A0A096MJD7_RAT Loading...

Phosphatidylinositol N-acetylglucosaminyltransferase subunit C

AlphaFold DB , UniProt , Accession A0A096MJD7, Species RAT (Rattus norvegicus, Rat), Gene Pigc, Length 133 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
1M36.5Very low47.5Very low246 Ų246144.3 Ų144.3100%1.21282%0.821SS**  0115.30-86.3168.1170.700107.6
2C44Very low49.9Very low130 Ų130140.1 Ų140.188%0.87880%0.8SS**  trans-77131.2-173.4-55.20000110.3
3A42.4Very low52.5Low101 Ų101140.7 Ų140.784%0.83579%0.788SS**  trans-135.679.715900000107.1H5A3-H5 PolarHBondContact O-N 3.12Å
4Q44.1Very low54.9Low183 Ų183135.1 Ų135.186%0.85575%0.749SS**  trans-74.599.4164.9-76.4173.1-38.700106.5V6Q4-V6 PolarHBondContact O-N 2.94Å; Q4-V6 VanDerWaalsContact O-N 3.13Å
5H41.6Very low56.8Low181 Ų181133.5 Ų133.584%0.83873%0.733SS**  trans-72.1102164.6-139.4-80.5000105.9A3 A7A3-H5 PolarHBondContact O-N 3.12Å; H5-A7 PolarHBondContact O-N 3.13Å
6V49.8Very low58.4Low131 Ų131133.6 Ų133.679%0.79472%0.724SS**  trans-67.990.1167.7178.90000105.4Q4 D8Q4-V6 PolarHBondContact O-N 2.94Å; Q4-V6 VanDerWaalsContact O-N 3.13Å; V6-D8 PolarHBondContact O-N 3.22Å
7A47.7Very low60Low72 Ų72129.8 Ų129.860%0.59571%0.706SS**  trans-66.2114165.600000105.8H5 T9H5-A7 PolarHBondContact O-N 3.13Å; A7-T9 PolarHBondContact O-N 2.89Å
8D42.1Very low61.2Low139 Ų139130.4 Ų130.474%0.74371%0.708SS**  trans-41.4108163.3-175.431.2000107.9V6 S10V6-D8 PolarHBondContact O-N 3.22Å; D8-S10 PolarHBondContact O-N 2.75Å
9T48.1Very low62.3Low132 Ų132134.7 Ų134.781%0.8171%0.714SS**  trans-74.567.3177.751.60000107.5A7 E11A7-T9 PolarHBondContact O-N 2.89Å; T9-E11 PolarHBondContact O-N 2.92Å; T9-E11 VanDerWaalsContact O-N 3.12Å
10S58Low63.5Low85 Ų85133.6 Ų133.659%0.59471%0.705SS**  trans-55.4114.215353.40000105.4D8 V12D8-S10 PolarHBondContact O-N 2.75Å; S10-V12 PolarHBondContact O-N 2.87Å
11E68.7Low64.4Low187 Ų187139.1 Ų139.187%0.87472%0.716SS**  trans-50.6112.8176.2-73.3-173.9153.600108T9 K13T9-E11 PolarHBondContact O-N 2.92Å; T9-E11 VanDerWaalsContact O-N 3.12Å; E11-K13 PolarHBondContact O-N 3.19Å
12V76Confident66.8Low94 Ų94129.6 Ų129.657%0.5767%0.669SS**  trans-67.6102.8179.7-179.80000106.5S10 P23 F24S10-V12 PolarHBondContact O-N 2.87Å; V12-P23 HydrophobicContact CB-CG 4.31Å; V12-P23 HydrophobicContact CG1-CG 3.72Å; V12-F24 HydrophobicContact CG1-CE2 4.35Å; V12-F24 WeakPolarHBondContact O-CZ 3.32Å
13K84.1Confident69Low148 Ų148128.3 Ų128.364%0.64366%0.658SS**  trans-83.6134.7178.1-168.3176.8-177.1176.10109.3E11 Q15E11-K13 PolarHBondContact O-N 3.19Å; K13-Q15 PolarHBondContact O-N 3.48Å
14W85Confident71.1Confident63 Ų63126.1 Ų126.124%0.23963%0.63CS.*  trans-57136.7172.3179.290.1000110.9K16 F24 Y28 D30W14-K16 HydrophobicContact CH2-CB 3.63Å; W14-K16 HydrophobicContact CH2-CD 4.41Å; W14-K16 HydrophobicContact CH2-CG 3.79Å; W14-K16 HydrophobicContact CZ2-CB 4.48Å; W14-K16 HydrophobicContact CZ3-CB 3.78Å; W14-K16 HydrophobicContact CZ3-CG 4.36Å; W14-F24 VanDerWaalsContact CA-CE2 3.41Å; W14-F24 HydrophobicContact CB-CD1 4.4Å; W14-F24 HydrophobicContact CB-CD2 4Å; W14-F24 HydrophobicContact CB-CE1 4.08Å; W14-F24 HydrophobicContact CB-CE2 3.67Å; W14-F24 HydrophobicContact CB-CG 4.37Å; W14-F24 HydrophobicContact CB-CZ 3.71Å; W14-F24 AromaticContact CD1-CD2 3.71Å; W14-F24 AromaticContact CD1-CG 3.8Å; W14-F24 HydrophobicContact CG-CD2 4.27Å; W14-F24 HydrophobicContact CG-CE2 4.4Å; W14-F24 HydrophobicContact CG-CG 4.5Å; W14-Y28 HydrophobicContact CB-CD1 4.23Å; W14-Y28 HydrophobicContact CB-CE1 3.69Å; W14-Y28 AromaticContact CD1-CD1 3.36Å; W14-Y28 AromaticContact CD1-CE1 3.74Å; W14-Y28 HydrophobicContact CD2-CD1 4.32Å; W14-Y28 HydrophobicContact CD2-CE1 4.26Å; W14-Y28 AromaticContact CG-CD1 3.72Å; W14-Y28 HydrophobicContact CG-CD1 3.72Å; W14-Y28 AromaticContact CG-CE1 3.61Å; W14-Y28 HydrophobicContact CG-CE1 3.61Å; W14-Y28 AromaticContact NE1-CD1 3.72Å; W14-D30 HydrophobicContact CD2-CB 4.3Å; W14-D30 HydrophobicContact CE3-CB 3.59Å; W14-D30 HydrophobicContact CZ3-CB 3.7Å
15Q83.8Confident73.2Confident110 Ų110121.9 Ų121.951%0.51462%0.618SS.*  trans-122.9140.7177.9-58.1-171.710.300110.8K13 V17 Q22K13-Q15 PolarHBondContact O-N 3.48Å; Q15-V17 HydrophobicContact CB-CG2 4.09Å; Q15-V17 PolarHBondContact O-N 3.47Å; Q15-Q22 PolarHBondContact O-NE2 3.47Å; Q15-Q22 PolarHBondContact O-OE1 2.97Å
16K83.1Confident75.2Confident136 Ų136121.5 Ų121.559%0.59162%0.623SS**  trans-80.864.6179.2-163.6177.9-169.6175.90111.2W14 E36W14-K16 HydrophobicContact CH2-CB 3.63Å; W14-K16 HydrophobicContact CH2-CD 4.41Å; W14-K16 HydrophobicContact CH2-CG 3.79Å; W14-K16 HydrophobicContact CZ2-CB 4.48Å; W14-K16 HydrophobicContact CZ3-CB 3.78Å; W14-K16 HydrophobicContact CZ3-CG 4.36Å; K16-E36 IonicContact NZ-OE2 2.78Å; K16-E36 PolarHBondContact NZ-OE2 2.79Å
17V84.4Confident76.8Confident68 Ų68122.7 Ų122.741%0.41263%0.625SS.*  trans-116.3131-179.9-178.60000108.9Q15 Y19 E20Q15-V17 HydrophobicContact CB-CG2 4.09Å; Q15-V17 PolarHBondContact O-N 3.47Å; V17-Y19 PolarHBondContact O-N 3.36Å; V17-E20 HydrophobicContact CB-CB 4.11Å; V17-E20 HydrophobicContact CG1-CB 3.73Å
18L82.2Confident78.7Confident141 Ų141123.5 Ų123.574%0.73861%0.613SS**SBendtrans-72-30-168.2-173.161.5000114.5
19Y82.8Confident80.6Confident212 Ų212121.1 Ų121.183%0.83160%0.603SS**SBendtrans-125.88.3-169.3-61.1-66.7000114.7V17V17-Y19 PolarHBondContact O-N 3.36Å
20E85.3Confident82.4Confident113 Ų113116.6 Ų116.653%0.52857%0.574SS.*  trans-91.9131.9-178.4-169.1165.3-172.400110.9V17 Q22V17-E20 HydrophobicContact CB-CB 4.11Å; V17-E20 HydrophobicContact CG1-CB 3.73Å; E20-Q22 PolarHBondContact O-N 2.93Å
21R82.5Confident83.7Confident249 Ų249120.9 Ų120.994%0.9459%0.585SS**  trans-75.2115.2176.5-83.4-173.9167.5178.7-2.9109.7
22Q87.4Confident84.2Confident47 Ų47118.6 Ų118.622%0.2257%0.568CS.*  trans-120.5154.5179.4-59.4176.64900110.8Q15 E20 F24Q15-Q22 PolarHBondContact O-NE2 3.47Å; Q15-Q22 PolarHBondContact O-OE1 2.97Å; E20-Q22 PolarHBondContact O-N 2.93Å; Q22-F24 HydrophobicContact CB-CD2 3.86Å; Q22-F24 PolarHBondContact O-N 3.32Å
23P89.6Confident84.6Confident102 Ų102118.1 Ų118.166%0.66256%0.558SS**SBendtrans-79.144.7-17935.2-37.4000112.5V12V12-P23 HydrophobicContact CB-CG 4.31Å; V12-P23 HydrophobicContact CG1-CG 3.72Å
