-CB 4.18Å; A293-L308 HydrophobicContact CB-CD1 4.27Å; A293-L308 HydrophobicContact CB-CD2 4.14Å; A293-L308 HydrophobicContact CB-CG 3.91Å
294V92.6Very high90.8Very high0 Ų058.3 Ų58.30%031%0.306CS..Hα-helixtrans-69.4-35178.4176.60000111.7F258 Y273 V276 L280 I290 E292 K298 G299 A304F258-V294 HydrophobicContact CZ-CB 4.12Å; F258-V294 HydrophobicContact CZ-CG1 3.9Å; Y273-V294 HydrophobicContact CD1-CG1 3.79Å; Y273-V294 HydrophobicContact CE1-CG1 4.25Å; Y273-V294 HydrophobicContact CG-CG1 4.28Å; V276-V294 HydrophobicContact CG1-CG2 3.88Å; L280-V294 HydrophobicContact CD1-CG2 3.48Å; L280-V294 VanDerWaalsContact CD1-CG2 3.48Å; I290-V294 HydrophobicContact CG2-CG2 4.13Å; I290-V294 WeakPolarHBondContact O-CB 3.46Å; I290-V294 VanDerWaalsContact O-CG2 3.24Å; I290-V294 WeakPolarHBondContact O-CG2 3.21Å; I290-V294 PolarHBondContact O-N 3.35Å; E292-V294 PolarHBondContact O-N 3.01Å; V294-K298 PolarHBondContact O-N 3Å; V294-G299 PolarHBondContact O-N 3Å; V294-A304 HydrophobicContact CG2-CB 4.22Å
295A91.3Very high90.9Very high41 Ų4157.6 Ų57.634%0.33929%0.29SS..Hα-helixtrans-65.3-46.4172.800000112F258 F291 E292 K298F258-A295 HydrophobicContact CE2-CB 4.12Å; F291-A295 VanDerWaalsContact O-CB 3.29Å; F291-A295 WeakPolarHBondContact O-CB 3.3Å; F291-A295 PolarHBondContact O-N 3.23Å; E292-A295 PolarHBondContact O-N 3.39Å; A295-K298 PolarHBondContact O-N 3.06Å
296V91Very high90.9Very high72 Ų7259.3 Ų59.344%0.43631%0.307SS..Hα-helixtrans-68.7-46.8-177.71750000111.6E292 A293 K298E292-V296 WeakPolarHBondContact O-CG2 3.4Å; E292-V296 PolarHBondContact O-N 3.17Å; A293-V296 PolarHBondContact O-N 2.83Å; V296-K298 PolarHBondContact O-N 3.16Å
297E91.6Very high90.9Very high24 Ų2462.4 Ų62.411%0.11231%0.311CS..THydrogen-bonded Turntrans-8613.8-178.6-52.5-58.1147.100112.8A293 G299 D300 R303 R307A293-E297 WeakPolarHBondContact O-CB 3.35Å; A293-E297 WeakPolarHBondContact O-CG 3.4Å; A293-E297 PolarHBondContact O-N 3.46Å; E297-G299 VanDerWaalsContact C-N 3.29Å; E297-G299 PolarHBondContact O-N 2.82Å; E297-D300 WeakPolarHBondContact O-CB 3.4Å; E297-D300 PolarHBondContact O-N 3.47Å; E297-R303 HydrophobicContact CB-CB 3.9Å; E297-R303 HydrophobicContact CG-CB 3.95Å; E297-R303 IonicContact OE2-CZ 3.08Å; E297-R303 IonicContact OE2-NE 2.99Å; E297-R303 PolarHBondContact OE2-NE 3.44Å; E297-R303 IonicContact OE2-NH2 2.72Å; E297-R303 PolarHBondContact OE2-NH2 2.98Å; E297-R307 IonicContact OE1-NH1 2.65Å; E297-R307 PolarHBondContact OE1-NH1 2.87Å
298K89.3Confident90.8Very high164 Ų16460.2 Ų60.271%0.71330%0.304SS*.THydrogen-bonded Turntrans52.935.6173-56.8-175.3-179.3179.60115.6Y273 V294 A295 V296Y273-K298 WeakPolarHBondContact CE2-O 3.41Å; Y273-K298 WeakPolarHBondContact OH-CA 3.44Å; Y273-K298 PolarHBondContact OH-O 3.32Å; Y273-K298 VanDerWaalsContact OH-O 3.07Å; V294-K298 PolarHBondContact O-N 3Å; A295-K298 PolarHBondContact O-N 3.06Å; V296-K298 PolarHBondContact O-N 3.16Å
299G86.8Confident90.8Very high9 Ų960.9 Ų60.99%0.09330%0.303CS..THydrogen-bonded Turntrans874.1-17900000115.6V276 V294 E297 Q301V276-G299 WeakPolarHBondContact CG2-O 3.48Å; V294-G299 PolarHBondContact O-N 3Å; E297-G299 VanDerWaalsContact C-N 3.29Å; E297-G299 PolarHBondContact O-N 2.82Å; G299-Q301 PolarHBondContact O-N 3.36Å
300D91.4Very high90.1Very high63 Ų6361.6 Ų61.634%0.33732%0.316SS..  trans-74.3114.5171.5-174.9-38.3000110.7E297 N302 R303 A304E297-D300 WeakPolarHBondContact O-CB 3.4Å; E297-D300 PolarHBondContact O-N 3.47Å; D300-N302 PolarHBondContact OD1-N 3.12Å; D300-R303 HydrophobicContact CB-CB 4.04Å; D300-R303 HydrophobicContact CB-CG 4.23Å; D300-R303 PolarHBondContact OD1-N 3.29Å; D300-R303 WeakPolarHBondContact OD2-CD 3.26Å; D300-R303 WeakPolarHBondContact OD2-CG 3.47Å; D300-A304 WeakPolarHBondContact O-CB 3.46Å; D300-A304 PolarHBondContact O-N 3.36Å
301Q91.4Very high88.7Confident60 Ų6069.1 Ų69.128%0.2836%0.357SS..Hα-helixtrans-64.3-40.4-179-171.3176.3-71.200113V276 N279 G299 L305V276-Q301 HydrophobicContact CB-CB 4.5Å; V276-Q301 HydrophobicContact CG1-CB 3.87Å; V276-Q301 HydrophobicContact CG1-CG 4.09Å; V276-Q301 HydrophobicContact CG2-CB 3.9Å; N279-Q301 PolarHBondContact ND2-OE1 3.49Å; G299-Q301 PolarHBondContact O-N 3.36Å; Q301-L305 HydrophobicContact CG-CD1 4.27Å; Q301-L305 WeakPolarHBondContact O-CB 3.46Å; Q301-L305 VanDerWaalsContact O-CG 3.3Å; Q301-L305 WeakPolarHBondContact O-CG 3.33Å; Q301-L305 PolarHBondContact O-N 2.89Å
302N91.8Very high86.3Confident113 Ų11377.3 Ų77.360%0.60442%0.416SS*.Hα-helixtrans-72.4-42-174.6-68.4-26.6000110.2D300 L305 S306D300-N302 PolarHBondContact OD1-N 3.12Å; N302-L305 WeakPolarHBondContact O-CB 3.22Å; N302-L305 PolarHBondContact O-N 2.82Å; N302-S306 PolarHBondContact O-N 3.17Å; N302-S306 PolarHBondContact O-OG 2.8Å