24F86.9Confident84.5Confident56 Ų56117 Ų11725%0.24656%0.559CS.*SBendtrans-123.6147.1177.7-63.6-82.9000109.6V12 W14 Q22 Y28V12-F24 HydrophobicContact CG1-CE2 4.35Å; V12-F24 WeakPolarHBondContact O-CZ 3.32Å; W14-F24 VanDerWaalsContact CA-CE2 3.41Å; W14-F24 HydrophobicContact CB-CD1 4.4Å; W14-F24 HydrophobicContact CB-CD2 4Å; W14-F24 HydrophobicContact CB-CE1 4.08Å; W14-F24 HydrophobicContact CB-CE2 3.67Å; W14-F24 HydrophobicContact CB-CG 4.37Å; W14-F24 HydrophobicContact CB-CZ 3.71Å; W14-F24 AromaticContact CD1-CD2 3.71Å; W14-F24 AromaticContact CD1-CG 3.8Å; W14-F24 HydrophobicContact CG-CD2 4.27Å; W14-F24 HydrophobicContact CG-CE2 4.4Å; W14-F24 HydrophobicContact CG-CG 4.5Å; Q22-F24 HydrophobicContact CB-CD2 3.86Å; Q22-F24 PolarHBondContact O-N 3.32Å; F24-Y28 HydrophobicContact CB-CD1 4.26Å; F24-Y28 HydrophobicContact CB-CG 4.14Å; F24-Y28 AromaticContact CD1-CD1 3.94Å; F24-Y28 HydrophobicContact CD1-CD1 3.94Å; F24-Y28 HydrophobicContact CD1-CD2 4.19Å; F24-Y28 AromaticContact CD1-CE1 3.97Å; F24-Y28 HydrophobicContact CD1-CE1 3.97Å; F24-Y28 HydrophobicContact CD1-CE2 4.22Å; F24-Y28 HydrophobicContact CD1-CG 4.04Å; F24-Y28 HydrophobicContact CE1-CE1 4.26Å; F24-Y28 HydrophobicContact CG-CD1 4.22Å; F24-Y28 HydrophobicContact CG-CG 4.41Å
25P87.8Confident84.3Confident93 Ų93120.7 Ų120.760%0.60458%0.579SS**  trans-65.1151175.425.2-29.9000110.8N27 Y28P25-N27 PolarHBondContact O-N 3.25Å; P25-Y28 WeakPolarHBondContact O-CB 3.42Å; P25-Y28 PolarHBondContact O-N 3.37Å
26D83.7Confident84.1Confident173 Ų173120.7 Ų120.793%0.92558%0.579SS**THydrogen-bonded Turntrans-54.8-27.6-177.2-99.515.7000114.2
27N84.9Confident84Confident157 Ų157118.3 Ų118.384%0.8457%0.572SS**THydrogen-bonded Turntrans-92.57.6179-66.7-21000113.6P25 V29P25-N27 PolarHBondContact O-N 3.25Å; N27-V29 PolarHBondContact O-N 2.98Å
28Y86.1Confident83.7Confident88 Ų88124 Ų12435%0.34559%0.586SS.*  trans-72.3128.4178.8-173.4-91.9000110.8W14 F24 P25W14-Y28 HydrophobicContact CB-CD1 4.23Å; W14-Y28 HydrophobicContact CB-CE1 3.69Å; W14-Y28 AromaticContact CD1-CD1 3.36Å; W14-Y28 AromaticContact CD1-CE1 3.74Å; W14-Y28 HydrophobicContact CD2-CD1 4.32Å; W14-Y28 HydrophobicContact CD2-CE1 4.26Å; W14-Y28 AromaticContact CG-CD1 3.72Å; W14-Y28 HydrophobicContact CG-CD1 3.72Å; W14-Y28 AromaticContact CG-CE1 3.61Å; W14-Y28 HydrophobicContact CG-CE1 3.61Å; W14-Y28 AromaticContact NE1-CD1 3.72Å; F24-Y28 HydrophobicContact CB-CD1 4.26Å; F24-Y28 HydrophobicContact CB-CG 4.14Å; F24-Y28 AromaticContact CD1-CD1 3.94Å; F24-Y28 HydrophobicContact CD1-CD1 3.94Å; F24-Y28 HydrophobicContact CD1-CD2 4.19Å; F24-Y28 AromaticContact CD1-CE1 3.97Å; F24-Y28 HydrophobicContact CD1-CE1 3.97Å; F24-Y28 HydrophobicContact CD1-CE2 4.22Å; F24-Y28 HydrophobicContact CD1-CG 4.04Å; F24-Y28 HydrophobicContact CE1-CE1 4.26Å; F24-Y28 HydrophobicContact CG-CD1 4.22Å; F24-Y28 HydrophobicContact CG-CG 4.41Å; P25-Y28 WeakPolarHBondContact O-CB 3.42Å; P25-Y28 PolarHBondContact O-N 3.37Å
29V81.9Confident83.3Confident89 Ų89126.1 Ų126.154%0.53959%0.589SS.*  trans-123.3139.2168.8-66.90000108.7N27 F33N27-V29 PolarHBondContact O-N 2.98Å; V29-F33 HydrophobicContact CB-CB 4.42Å; V29-F33 HydrophobicContact CB-CG 4.47Å
30D87.1Confident82.6Confident37 Ų37122 Ų12220%0.19858%0.582CS.*  trans-66.3151.6176.2-173.729.6000111.4W14 R32 F33W14-D30 HydrophobicContact CD2-CB 4.3Å; W14-D30 HydrophobicContact CE3-CB 3.59Å; W14-D30 HydrophobicContact CZ3-CB 3.7Å; D30-R32 PolarHBondContact O-N 3.19Å; D30-R32 WeakPolarHBondContact OD2-CB 3.17Å; D30-R32 WeakPolarHBondContact OD2-CG 3.32Å; D30-F33 WeakPolarHBondContact O-CB 3.43Å; D30-F33 PolarHBondContact O-N 2.9Å
31Q83.9Confident81.9Confident175 Ų175120.6 Ų120.682%0.81858%0.577SS**G310 helixtrans-60.5-30178.6-64.9-176.8-6.300111.8F33Q31-F33 PolarHBondContact O-N 3.47Å
32R80.6Confident81.5Confident140 Ų140118.5 Ų118.553%0.52857%0.571SS.*G310 helixtrans-76.5-8178-48.9-172.797.7175.413.6113.5D30 L34 E35 E36D30-R32 PolarHBondContact O-N 3.19Å; D30-R32 WeakPolarHBondContact OD2-CB 3.17Å; D30-R32 WeakPolarHBondContact OD2-CG 3.32Å; R32-L34 VanDerWaalsContact C-N 3.26Å; R32-L34 PolarHBondContact O-N 2.86Å; R32-E35 IonicContact NE-OE2 3.81Å; R32-E35 PolarHBondContact NE-OE2 3.49Å; R32-E35 WeakPolarHBondContact O-CA 3.09Å; R32-E35 WeakPolarHBondContact O-CB 3.48Å; R32-E35 PolarHBondContact O-N 3.26Å; R32-E36 PolarHBondContact O-N 3.37Å
33F83.5Confident80.8Confident83 Ų83119 Ų11936%0.36458%0.583SS.*G310 helixtrans-53.5-44.7179.8172.8-101.9000112.1V29 D30 Q31 E35 E36 L37V29-F33 HydrophobicContact CB-CB 4.42Å; V29-F33 HydrophobicContact CB-CG 4.47Å; D30-F33 WeakPolarHBondContact O-CB 3.43Å; D30-F33 PolarHBondContact O-N 2.9Å; Q31-F33 PolarHBondContact O-N 3.47Å; F33-E35 VanDerWaalsContact C-N 3.34Å; F33-E36 PolarHBondContact O-N 2.82Å; F33-L37 HydrophobicContact CE1-CD1 4.3Å; F33-L37 HydrophobicContact CZ-CD2 4.42Å; F33-L37 PolarHBondContact O-N 3.48Å
34L82.2Confident79.8Confident125 Ų125124 Ų12465%0.65459%0.588SS**THydrogen-bonded Turntrans-73.3-28.2178.4-62.8-179.8000112.3R32 E36 L37R32-L34 VanDerWaalsContact C-N 3.26Å; R32-L34 PolarHBondContact O-N 2.86Å; L34-E36 VanDerWaalsContact C-N 3.31Å; L34-L37 HydrophobicContact CD2-CD1 3.58Å; L34-L37 WeakPolarHBondContact O-CB 3.47Å; L34-L37 PolarHBondContact O-N 3.02Å
35E81.1Confident79.2Confident140 Ų140130.5 Ų130.565%0.65462%0.617SS**THydrogen-bonded Turntrans-68-33.8173.5-55.5179.5165.600111.2R32 F33 L37R32-E35 IonicContact NE-OE2 3.81Å; R32-E35 PolarHBondContact NE-OE2 3.49Å; R32-E35 WeakPolarHBondContact O-CA 3.09Å; R32-E35 WeakPolarHBondContact O-CB 3.48Å; R32-E35 PolarHBondContact O-N 3.26Å; F33-E35 VanDerWaalsContact C-N 3.34Å; E35-L37 VanDerWaalsContact C-N 3.3Å; E35-L37 PolarHBondContact O-N 2.91Å
36E79.3Confident78.4Confident110 Ų110134.4 Ų134.451%0.51462%0.62SS.*SBendtrans-77.3-11.7176-70.7-176.4179.200113.7K16 R32 F33 L34 R38K16-E36 IonicContact NZ-OE2 2.78Å; K16-E36 PolarHBondContact NZ-OE2 2.79Å; R32-E36 PolarHBondContact O-N 3.37Å; F33-E36 PolarHBondContact O-N 2.82Å; L34-E36 VanDerWaalsContact C-N 3.31Å; E36-R38 VanDerWaalsContact C-N 3.32Å; E36-R38 PolarHBondContact O-N 2.8Å
37L81.5Confident78.3Confident87 Ų87132.7 Ų132.746%0.45561%0.607SS.*  trans-70.786.8178.4-75.4-179.5000111.2F33 L34 E35 K39F33-L37 HydrophobicContact CE1-CD1 4.3Å; F33-L37 HydrophobicContact CZ-CD2 4.42Å; F33-L37 PolarHBondContact O-N 3.48Å; L34-L37 HydrophobicContact CD2-CD1 3.58Å; L34-L37 WeakPolarHBondContact O-CB 3.47Å; L34-L37 PolarHBondContact O-N 3.02Å; E35-L37 VanDerWaalsContact C-N 3.3Å; E35-L37 PolarHBondContact O-N 2.91Å; L37-K39 PolarHBondContact O-N 3.32Å