303R91.2Very high86.1Confident143 Ų14375.2 Ų75.254%0.5441%0.408SS..Hα-helixtrans-69-39.5176.1-63.8-178.461.3-174-5.9112E297 D300 L305 S306 R307E297-R303 HydrophobicContact CB-CB 3.9Å; E297-R303 HydrophobicContact CG-CB 3.95Å; E297-R303 IonicContact OE2-CZ 3.08Å; E297-R303 IonicContact OE2-NE 2.99Å; E297-R303 PolarHBondContact OE2-NE 3.44Å; E297-R303 IonicContact OE2-NH2 2.72Å; E297-R303 PolarHBondContact OE2-NH2 2.98Å; D300-R303 HydrophobicContact CB-CB 4.04Å; D300-R303 HydrophobicContact CB-CG 4.23Å; D300-R303 PolarHBondContact OD1-N 3.29Å; D300-R303 WeakPolarHBondContact OD2-CD 3.26Å; D300-R303 WeakPolarHBondContact OD2-CG 3.47Å; R303-L305 VanDerWaalsContact C-N 3.32Å; R303-L305 PolarHBondContact O-N 2.89Å; R303-S306 PolarHBondContact O-N 2.95Å; R303-R307 PolarHBondContact O-N 3.1Å
304A91.6Very high85.8Confident0 Ų079 Ų790%043%0.429CS..Hα-helixtrans-61.1-40.8172.100000111.6L280 A293 V294 D300 R307 L308L280-A304 HydrophobicContact CD1-CB 4.04Å; A293-A304 HydrophobicContact CB-CB 4.18Å; V294-A304 HydrophobicContact CG2-CB 4.22Å; D300-A304 WeakPolarHBondContact O-CB 3.46Å; D300-A304 PolarHBondContact O-N 3.36Å; A304-R307 PolarHBondContact O-N 2.96Å; A304-L308 WeakPolarHBondContact O-CB 3.47Å; A304-L308 WeakPolarHBondContact O-CD1 3.19Å; A304-L308 VanDerWaalsContact O-CG 3.24Å; A304-L308 WeakPolarHBondContact O-CG 3.1Å; A304-L308 PolarHBondContact O-N 3.02Å
305L91.9Very high85.4Confident33 Ų3383.4 Ų83.417%0.17345%0.452CS..Hα-helixtrans-62-47.2172.7-80.1170.6000112.4L280 M283 F285 Q301 N302 R303 R307 L308 L309L280-L305 HydrophobicContact CD2-CD2 3.43Å; L280-L305 VanDerWaalsContact CD2-CD2 3.43Å; L280-L305 HydrophobicContact CD2-CG 3.72Å; M283-L305 HydrophobicContact CE-CD1 4.28Å; M283-L305 HydrophobicContact CE-CD2 4.05Å; M283-L305 HydrophobicContact SD-CD1 4.48Å; M283-L305 HydrophobicContact SD-CD2 3.8Å; F285-L305 HydrophobicContact CE2-CD2 3.65Å; F285-L305 HydrophobicContact CZ-CD2 4.08Å; Q301-L305 HydrophobicContact CG-CD1 4.27Å; Q301-L305 WeakPolarHBondContact O-CB 3.46Å; Q301-L305 VanDerWaalsContact O-CG 3.3Å; Q301-L305 WeakPolarHBondContact O-CG 3.33Å; Q301-L305 PolarHBondContact O-N 2.89Å; N302-L305 WeakPolarHBondContact O-CB 3.22Å; N302-L305 PolarHBondContact O-N 2.82Å; R303-L305 VanDerWaalsContact C-N 3.32Å; R303-L305 PolarHBondContact O-N 2.89Å; L305-R307 PolarHBondContact O-N 2.75Å; L305-L308 PolarHBondContact O-N 2.9Å; L305-L308 VanDerWaalsContact O-N 3.1Å; L305-L309 WeakPolarHBondContact O-CB 3.34Å; L305-L309 WeakPolarHBondContact O-CG 3.02Å; L305-L309 PolarHBondContact O-N 3.09Å
306S90.3Very high85.1Confident78 Ų7885.9 Ų85.955%0.54546%0.459SS..Hα-helixtrans-60.3-24.6176.7-58.90000113.4N302 R303N302-S306 PolarHBondContact O-N 3.17Å; N302-S306 PolarHBondContact O-OG 2.8Å; R303-S306 PolarHBondContact O-N 2.95Å