38R77.6Confident78.2Confident187 Ų187133.4 Ų133.471%0.70660%0.599SS**  trans-79.4103.8169.2-63.4-165.776.5176.35.1110.4E36 I41E36-R38 VanDerWaalsContact C-N 3.32Å; E36-R38 PolarHBondContact O-N 2.8Å; R38-I41 HydrophobicContact CB-CD1 3.45Å; R38-I41 VanDerWaalsContact CB-CD1 3.45Å; R38-I41 HydrophobicContact CB-CG1 3.55Å; R38-I41 HydrophobicContact CG-CD1 4.15Å; R38-I41 HydrophobicContact CG-CG1 4.44Å
39K73.8Confident78.4Confident185 Ų185137.6 Ų137.680%0.80461%0.614SS**  trans-85.3132.7170.6-67-179.6-176.2173.10110.3L37 I41L37-K39 PolarHBondContact O-N 3.32Å; K39-I41 PolarHBondContact O-N 3.37Å
40N68.7Low78.5Confident127 Ų127135.9 Ų135.968%0.67961%0.61SS**  trans55.248.4166.1-152.2-0.6000115.1Y42 A43N40-Y42 PolarHBondContact O-N 3.4Å; N40-Y42 VanDerWaalsContact O-N 3.16Å; N40-A43 PolarHBondContact O-N 3.16Å; N40-A43 WeakPolarHBondContact OD1-CB 3.42Å; N40-A43 PolarHBondContact OD1-N 3.3Å
41I69.3Low78.5Confident82 Ų82137.6 Ų137.642%0.42162%0.621SS.*THydrogen-bonded Turntrans-58.4-27.8-179.8-55.1171.4000112.2R38 K39R38-I41 HydrophobicContact CB-CD1 3.45Å; R38-I41 VanDerWaalsContact CB-CD1 3.45Å; R38-I41 HydrophobicContact CB-CG1 3.55Å; R38-I41 HydrophobicContact CG-CD1 4.15Å; R38-I41 HydrophobicContact CG-CG1 4.44Å; K39-I41 PolarHBondContact O-N 3.37Å
42Y74.5Confident78.7Confident206 Ų206131.7 Ų131.781%0.80860%0.597SS**THydrogen-bonded Turntrans-109.623.8-172.5-57.8-70.6000114N40 R44N40-Y42 PolarHBondContact O-N 3.4Å; N40-Y42 VanDerWaalsContact O-N 3.16Å; Y42-R44 PolarHBondContact O-N 3.08Å
43A72.4Confident79Confident57 Ų57131.7 Ų131.747%0.47160%0.601SS.*  trans-60.9106175.800000111N40 K45N40-A43 PolarHBondContact O-N 3.16Å; N40-A43 WeakPolarHBondContact OD1-CB 3.42Å; N40-A43 PolarHBondContact OD1-N 3.3Å; A43-K45 PolarHBondContact O-N 3.33Å
44R69.1Low79.2Confident208 Ų208134.9 Ų134.979%0.78562%0.617SS**  trans-73.3114.2171.8-90.3175.1-177.91572.3109.7Y42 Y46Y42-R44 PolarHBondContact O-N 3.08Å; R44-Y46 HydrophobicContact CB-CD2 4.27Å; R44-Y46 HydrophobicContact CB-CE2 3.89Å; R44-Y46 PolarHBondContact O-N 3.5Å
45K73.4Confident79.5Confident192 Ų192131.3 Ų131.384%0.83560%0.602SS**  trans-79.596.6168.9-64.8-171.2-179.8-176.70108.7A43A43-K45 PolarHBondContact O-N 3.33Å
46Y72.5Confident80.1Confident174 Ų174127.1 Ų127.168%0.68259%0.589SS**  trans-69.7129.3170.2-75.9-89.2000109.5R44 Y48 V51R44-Y46 HydrophobicContact CB-CD2 4.27Å; R44-Y46 HydrophobicContact CB-CE2 3.89Å; R44-Y46 PolarHBondContact O-N 3.5Å; Y46-Y48 PolarHBondContact O-N 3.05Å; Y46-V51 HydrophobicContact CD1-CG2 4.03Å; Y46-V51 HydrophobicContact CG-CG2 4.35Å
47Q81.6Confident80.7Confident137 Ų137126.1 Ų126.164%0.6459%0.59SS**  trans-72117.7170.6-63.8-61.4-51.300107.7W49 A50 V51Q47-W49 VanDerWaalsContact C-N 3.26Å; Q47-W49 PolarHBondContact O-N 3.18Å; Q47-A50 HydrophobicContact CB-CB 4.15Å; Q47-A50 WeakPolarHBondContact O-CB 3.47Å; Q47-A50 PolarHBondContact O-N 3.27Å; Q47-V51 PolarHBondContact O-N 3.38Å
48Y83Confident81.2Confident172 Ų172127.1 Ų127.168%0.67560%0.599SS**Hα-helixtrans-49.7-47.4-176.2176.5-100.7000112.2Y46 A50 V51 V52Y46-Y48 PolarHBondContact O-N 3.05Å; Y48-A50 PolarHBondContact O-N 3.23Å; Y48-V51 PolarHBondContact O-N 3.21Å; Y48-V52 HydrophobicContact CD1-CG2 4.06Å; Y48-V52 HydrophobicContact CE1-CG2 3.66Å; Y48-V52 HydrophobicContact CE2-CG2 4.18Å; Y48-V52 HydrophobicContact CG-CG2 4.48Å; Y48-V52 WeakPolarHBondContact O-CG2 3.23Å; Y48-V52 PolarHBondContact O-N 2.98Å
49W88.5Confident82Confident176 Ų176122.9 Ų122.967%0.66759%0.59SS**Hα-helixtrans-59.9-41.3179.5-71.9108.5000113.8Q47 V51 V52 F53Q47-W49 VanDerWaalsContact C-N 3.26Å; Q47-W49 PolarHBondContact O-N 3.18Å; W49-V51 VanDerWaalsContact C-N 3.3Å; W49-V51 PolarHBondContact O-N 3.33Å; W49-V52 PolarHBondContact O-N 2.9Å; W49-F53 HydrophobicContact CE3-CE2 4.42Å; W49-F53 WeakPolarHBondContact O-CD2 3.46Å; W49-F53 PolarHBondContact O-N 3.39Å
50A85.9Confident82.9Confident54 Ų54120.4 Ų120.445%0.44658%0.581SS.*Hα-helixtrans-61.6-43.717800000110.6Q47 Y48 V52 F53 E54Q47-A50 HydrophobicContact CB-CB 4.15Å; Q47-A50 WeakPolarHBondContact O-CB 3.47Å; Q47-A50 PolarHBondContact O-N 3.27Å; Y48-A50 PolarHBondContact O-N 3.23Å; A50-V52 VanDerWaalsContact C-N 3.33Å; A50-V52 PolarHBondContact O-N 3.26Å; A50-F53 PolarHBondContact O-N 3.33Å; A50-E54 VanDerWaalsContact O-CG 3.28Å; A50-E54 WeakPolarHBondContact O-CG 3.48Å; A50-E54 PolarHBondContact O-N 3.39Å
51V86.3Confident84.2Confident72 Ų72120.3 Ų120.344%0.43658%0.576SS.*Hα-helixtrans-64.5-39.2177.3-176.80000111.4Y46 Q47 Y48 W49 E54 S55Y46-V51 HydrophobicContact CD1-CG2 4.03Å; Y46-V51 HydrophobicContact CG-CG2 4.35Å; Q47-V51 PolarHBondContact O-N 3.38Å; Y48-V51 PolarHBondContact O-N 3.21Å; W49-V51 VanDerWaalsContact C-N 3.3Å; W49-V51 PolarHBondContact O-N 3.33Å; V51-E54 PolarHBondContact O-N 2.99Å; V51-S55 VanDerWaalsContact O-CB 3.31Å; V51-S55 WeakPolarHBondContact O-CB 3.27Å; V51-S55 PolarHBondContact O-N 2.96Å; V51-S55 PolarHBondContact O-OG 2.89Å; V51-S55 VanDerWaalsContact O-OG 3.13Å
52V87.8Confident85.5Confident51 Ų51121.9 Ų121.931%0.30959%0.585SS.*Hα-helixtrans-61.7-48.2175.91730000110.9Y48 W49 A50 E54 S55 S56Y48-V52 HydrophobicContact CD1-CG2 4.06Å; Y48-V52 HydrophobicContact CE1-CG2 3.66Å; Y48-V52 HydrophobicContact CE2-CG2 4.18Å; Y48-V52 HydrophobicContact CG-CG2 4.48Å; Y48-V52 WeakPolarHBondContact O-CG2 3.23Å; Y48-V52 PolarHBondContact O-N 2.98Å; W49-V52 PolarHBondContact O-N 2.9Å; A50-V52 VanDerWaalsContact C-N 3.33Å; A50-V52 PolarHBondContact O-N 3.26Å; V52-E54 PolarHBondContact O-N 3.5Å; V52-S55 WeakPolarHBondContact CA-OG 3.45Å; V52-S55 PolarHBondContact O-N 3.34Å; V52-S55 PolarHBondContact O-OG 3.27Å; V52-S56 WeakPolarHBondContact O-CB 3.47Å; V52-S56 PolarHBondContact O-N 2.91Å
53F87.1Confident86.4Confident141 Ų141115.3 Ų115.362%0.61857%0.569SS**Hα-helixtrans-60.3-45.5177.4-79.6-67.3000112.3W49 A50 S55 S56W49-F53 HydrophobicContact CE3-CE2 4.42Å; W49-F53 WeakPolarHBondContact O-CD2 3.46Å; W49-F53 PolarHBondContact O-N 3.39Å; A50-F53 PolarHBondContact O-N 3.33Å; F53-S55 VanDerWaalsContact C-N 3.35Å; F53-S55 PolarHBondContact O-N 3.15Å; F53-S56 WeakPolarHBondContact O-CB 3.28Å; F53-S56 PolarHBondContact O-N 3.11Å; F53-S56 PolarHBondContact O-OG 2.94Å
54E87.1Confident87.5Confident150 Ų150116 Ų11670%0.70157%0.57SS**Hα-helixtrans-63.2-41.2177.6-66.9-63150.900111.7A50 V51 V52 S56A50-E54 VanDerWaalsContact O-CG 3.28Å; A50-E54 WeakPolarHBondContact O-CG 3.48Å; A50-E54 PolarHBondContact O-N 3.39Å; V51-E54 PolarHBondContact O-N 2.99Å; V52-E54 PolarHBondContact O-N 3.5Å; E54-S56 VanDerWaalsContact C-N 3.3Å; E54-S56 PolarHBondContact O-N 3.37Å
55S90.1Very high88.8Confident49 Ų49110.3 Ų110.334%0.34356%0.558SS.*Hα-helixtrans-71.3-23.7177.871.20000113.9V51 V52 F53 V57 V58 I59V51-S55 VanDerWaalsContact O-CB 3.31Å; V51-S55 WeakPolarHBondContact O-CB 3.27Å; V51-S55 PolarHBondContact O-N 2.96Å; V51-S55 PolarHBondContact O-OG 2.89Å; V51-S55 VanDerWaalsContact O-OG 3.13Å; V52-S55 WeakPolarHBondContact CA-OG 3.45Å; V52-S55 PolarHBondContact O-N 3.34Å; V52-S55 PolarHBondContact O-OG 3.27Å; F53-S55 VanDerWaalsContact C-N 3.35Å; F53-S55 PolarHBondContact O-N 3.15Å; S55-V57 PolarHBondContact O-N 3.47Å; S55-V58 PolarHBondContact O-N 2.87Å; S55-I59 PolarHBondContact O-N 3.4Å
56S91.9Very high89.9Confident52 Ų52104.4 Ų104.436%0.36454%0.54SS..Hα-helixtrans-62.5-30.8-175.875.10000112.8V52 F53 E54 V58 I59 Q60V52-S56 WeakPolarHBondContact O-CB 3.47Å; V52-S56 PolarHBondContact O-N 2.91Å; F53-S56 WeakPolarHBondContact O-CB 3.28Å; F53-S56 PolarHBondContact O-N 3.11Å; F53-S56 PolarHBondContact O-OG 2.94Å; E54-S56 VanDerWaalsContact C-N 3.3Å; E54-S56 PolarHBondContact O-N 3.37Å; S56-V58 VanDerWaalsContact C-N 3.33Å; S56-V58 PolarHBondContact O-N 3.48Å; S56-I59 PolarHBondContact O-N 3.05Å; S56-Q60 WeakPolarHBondContact O-CB 3.47Å; S56-Q60 PolarHBondContact O-N 3.33Å
57V91.7Very high90.9Very high90 Ų90100 Ų10055%0.54553%0.531SS..Hα-helixtrans-61.8-43.4179179.40000110.8S55 Q60 Q61S55-V57 PolarHBondContact O-N 3.47Å; V57-Q60 PolarHBondContact O-N 2.93Å; V57-Q61 WeakPolarHBondContact O-CG 3.37Å; V57-Q61 PolarHBondContact O-N 3.03Å
58V92.6Very high91.4Very high107 Ų107100 Ų10065%0.64853%0.529SS*.Hα-helixtrans-67.9-42178.5-178.60000110.5S55 S56 Q60 Q61 L62S55-V58 PolarHBondContact O-N 2.87Å; S56-V58 VanDerWaalsContact C-N 3.33Å; S56-V58 PolarHBondContact O-N 3.48Å; V58-Q60 VanDerWaalsContact C-N 3.31Å; V58-Q60 PolarHBondContact O-N 2.91Å; V58-Q61 PolarHBondContact O-N 3.01Å; V58-L62 PolarHBondContact O-N 3.28Å
59I94Very high92Very high99 Ų9995.8 Ų95.851%0.50852%0.521SS..Hα-helixtrans-63-39.8177.8-62.8170.5000110.8S55 S56 Q61 L62 C63S55-I59 PolarHBondContact O-N 3.4Å; S56-I59 PolarHBondContact O-N 3.05Å; I59-Q61 PolarHBondContact O-N 3.47Å; I59-L62 PolarHBondContact O-N 3.44Å; I59-C63 WeakPolarHBondContact O-CB 3.09Å; I59-C63 PolarHBondContact O-N 2.99Å
60Q94.3Very high92.2Very high133 Ų13391 Ų9162%0.62151%0.511SS*.Hα-helixtrans-61.5-44.5177.3-175.566.914.400111.5S56 V57 V58 C63 S64S56-Q60 WeakPolarHBondContact O-CB 3.47Å; S56-Q60 PolarHBondContact O-N 3.33Å; V57-Q60 PolarHBondContact O-N 2.93Å; V58-Q60 VanDerWaalsContact C-N 3.31Å; V58-Q60 PolarHBondContact O-N 2.91Å; Q60-C63 PolarHBondContact O-N 3.21Å; Q60-S64 WeakPolarHBondContact O-CB 3.39Å; Q60-S64 PolarHBondContact O-N 3.43Å
61Q95.3Very high92.4Very high124 Ų12491.1 Ų91.158%0.57950%0.504SS*.Hα-helixtrans-65-43.5177.4-66.1-61.7-14.300111.3V57 V58 I59 S64 V65V57-Q61 WeakPolarHBondContact O-CG 3.37Å; V57-Q61 PolarHBondContact O-N 3.03Å; V58-Q61 PolarHBondContact O-N 3.01Å; I59-Q61 PolarHBondContact O-N 3.47Å; Q61-S64 WeakPolarHBondContact O-CB 3.34Å; Q61-S64 PolarHBondContact O-N 3.23Å; Q61-V65 WeakPolarHBondContact O-CG2 3.23Å; Q61-V65 PolarHBondContact O-N 3.43Å; Q61-V65 VanDerWaalsContact O-N 3.11Å
62L95.7Very high92.5Very high115 Ų11595.5 Ų95.560%0.60251%0.513SS*.Hα-helixtrans-60.8-46.5175.8-172.870.8000111.6V58 I59 S64 V65 C66V58-L62 PolarHBondContact O-N 3.28Å; I59-L62 PolarHBondContact O-N 3.44Å; L62-S64 VanDerWaalsContact C-N 3.32Å; L62-S64 PolarHBondContact O-N 2.95Å; L62-V65 PolarHBondContact O-N 3.41Å; L62-C66 PolarHBondContact O-N 3.44Å; L62-C66 PolarHBondContact O-SG 3.12Å
63C95.3Very high92.7Very high69 Ų69100.7 Ų100.747%0.46653%0.527SS..Hα-helixtrans-58.8-42.3175.4-96.70000111.9I59 Q60 V65 C66 V67I59-C63 WeakPolarHBondContact O-CB 3.09Å; I59-C63 PolarHBondContact O-N 2.99Å; Q60-C63 PolarHBondContact O-N 3.21Å; C63-V65 VanDerWaalsContact C-N 3.35Å; C63-V65 PolarHBondContact O-N 3.41Å; C63-C66 PolarHBondContact O-N 2.9Å; C63-V67 WeakPolarHBondContact O-CB 3.44Å; C63-V67 VanDerWaalsContact O-CG2 3.29Å; C63-V67 WeakPolarHBondContact O-CG2 3.31Å; C63-V67 PolarHBondContact O-N 2.86Å
64S94.6Very high92.7Very high70 Ų7099.5 Ų99.549%0.4952%0.519SS..Hα-helixtrans-57.7-46.8176.9-173.30000111.7Q60 Q61 L62 V67 F68Q60-S64 WeakPolarHBondContact O-CB 3.39Å; Q60-S64 PolarHBondContact O-N 3.43Å; Q61-S64 WeakPolarHBondContact O-CB 3.34Å; Q61-S64 PolarHBondContact O-N 3.23Å; L62-S64 VanDerWaalsContact C-N 3.32Å; L62-S64 PolarHBondContact O-N 2.95Å; S64-V67 PolarHBondContact O-N 3.13Å; S64-F68 WeakPolarHBondContact O-CB 3.28Å; S64-F68 PolarHBondContact O-N 3.46Å
65V96.5Very high92.8Very high90 Ų9096.1 Ų96.155%0.54550%0.504SS..Hα-helixtrans-63-46.3176.6177.20000111.1Q61 L62 C63 V67 F68 V69Q61-V65 WeakPolarHBondContact O-CG2 3.23Å; Q61-V65 PolarHBondContact O-N 3.43Å; Q61-V65 VanDerWaalsContact O-N 3.11Å; L62-V65 PolarHBondContact O-N 3.41Å; C63-V65 VanDerWaalsContact C-N 3.35Å; C63-V65 PolarHBondContact O-N 3.41Å; V65-V67 PolarHBondContact O-N 2.88Å; V65-F68 PolarHBondContact O-N 3.3Å; V65-V69 WeakPolarHBondContact O-CG2 3.11Å; V65-V69 PolarHBondContact O-N 3.46Å
66C96.2Very high92.7Very high67 Ų6799.8 Ų99.845%0.45352%0.52SS..Hα-helixtrans-60.5-46.2178.3-68.20000112.1L62 C63 F68 V69 V70L62-C66 PolarHBondContact O-N 3.44Å; L62-C66 PolarHBondContact O-SG 3.12Å; C63-C66 PolarHBondContact O-N 2.9Å; C66-F68 VanDerWaalsContact C-N 3.33Å; C66-F68 PolarHBondContact O-N 2.93Å; C66-V69 PolarHBondContact O-N 2.78Å; C66-V70 VanDerWaalsContact O-CG2 3.27Å; C66-V70 WeakPolarHBondContact O-CG2 3.11Å; C66-V70 PolarHBondContact O-N 2.86Å
67V93.4Very high92.6Very high82 Ų82102.6 Ų102.650%0.49753%0.527SS..Hα-helixtrans-62.1-42.4178.6168.60000110.8C63 S64 V65 V69 V70 I71C63-V67 WeakPolarHBondContact O-CB 3.44Å; C63-V67 VanDerWaalsContact O-CG2 3.29Å; C63-V67 WeakPolarHBondContact O-CG2 3.31Å; C63-V67 PolarHBondContact O-N 2.86Å; S64-V67 PolarHBondContact O-N 3.13Å; V65-V67 PolarHBondContact O-N 2.88Å; V67-V69 PolarHBondContact O-N 3.41Å; V67-V70 PolarHBondContact O-N 3.4Å; V67-I71 HydrophobicContact CG1-CD1 3.63Å; V67-I71 HydrophobicContact CG1-CG1 4.3Å; V67-I71 WeakPolarHBondContact O-CB 3.48Å; V67-I71 VanDerWaalsContact O-CG1 3.27Å; V67-I71 WeakPolarHBondContact O-CG1 3.29Å; V67-I71 PolarHBondContact O-N 3.23Å