307R88.9Confident84.7Confident128 Ų12886.8 Ų86.848%0.48346%0.461SS..Hα-helixtrans-85.1-31.3175.1-167.5-176-174.48910113.3E297 R303 A304 L305E297-R307 IonicContact OE1-NH1 2.65Å; E297-R307 PolarHBondContact OE1-NH1 2.87Å; R303-R307 PolarHBondContact O-N 3.1Å; A304-R307 PolarHBondContact O-N 2.96Å; L305-R307 PolarHBondContact O-N 2.75Å
308L89.1Confident84.2Confident20 Ų2090.9 Ų90.911%0.10548%0.484CS..Hα-helixtrans-82.2-30.6179.9-74.1168000112.9L280 F285 Q289 I290 A293 A304 L305L280-L308 HydrophobicContact CD1-CD1 4.09Å; L280-L308 HydrophobicContact CD2-CD1 3.82Å; L280-L308 HydrophobicContact CG-CD1 4.42Å; F285-L308 HydrophobicContact CB-CD1 4.41Å; F285-L308 HydrophobicContact CD1-CB 3.9Å; F285-L308 HydrophobicContact CD1-CD1 4.45Å; F285-L308 HydrophobicContact CD2-CD1 4.31Å; F285-L308 HydrophobicContact CE1-CB 3.84Å; F285-L308 HydrophobicContact CG-CB 4.42Å; F285-L308 HydrophobicContact CG-CD1 4.15Å; F285-L308 HydrophobicContact CZ-CB 4.32Å; Q289-L308 HydrophobicContact CB-CD2 3.56Å; I290-L308 HydrophobicContact CG1-CD1 4.29Å; A293-L308 HydrophobicContact CB-CD1 4.27Å; A293-L308 HydrophobicContact CB-CD2 4.14Å; A293-L308 HydrophobicContact CB-CG 3.91Å; A304-L308 WeakPolarHBondContact O-CB 3.47Å; A304-L308 WeakPolarHBondContact O-CD1 3.19Å; A304-L308 VanDerWaalsContact O-CG 3.24Å; A304-L308 WeakPolarHBondContact O-CG 3.1Å; A304-L308 PolarHBondContact O-N 3.02Å; L305-L308 PolarHBondContact O-N 2.9Å; L305-L308 VanDerWaalsContact O-N 3.1Å
309L88.3Confident83.9Confident93 Ų9385.7 Ų85.749%0.48747%0.467SS..SBendtrans-78.3130.4170.7-67.9172.5000109F285 L305 N311F285-L309 HydrophobicContact CE1-CD2 4.16Å; F285-L309 HydrophobicContact CZ-CD2 3.92Å; F285-L309 HydrophobicContact CZ-CG 4.31Å; L305-L309 WeakPolarHBondContact O-CB 3.34Å; L305-L309 WeakPolarHBondContact O-CG 3.02Å; L305-L309 PolarHBondContact O-N 3.09Å; L309-N311 PolarHBondContact O-N 3.29Å
310P77Confident83.6Confident115 Ų11591.6 Ų91.675%0.74750%0.496SS*.  trans-63134.6169.627.4-32.8000109.1S312P310-S312 PolarHBondContact O-N 2.8Å
311N61.3Low83Confident159 Ų15994 Ų9485%0.8551%0.51SS*.  trans-58110.8171.1-69.2-24.3000108.9L309L309-N311 PolarHBondContact O-N 3.29Å
312S43.1Very low82.2Confident186 Ų18697.1 Ų97.1100%1.30153%0.53SS*.  trans-87.90173.262.80000111.3P310P310-S312 PolarHBondContact O-N 2.8Å

Retrieved 312 of 312 residues in 53.9 ms (Link to these results)