68F92.4Very high92.2Very high138 Ų138101.3 Ų101.361%0.60553%0.532SS*.Hα-helixtrans-58.9-48.2175.7177-98.2000112.1S64 V65 C66 V70 I71 W72S64-F68 WeakPolarHBondContact O-CB 3.28Å; S64-F68 PolarHBondContact O-N 3.46Å; V65-F68 PolarHBondContact O-N 3.3Å; C66-F68 VanDerWaalsContact C-N 3.33Å; C66-F68 PolarHBondContact O-N 2.93Å; F68-V70 VanDerWaalsContact C-N 3.34Å; F68-V70 PolarHBondContact O-N 2.91Å; F68-I71 PolarHBondContact O-N 3.3Å; F68-W72 WeakPolarHBondContact O-CB 3.49Å; F68-W72 PolarHBondContact O-N 3.21Å
69V94.7Very high91.6Very high82 Ų82102.5 Ų102.550%0.49753%0.534SS..Hα-helixtrans-62.5-41.8178.6173.10000111.5V65 C66 V67 W72 W73V65-V69 WeakPolarHBondContact O-CG2 3.11Å; V65-V69 PolarHBondContact O-N 3.46Å; C66-V69 PolarHBondContact O-N 2.78Å; V67-V69 PolarHBondContact O-N 3.41Å; V69-W72 WeakPolarHBondContact O-CB 3.34Å; V69-W72 PolarHBondContact O-N 3.45Å; V69-W73 WeakPolarHBondContact O-CB 3.4Å; V69-W73 PolarHBondContact O-N 3.25Å
70V92.6Very high90.9Very high76 Ų76100.2 Ų100.246%0.46152%0.523SS..Hα-helixtrans-62.4-50.4176.6170.50000110.5C66 V67 F68 W72 W73 Y74C66-V70 VanDerWaalsContact O-CG2 3.27Å; C66-V70 WeakPolarHBondContact O-CG2 3.11Å; C66-V70 PolarHBondContact O-N 2.86Å; V67-V70 PolarHBondContact O-N 3.4Å; F68-V70 VanDerWaalsContact C-N 3.34Å; F68-V70 PolarHBondContact O-N 2.91Å; V70-W72 VanDerWaalsContact C-N 3.27Å; V70-W72 PolarHBondContact O-N 2.62Å; V70-W73 PolarHBondContact O-N 3.25Å; V70-W73 VanDerWaalsContact O-N 3.17Å; V70-Y74 HydrophobicContact CG1-CD2 3.65Å; V70-Y74 HydrophobicContact CG1-CE2 3.67Å; V70-Y74 VanDerWaalsContact O-CD2 3.29Å; V70-Y74 WeakPolarHBondContact O-CD2 3.39Å; V70-Y74 PolarHBondContact O-N 3.43Å
71I90.5Very high90.4Very high57 Ų5795.4 Ų95.429%0.29251%0.506SS..Hα-helixtrans-57.5-43.5178.5-70.3168.5000110.9V67 F68 Y74 M75 L85V67-I71 HydrophobicContact CG1-CD1 3.63Å; V67-I71 HydrophobicContact CG1-CG1 4.3Å; V67-I71 WeakPolarHBondContact O-CB 3.48Å; V67-I71 VanDerWaalsContact O-CG1 3.27Å; V67-I71 WeakPolarHBondContact O-CG1 3.29Å; V67-I71 PolarHBondContact O-N 3.23Å; F68-I71 PolarHBondContact O-N 3.3Å; I71-Y74 PolarHBondContact O-N 3Å; I71-M75 HydrophobicContact CG2-CE 4.12Å; I71-M75 WeakPolarHBondContact O-CB 3.46Å; I71-M75 PolarHBondContact O-N 3.01Å; I71-M75 VanDerWaalsContact O-N 3.08Å; I71-L85 HydrophobicContact CD1-CD2 4.38Å; I71-L85 HydrophobicContact CG1-CD2 4.32Å; I71-L85 HydrophobicContact CG2-CD1 3.66Å; I71-L85 HydrophobicContact CG2-CD2 4.01Å
72W88.8Confident89.7Confident163 Ų16392.8 Ų92.862%0.61750%0.499SS*.Hα-helixtrans-57.8-52.3175.4177.7-80.4000111.6F68 V69 V70 Y74 M75 D76F68-W72 WeakPolarHBondContact O-CB 3.49Å; F68-W72 PolarHBondContact O-N 3.21Å; V69-W72 WeakPolarHBondContact O-CB 3.34Å; V69-W72 PolarHBondContact O-N 3.45Å; V70-W72 VanDerWaalsContact C-N 3.27Å; V70-W72 PolarHBondContact O-N 2.62Å; W72-Y74 VanDerWaalsContact C-N 3.33Å; W72-Y74 PolarHBondContact O-N 3.11Å; W72-M75 WeakPolarHBondContact O-CB 3.27Å; W72-M75 PolarHBondContact O-N 3.35Å; W72-D76 PolarHBondContact O-N 2.96Å
73W92.1Very high89.2Confident161 Ų16194.1 Ų94.161%0.6150%0.503SS*.Hα-helixtrans-55.8-48.4-179.8-173.4-65.8000111.7V69 V70 M75 D76 E77V69-W73 WeakPolarHBondContact O-CB 3.4Å; V69-W73 PolarHBondContact O-N 3.25Å; V70-W73 PolarHBondContact O-N 3.25Å; V70-W73 VanDerWaalsContact O-N 3.17Å; W73-M75 PolarHBondContact O-N 3.37Å; W73-D76 PolarHBondContact O-N 2.99Å; W73-E77 WeakPolarHBondContact O-CG 3.38Å; W73-E77 PolarHBondContact O-N 2.85Å; W73-E77 VanDerWaalsContact O-N 3.07Å
74Y88Confident88.8Confident115 Ų11599.1 Ų99.145%0.45151%0.512SS..Hα-helixtrans-65.7-26.7-180-87.7-87.1000113.4V70 I71 W72 L79 L80V70-Y74 HydrophobicContact CG1-CD2 3.65Å; V70-Y74 HydrophobicContact CG1-CE2 3.67Å; V70-Y74 VanDerWaalsContact O-CD2 3.29Å; V70-Y74 WeakPolarHBondContact O-CD2 3.39Å; V70-Y74 PolarHBondContact O-N 3.43Å; I71-Y74 PolarHBondContact O-N 3Å; W72-Y74 VanDerWaalsContact C-N 3.33Å; W72-Y74 PolarHBondContact O-N 3.11Å; Y74-L79 HydrophobicContact CD1-CB 4.31Å; Y74-L79 HydrophobicContact CD1-CD1 4.36Å; Y74-L79 PolarHBondContact O-N 2.83Å; Y74-L80 VanDerWaalsContact CB-CD1 3.41Å; Y74-L80 HydrophobicContact CD1-CD1 4.04Å; Y74-L80 HydrophobicContact CG-CD1 3.81Å; Y74-L80 PolarHBondContact O-N 3.5Å
75M88.1Confident88.4Confident79 Ų7998 Ų9839%0.38950%0.5SS..Hα-helixtrans-76.6-37.7174.7-162.5-178.9-4400111.5I71 W72 W73 G78 L85I71-M75 HydrophobicContact CG2-CE 4.12Å; I71-M75 WeakPolarHBondContact O-CB 3.46Å; I71-M75 PolarHBondContact O-N 3.01Å; I71-M75 VanDerWaalsContact O-N 3.08Å; W72-M75 WeakPolarHBondContact O-CB 3.27Å; W72-M75 PolarHBondContact O-N 3.35Å; W73-M75 PolarHBondContact O-N 3.37Å; M75-G78 PolarHBondContact O-N 2.79Å; M75-G78 VanDerWaalsContact O-N 3.08Å; M75-L85 HydrophobicContact CE-CD1 3.8Å
76D88.6Confident88Confident126 Ų12699.9 Ų99.967%0.67450%0.501SS*.Hα-helixtrans-63.8-42.2176.6-167.862.1000111.8W72 W73 G78W72-D76 PolarHBondContact O-N 2.96Å; W73-D76 PolarHBondContact O-N 2.99Å; D76-G78 PolarHBondContact O-N 2.74Å; D76-G78 VanDerWaalsContact O-N 3.15Å
77E89Confident87.6Confident111 Ų11198.5 Ų98.552%0.51950%0.498SS..THydrogen-bonded Turntrans-70.1-4173.3-66.3-74.6-178.500113.4W73 L79W73-E77 WeakPolarHBondContact O-CG 3.38Å; W73-E77 PolarHBondContact O-N 2.85Å; W73-E77 VanDerWaalsContact O-N 3.07Å; E77-L79 HydrophobicContact CB-CD1 4.18Å; E77-L79 HydrophobicContact CB-CG 4.13Å; E77-L79 PolarHBondContact O-N 3.33Å; E77-L79 VanDerWaalsContact O-N 3.16Å
78G84.1Confident87.4Confident63 Ų6398.7 Ų98.765%0.64950%0.499SS*.THydrogen-bonded Turntrans69.86.7179.900000115.2M75 D76M75-G78 PolarHBondContact O-N 2.79Å; M75-G78 VanDerWaalsContact O-N 3.08Å; D76-G78 PolarHBondContact O-N 2.74Å; D76-G78 VanDerWaalsContact O-N 3.15Å
79L79.1Confident87.3Confident132 Ų13293.4 Ų93.469%0.69148%0.484SS*.  trans-76.5-23.3-178.4-65.2175.1000112.8Y74 E77Y74-L79 HydrophobicContact CD1-CB 4.31Å; Y74-L79 HydrophobicContact CD1-CD1 4.36Å; Y74-L79 PolarHBondContact O-N 2.83Å; E77-L79 HydrophobicContact CB-CD1 4.18Å; E77-L79 HydrophobicContact CB-CG 4.13Å; E77-L79 PolarHBondContact O-N 3.33Å; E77-L79 VanDerWaalsContact O-N 3.16Å
80L79.9Confident87.1Confident51 Ų5195.1 Ų95.127%0.26749%0.49SS..SBendtrans-116.7104.7-178.5-105.6157.8000111Y74 W84 L85Y74-L80 VanDerWaalsContact CB-CD1 3.41Å; Y74-L80 HydrophobicContact CD1-CD1 4.04Å; Y74-L80 HydrophobicContact CG-CD1 3.81Å; Y74-L80 PolarHBondContact O-N 3.5Å; L80-W84 HydrophobicContact CD2-CB 4.25Å; L80-L85 HydrophobicContact CD2-CD2 4.29Å; L80-L85 HydrophobicContact CD2-CG 4.29Å
81A83.9Confident87.1Confident32 Ų3294 Ų9426%0.26449%0.488SS..  trans-71.1136.8171.400000110.2Q83 W84A81-Q83 HydrophobicContact CB-CG 3.9Å; A81-Q83 PolarHBondContact O-N 3.33Å; A81-W84 PolarHBondContact O-N 3.27Å
82P81.3Confident87.2Confident69 Ų6994.8 Ų94.845%0.44850%0.499SS..Hα-helixtrans-53.8-32.9-176.1-28.834.4000114.5W84 L85 F86P82-W84 VanDerWaalsContact C-N 3.27Å; P82-W84 PolarHBondContact O-N 3.46Å; P82-L85 WeakPolarHBondContact O-CB 3.34Å; P82-L85 PolarHBondContact O-N 2.96Å; P82-L85 VanDerWaalsContact O-N 3.14Å; P82-F86 WeakPolarHBondContact O-CD2 3.28Å; P82-F86 PolarHBondContact O-N 3.43Å
83Q85.3Confident87.2Confident143 Ų14390.9 Ų90.967%0.66850%0.497SS*.Hα-helixtrans-57.2-34.9176.260.7-167-34.300114A81 F86 G87A81-Q83 HydrophobicContact CB-CG 3.9Å; A81-Q83 PolarHBondContact O-N 3.33Å; Q83-F86 PolarHBondContact O-N 3.04Å; Q83-G87 PolarHBondContact O-N 2.86Å
84W85.8Confident87.2Confident175 Ų17588.9 Ų88.966%0.66350%0.497SS*.Hα-helixtrans-69.8-34.7178.2-71.6109.4000111.6L80 A81 P82 G87 T88L80-W84 HydrophobicContact CD2-CB 4.25Å; A81-W84 PolarHBondContact O-N 3.27Å; P82-W84 VanDerWaalsContact C-N 3.27Å; P82-W84 PolarHBondContact O-N 3.46Å; W84-G87 PolarHBondContact O-N 2.92Å; W84-T88 WeakPolarHBondContact O-CG2 3.37Å; W84-T88 PolarHBondContact O-N 2.91Å; W84-T88 PolarHBondContact O-OG1 3.42Å; W84-T88 VanDerWaalsContact O-OG1 3.11Å
85L86.4Confident87.5Confident45 Ų4588 Ų8824%0.23650%0.504CS..Hα-helixtrans-65.1-43.3174.7-67.2168.1000111.4I71 M75 L80 P82 G87 T88 G89I71-L85 HydrophobicContact CD1-CD2 4.38Å; I71-L85 HydrophobicContact CG1-CD2 4.32Å; I71-L85 HydrophobicContact CG2-CD1 3.66Å; I71-L85 HydrophobicContact CG2-CD2 4.01Å; M75-L85 HydrophobicContact CE-CD1 3.8Å; L80-L85 HydrophobicContact CD2-CD2 4.29Å; L80-L85 HydrophobicContact CD2-CG 4.29Å; P82-L85 WeakPolarHBondContact O-CB 3.34Å; P82-L85 PolarHBondContact O-N 2.96Å; P82-L85 VanDerWaalsContact O-N 3.14Å; L85-G87 VanDerWaalsContact C-N 3.35Å; L85-T88 PolarHBondContact O-OG1 2.82Å; L85-G89 PolarHBondContact O-N 3.45Å
86F87Confident87.7Confident131 Ų13186.1 Ų86.158%0.57551%0.505SS*.Hα-helixtrans-63.9-41.8174.1-70.6-69.7000111.6P82 Q83 G89 L90P82-F86 WeakPolarHBondContact O-CD2 3.28Å; P82-F86 PolarHBondContact O-N 3.43Å; Q83-F86 PolarHBondContact O-N 3.04Å; F86-G89 PolarHBondContact O-N 3.18Å; F86-L90 WeakPolarHBondContact O-CB 3.22Å; F86-L90 VanDerWaalsContact O-CG 3.27Å; F86-L90 WeakPolarHBondContact O-CG 3.31Å; F86-L90 PolarHBondContact O-N 3.43Å
87G89.5Confident87.7Confident37 Ų3784.2 Ų84.238%0.38149%0.489SS..Hα-helixtrans-60.7-49.2177.400000112.9Q83 W84 L85 L90 A91Q83-G87 PolarHBondContact O-N 2.86Å; W84-G87 PolarHBondContact O-N 2.92Å; L85-G87 VanDerWaalsContact C-N 3.35Å; G87-L90 PolarHBondContact O-N 3.3Å; G87-A91 VanDerWaalsContact O-CB 3.28Å; G87-A91 WeakPolarHBondContact O-CB 3.34Å; G87-A91 PolarHBondContact O-N 2.88Å
88T88.9Confident87.8Confident86 Ų8682.7 Ų82.753%0.52849%0.487SS..Hα-helixtrans-68.7-35.917858.10000112.3W84 L85 A91 S92W84-T88 WeakPolarHBondContact O-CG2 3.37Å; W84-T88 PolarHBondContact O-N 2.91Å; W84-T88 PolarHBondContact O-OG1 3.42Å; W84-T88 VanDerWaalsContact O-OG1 3.11Å; L85-T88 PolarHBondContact O-OG1 2.82Å; T88-A91 PolarHBondContact O-N 3.38Å; T88-S92 VanDerWaalsContact O-CB 3.31Å; T88-S92 WeakPolarHBondContact O-CB 3.48Å; T88-S92 PolarHBondContact O-N 2.93Å; T88-S92 PolarHBondContact O-OG 2.89Å
89G89.7Confident88.2Confident28 Ų2884.5 Ų84.529%0.28948%0.481SS..Hα-helixtrans-62.8-45.3173.500000113L85 F86 S92 S93L85-G89 PolarHBondContact O-N 3.45Å; F86-G89 PolarHBondContact O-N 3.18Å; G89-S92 WeakPolarHBondContact CA-OG 3.5Å; G89-S92 PolarHBondContact O-OG 3.47Å; G89-S93 WeakPolarHBondContact O-CB 3.43Å; G89-S93 PolarHBondContact O-N 2.84Å; G89-S93 PolarHBondContact O-OG 3.26Å
90L89.9Confident88.6Confident118 Ų11884.4 Ų84.462%0.61848%0.475SS*.Hα-helixtrans-66-44.6174.9-71.9173.8000111.6F86 G87 S93 L94F86-L90 WeakPolarHBondContact O-CB 3.22Å; F86-L90 VanDerWaalsContact O-CG 3.27Å; F86-L90 WeakPolarHBondContact O-CG 3.31Å; F86-L90 PolarHBondContact O-N 3.43Å; G87-L90 PolarHBondContact O-N 3.3Å; L90-S93 PolarHBondContact O-N 3.3Å; L90-L94 WeakPolarHBondContact O-CG 3.35Å; L90-L94 PolarHBondContact O-N 3.05Å
91A93.5Very high88.9Confident51 Ų5183.6 Ų83.642%0.42147%0.471SS..Hα-helixtrans-60.8-48.1178.100000111.9G87 T88 S93 L94 V95G87-A91 VanDerWaalsContact O-CB 3.28Å; G87-A91 WeakPolarHBondContact O-CB 3.34Å; G87-A91 PolarHBondContact O-N 2.88Å; T88-A91 PolarHBondContact O-N 3.38Å; A91-S93 VanDerWaalsContact C-N 3.33Å; A91-S93 PolarHBondContact O-N 3.11Å; A91-L94 PolarHBondContact O-N 3.09Å; A91-V95 VanDerWaalsContact O-CG2 3.29Å; A91-V95 WeakPolarHBondContact O-CG2 3.38Å; A91-V95 PolarHBondContact O-N 3.18Å
92S92.1Very high89.1Confident75 Ų7588.1 Ų88.152%0.52449%0.49SS..Hα-helixtrans-61.6-39.6177.159.30000112.5T88 G89 V95 G96T88-S92 VanDerWaalsContact O-CB 3.31Å; T88-S92 WeakPolarHBondContact O-CB 3.48Å; T88-S92 PolarHBondContact O-N 2.93Å; T88-S92 PolarHBondContact O-OG 2.89Å; G89-S92 WeakPolarHBondContact CA-OG 3.5Å; G89-S92 PolarHBondContact O-OG 3.47Å; S92-V95 PolarHBondContact O-N 2.91Å; S92-G96 PolarHBondContact O-N 3.44Å
93S89.8Confident89.5Confident81 Ų8191.3 Ų91.357%0.56650%0.502SS*.Hα-helixtrans-63.8-42.4175.7-60.10000112.1G89 L90 A91 G96 Y97G89-S93 WeakPolarHBondContact O-CB 3.43Å; G89-S93 PolarHBondContact O-N 2.84Å; G89-S93 PolarHBondContact O-OG 3.26Å; L90-S93 PolarHBondContact O-N 3.3Å; A91-S93 VanDerWaalsContact C-N 3.33Å; A91-S93 PolarHBondContact O-N 3.11Å; S93-G96 PolarHBondContact O-N 3.45Å; S93-Y97 PolarHBondContact O-N 3.25Å
94L91.7Very high89.5Confident118 Ų11887.2 Ų87.262%0.61848%0.484SS*.Hα-helixtrans-64.8-45175.7-72.8171000111.8L90 A91 G96 Y97 V98L90-L94 WeakPolarHBondContact O-CG 3.35Å; L90-L94 PolarHBondContact O-N 3.05Å; A91-L94 PolarHBondContact O-N 3.09Å; L94-G96 VanDerWaalsContact C-N 3.32Å; L94-G96 PolarHBondContact O-N 3.11Å; L94-Y97 PolarHBondContact O-N 3.25Å; L94-V98 WeakPolarHBondContact O-CG2 3.29Å; L94-V98 PolarHBondContact O-N 3.27Å
95V94.8Very high89.2Confident98 Ų9881.7 Ų81.759%0.59448%0.482SS*.Hα-helixtrans-59.7-45.1176170.80000110.4A91 S92 Y97 V98 L99A91-V95 VanDerWaalsContact O-CG2 3.29Å; A91-V95 WeakPolarHBondContact O-CG2 3.38Å; A91-V95 PolarHBondContact O-N 3.18Å; S92-V95 PolarHBondContact O-N 2.91Å; V95-Y97 PolarHBondContact O-N 3.33Å; V95-V98 PolarHBondContact O-N 2.85Å; V95-L99 WeakPolarHBondContact O-CB 3.38Å; V95-L99 PolarHBondContact O-N 3.48Å
96G91.4Very high88.4Confident39 Ų3980.1 Ų80.140%0.40248%0.477SS..Hα-helixtrans-59.3-43.6176.200000112.7S92 S93 L94 L99 F100S92-G96 PolarHBondContact O-N 3.44Å; S93-G96 PolarHBondContact O-N 3.45Å; L94-G96 VanDerWaalsContact C-N 3.32Å; L94-G96 PolarHBondContact O-N 3.11Å; G96-L99 PolarHBondContact O-N 2.95Å; G96-F100 WeakPolarHBondContact O-CB 3.37Å; G96-F100 PolarHBondContact O-N 3.01Å
97Y88.7Confident87.9Confident86 Ų8677.5 Ų77.534%0.33747%0.469SS..Hα-helixtrans-63.4-43.9176.4-176.9-99.2000112.4S93 L94 V95 F100 D101 D119S93-Y97 PolarHBondContact O-N 3.25Å; L94-Y97 PolarHBondContact O-N 3.25Å; V95-Y97 PolarHBondContact O-N 3.33Å; Y97-F100 PolarHBondContact O-N 2.92Å; Y97-D101 WeakPolarHBondContact O-CB 3.42Å; Y97-D101 PolarHBondContact O-N 3.47Å; Y97-D119 PolarHBondContact OH-OD2 3.41Å
98V90.4Very high87.1Confident79 Ų7977 Ų7748%0.47946%0.464SS..Hα-helixtrans-64.7-45177.2172.40000110.8L94 V95 F100 D101 L102L94-V98 WeakPolarHBondContact O-CG2 3.29Å; L94-V98 PolarHBondContact O-N 3.27Å; V95-V98 PolarHBondContact O-N 2.85Å; V98-F100 VanDerWaalsContact C-N 3.29Å; V98-F100 PolarHBondContact O-N 3.43Å; V98-D101 PolarHBondContact O-N 2.88Å; V98-L102 HydrophobicContact CG1-CD1 3.98Å; V98-L102 HydrophobicContact CG1-CG 4.3Å; V98-L102 WeakPolarHBondContact O-CB 3.27Å; V98-L102 VanDerWaalsContact O-CG 3.27Å; V98-L102 WeakPolarHBondContact O-CG 3.4Å; V98-L102 PolarHBondContact O-N 2.78Å
99L92.3Very high86.3Confident100 Ų10077.7 Ų77.752%0.52446%0.456SS..Hα-helixtrans-61.9-40.4179-162.972.5000111.1V95 G96 L102 I103V95-L99 WeakPolarHBondContact O-CB 3.38Å; V95-L99 PolarHBondContact O-N 3.48Å; G96-L99 PolarHBondContact O-N 2.95Å; L99-L102 PolarHBondContact O-N 3.42Å; L99-I103 HydrophobicContact CD2-CD1 4.45Å; L99-I103 HydrophobicContact CG-CD1 4.02Å; L99-I103 WeakPolarHBondContact O-CB 3.47Å; L99-I103 VanDerWaalsContact O-CG1 3.23Å; L99-I103 WeakPolarHBondContact O-CG1 3.47Å; L99-I103 PolarHBondContact O-N 2.86Å
100F88.4Confident85.5Confident131 Ų13184.3 Ų84.358%0.57548%0.477SS*.Hα-helixtrans-61.6-48.4173.4178-98000112.2G96 Y97 V98 L102 I103 D104G96-F100 WeakPolarHBondContact O-CB 3.37Å; G96-F100 PolarHBondContact O-N 3.01Å; Y97-F100 PolarHBondContact O-N 2.92Å; V98-F100 VanDerWaalsContact C-N 3.29Å; V98-F100 PolarHBondContact O-N 3.43Å; F100-L102 VanDerWaalsContact C-N 3.25Å; F100-L102 PolarHBondContact O-N 2.91Å; F100-I103 PolarHBondContact O-N 3.46Å; F100-D104 VanDerWaalsContact O-CB 3.28Å; F100-D104 WeakPolarHBondContact O-CB 3.43Å; F100-D104 PolarHBondContact O-N 3.29Å
101D86.7Confident84.9Confident34 Ų3486.6 Ų86.618%0.18248%0.482CS..Hα-helixtrans-61.8-34.5178.5-161.135000111.4Y97 V98 G105 G106 R116Y97-D101 WeakPolarHBondContact O-CB 3.42Å; Y97-D101 PolarHBondContact O-N 3.47Å; V98-D101 PolarHBondContact O-N 2.88Å; D101-G105 PolarHBondContact O-N 3.36Å; D101-G105 VanDerWaalsContact O-N 3.15Å; D101-G106 PolarHBondContact O-N 2.91Å; D101-R116 IonicContact OD2-CZ 2.79Å; D101-R116 IonicContact OD2-NH2 3.08Å; D101-R116 PolarHBondContact OD2-NH2 3.5Å
102L87.9Confident83.9Confident127 Ų12788 Ų8867%0.66549%0.489SS*.Hα-helixtrans-70.9-44.9174.8-70.8174.7000112.8V98 L99 F100 G105V98-L102 HydrophobicContact CG1-CD1 3.98Å; V98-L102 HydrophobicContact CG1-CG 4.3Å; V98-L102 WeakPolarHBondContact O-CB 3.27Å; V98-L102 VanDerWaalsContact O-CG 3.27Å; V98-L102 WeakPolarHBondContact O-CG 3.4Å; V98-L102 PolarHBondContact O-N 2.78Å; L99-L102 PolarHBondContact O-N 3.42Å; F100-L102 VanDerWaalsContact C-N 3.25Å; F100-L102 PolarHBondContact O-N 2.91Å; L102-G105 PolarHBondContact O-N 3.41Å
103I89.6Confident83.2Confident135 Ų13587.5 Ų87.569%0.69250%0.496SS*.Hα-helixtrans-66.4-42.5179.1-70.6165.9000110.8L99 F100 G105L99-I103 HydrophobicContact CD2-CD1 4.45Å; L99-I103 HydrophobicContact CG-CD1 4.02Å; L99-I103 WeakPolarHBondContact O-CB 3.47Å; L99-I103 VanDerWaalsContact O-CG1 3.23Å; L99-I103 WeakPolarHBondContact O-CG1 3.47Å; L99-I103 PolarHBondContact O-N 2.86Å; F100-I103 PolarHBondContact O-N 3.46Å; I103-G105 PolarHBondContact O-N 2.99Å
104D85.2Confident82.5Confident57 Ų5788.8 Ų88.831%0.30549%0.488SS..THydrogen-bonded Turntrans-76.8-10.4-179.6-164.936.6000112.1F100 G106 D107 G108F100-D104 VanDerWaalsContact O-CB 3.28Å; F100-D104 WeakPolarHBondContact O-CB 3.43Å; F100-D104 PolarHBondContact O-N 3.29Å; D104-G106 PolarHBondContact O-N 3.35Å; D104-D107 WeakPolarHBondContact O-CB 3.29Å; D104-D107 PolarHBondContact O-N 3.28Å; D104-G108 PolarHBondContact OD1-N 2.97Å; D104-G108 WeakPolarHBondContact OD2-CA 3.27Å; D104-G108 PolarHBondContact OD2-N 2.99Å
105G79Confident82Confident59 Ų5987 Ų8761%0.60848%0.483SS*.THydrogen-bonded Turntrans58.818.7176.700000114D101 L102 I103 D107D101-G105 PolarHBondContact O-N 3.36Å; D101-G105 VanDerWaalsContact O-N 3.15Å; L102-G105 PolarHBondContact O-N 3.41Å; I103-G105 PolarHBondContact O-N 2.99Å; G105-D107 PolarHBondContact O-N 3.3Å
106G70.7Confident81.4Confident13 Ų1388.8 Ų88.813%0.13448%0.478CS..THydrogen-bonded Turntrans67.89.5-170.200000115.2D101 D104 R109 K110D101-G106 PolarHBondContact O-N 2.91Å; D104-G106 PolarHBondContact O-N 3.35Å; G106-R109 PolarHBondContact O-N 2.93Å; G106-K110 WeakPolarHBondContact O-CG 3.27Å; G106-K110 PolarHBondContact O-N 3.3Å; G106-K110 VanDerWaalsContact O-N 3.11Å
107D75Confident80.9Confident76 Ų7696.4 Ų96.441%0.40650%0.495SS..Hα-helixtrans-75.5-40.5-178-156.144.5000111.7D104 G105 R109 K110 K111D104-D107 WeakPolarHBondContact O-CB 3.29Å; D104-D107 PolarHBondContact O-N 3.28Å; G105-D107 PolarHBondContact O-N 3.3Å; D107-R109 VanDerWaalsContact C-N 3.26Å; D107-R109 PolarHBondContact O-N 3.46Å; D107-K110 PolarHBondContact O-N 3.46Å; D107-K111 WeakPolarHBondContact O-CG 3.35Å; D107-K111 PolarHBondContact O-N 2.89Å; D107-K111 WeakPolarHBondContact OD2-CE 3.29Å; D107-K111 IonicContact OD2-NZ 3.48Å; D107-K111 PolarHBondContact OD2-NZ 3.42Å; D107-K111 VanDerWaalsContact OD2-NZ 3.08Å
108G72.8Confident80.8Confident26 Ų2694 Ų9427%0.26849%0.493SS..Hα-helixtrans-62.5-33.7170.900000112.5D104 K111 S112D104-G108 PolarHBondContact OD1-N 2.97Å; D104-G108 WeakPolarHBondContact OD2-CA 3.27Å; D104-G108 PolarHBondContact OD2-N 2.99Å; G108-K111 PolarHBondContact O-N 3.17Å; G108-S112 VanDerWaalsContact O-CB 3.23Å; G108-S112 WeakPolarHBondContact O-CB 3.43Å; G108-S112 PolarHBondContact O-N 3.33Å
109R72.5Confident80.6Confident100 Ų10092 Ų9238%0.37748%0.48SS..Hα-helixtrans-69.8-37.8175.5-160.6161.767.687.6-2.4113G106 D107 G113 R114G106-R109 PolarHBondContact O-N 2.93Å; D107-R109 VanDerWaalsContact C-N 3.26Å; D107-R109 PolarHBondContact O-N 3.46Å; R109-G113 PolarHBondContact O-N 3.35Å; R109-R114 WeakPolarHBondContact CG-O 3.16Å
110K72.4Confident80.4Confident167 Ų16792.1 Ų92.173%0.72648%0.48SS*.Hα-helixtrans-65.8-40.6174-73173-173.4174.70112G106 D107G106-K110 WeakPolarHBondContact O-CG 3.27Å; G106-K110 PolarHBondContact O-N 3.3Å; G106-K110 VanDerWaalsContact O-N 3.11Å; D107-K110 PolarHBondContact O-N 3.46Å
111K77.3Confident80.5Confident166 Ų16693.2 Ų93.272%0.72249%0.485SS*.Hα-helixtrans-69.2-37.3176.4-70.4175.2-172.5163.10112.8D107 G108D107-K111 WeakPolarHBondContact O-CG 3.35Å; D107-K111 PolarHBondContact O-N 2.89Å; D107-K111 WeakPolarHBondContact OD2-CE 3.29Å; D107-K111 IonicContact OD2-NZ 3.48Å; D107-K111 PolarHBondContact OD2-NZ 3.42Å; D107-K111 VanDerWaalsContact OD2-NZ 3.08Å; G108-K111 PolarHBondContact O-N 3.17Å
112S73.6Confident80.5Confident80 Ų8093.6 Ų93.656%0.55949%0.49SS*.Hα-helixtrans-80-19.2-179.8-174.70000113.5G108 R114G108-S112 VanDerWaalsContact O-CB 3.23Å; G108-S112 WeakPolarHBondContact O-CB 3.43Å; G108-S112 PolarHBondContact O-N 3.33Å; S112-R114 PolarHBondContact O-N 2.94Å; S112-R114 VanDerWaalsContact O-N 3.12Å
113G77Confident80.6Confident65 Ų6591.1 Ų91.167%0.6748%0.48SS*.THydrogen-bonded Turntrans65.310-176.300000113.9R109R109-G113 PolarHBondContact O-N 3.35Å
114R75.1Confident80.6Confident108 Ų10889.9 Ų89.941%0.40848%0.475SS..  trans-88.2130.2-169.7-164.2168.4149.5126.6-1.9110.6R109 S112 A118 D119R109-R114 WeakPolarHBondContact CG-O 3.16Å; S112-R114 PolarHBondContact O-N 2.94Å; S112-R114 VanDerWaalsContact O-N 3.12Å; R114-A118 HydrophobicContact CG-CB 3.92Å; R114-D119 IonicContact CZ-OD1 3.21Å; R114-D119 IonicContact NE-OD1 2.74Å; R114-D119 PolarHBondContact NE-OD1 2.99Å; R114-D119 IonicContact NH2-OD1 2.79Å; R114-D119 PolarHBondContact NH2-OD1 3.08Å
115T82.2Confident81Confident82 Ų8291.4 Ų91.450%0.50349%0.486SS..  trans-91153.1-179.934.70000111.3W117 A118 D119T115-W117 PolarHBondContact O-N 3.03Å; T115-W117 VanDerWaalsContact O-N 3.11Å; T115-A118 WeakPolarHBondContact O-CA 3.47Å; T115-A118 VanDerWaalsContact O-CB 3.27Å; T115-A118 WeakPolarHBondContact O-CB 3.45Å; T115-A118 PolarHBondContact O-N 3.14Å; T115-D119 PolarHBondContact O-N 3.3Å
116R81.8Confident81.4Confident134 Ų13495 Ų9551%0.50649%0.485SS..Hα-helixtrans-55.7-29.4176.1-73.8-177156.2-179.5-4.8113.2D101 A118 D119 L120D101-R116 IonicContact OD2-CZ 2.79Å; D101-R116 IonicContact OD2-NH2 3.08Å; D101-R116 PolarHBondContact OD2-NH2 3.5Å; R116-A118 VanDerWaalsContact C-N 3.34Å; R116-D119 PolarHBondContact O-N 2.95Å; R116-L120 PolarHBondContact O-N 3.25Å
117W81.3Confident82.3Confident200 Ų20098.8 Ų98.876%0.75850%0.501SS*.Hα-helixtrans-66.1-33.2173-77.8104.6000113.4T115 L120 K121T115-W117 PolarHBondContact O-N 3.03Å; T115-W117 VanDerWaalsContact O-N 3.11Å; W117-L120 HydrophobicContact CE3-CD2 4.2Å; W117-L120 HydrophobicContact CZ3-CD2 4.09Å; W117-K121 VanDerWaalsContact O-CB 3.22Å; W117-K121 WeakPolarHBondContact O-CB 3.46Å; W117-K121 PolarHBondContact O-N 3.4Å
118A85.6Confident83.1Confident35 Ų3599.3 Ų99.329%0.28951%0.507SS..Hα-helixtrans-69.2-37.8175.100000111.1R114 T115 R116 S122R114-A118 HydrophobicContact CG-CB 3.92Å; T115-A118 WeakPolarHBondContact O-CA 3.47Å; T115-A118 VanDerWaalsContact O-CB 3.27Å; T115-A118 WeakPolarHBondContact O-CB 3.45Å; T115-A118 PolarHBondContact O-N 3.14Å; R116-A118 VanDerWaalsContact C-N 3.34Å; A118-S122 WeakPolarHBondContact O-CB 3.39Å; A118-S122 PolarHBondContact O-N 3.46Å
119D86.3Confident84Confident37 Ų37105.1 Ų105.120%0.19853%0.526CS..Hα-helixtrans-63.6-49.8173.1-66.1-23.6000110.9Y97 R114 T115 R116 K121 S122 T123Y97-D119 PolarHBondContact OH-OD2 3.41Å; R114-D119 IonicContact CZ-OD1 3.21Å; R114-D119 IonicContact NE-OD1 2.74Å; R114-D119 PolarHBondContact NE-OD1 2.99Å; R114-D119 IonicContact NH2-OD1 2.79Å; R114-D119 PolarHBondContact NH2-OD1 3.08Å; T115-D119 PolarHBondContact O-N 3.3Å; R116-D119 PolarHBondContact O-N 2.95Å; D119-K121 VanDerWaalsContact C-N 3.34Å; D119-K121 PolarHBondContact O-N 3.22Å; D119-S122 WeakPolarHBondContact O-CA 3.34Å; D119-S122 WeakPolarHBondContact O-CB 3.44Å; D119-S122 PolarHBondContact O-N 2.87Å; D119-S122 VanDerWaalsContact O-N 3.09Å; D119-T123 PolarHBondContact O-N 3.33Å; D119-T123 PolarHBondContact O-OG1 2.86Å; D119-T123 VanDerWaalsContact O-OG1 3.05Å
120L87.6Confident84.8Confident103 Ų103104.5 Ų104.554%0.53953%0.533SS..Hα-helixtrans-60.6-42.6178.2-174.665.5000112.2R116 W117 S122 T123 L124R116-L120 PolarHBondContact O-N 3.25Å; W117-L120 HydrophobicContact CE3-CD2 4.2Å; W117-L120 HydrophobicContact CZ3-CD2 4.09Å; L120-S122 VanDerWaalsContact C-N 3.31Å; L120-S122 PolarHBondContact O-N 3.31Å; L120-T123 PolarHBondContact O-N 2.96Å; L120-L124 WeakPolarHBondContact O-CB 3.48Å; L120-L124 PolarHBondContact O-N 3.16Å
121K90.3Very high85.3Confident153 Ų153104.5 Ų104.567%0.66553%0.529SS*.Hα-helixtrans-61.1-42.4175-176.8178.9178.2179.40111.1W117 D119 L124 V125W117-K121 VanDerWaalsContact O-CB 3.22Å; W117-K121 WeakPolarHBondContact O-CB 3.46Å; W117-K121 PolarHBondContact O-N 3.4Å; D119-K121 VanDerWaalsContact C-N 3.34Å; D119-K121 PolarHBondContact O-N 3.22Å; K121-L124 PolarHBondContact O-N 3.2Å; K121-V125 VanDerWaalsContact O-CG2 3.29Å; K121-V125 WeakPolarHBondContact O-CG2 3.37Å; K121-V125 PolarHBondContact O-N 2.9Å
122S88.3Confident85.4Confident42 Ų4299.3 Ų99.329%0.29452%0.523SS..Hα-helixtrans-62.8-46.2176.2-162.90000110.9A118 D119 L120 L124 V125 F126A118-S122 WeakPolarHBondContact O-CB 3.39Å; A118-S122 PolarHBondContact O-N 3.46Å; D119-S122 WeakPolarHBondContact O-CA 3.34Å; D119-S122 WeakPolarHBondContact O-CB 3.44Å; D119-S122 PolarHBondContact O-N 2.87Å; D119-S122 VanDerWaalsContact O-N 3.09Å; L120-S122 VanDerWaalsContact C-N 3.31Å; L120-S122 PolarHBondContact O-N 3.31Å; S122-L124 VanDerWaalsContact C-N 3.34Å; S122-L124 PolarHBondContact O-N 3.2Å; S122-V125 PolarHBondContact O-N 3.3Å; S122-F126 WeakPolarHBondContact O-CD2 3.3Å; S122-F126 PolarHBondContact O-N 3.07Å
123T88.9Confident84.5Confident75 Ų75107 Ų10746%0.4655%0.547SS..Hα-helixtrans-60.3-43.5176.8-55.20000111.5D119 L120 F126 I127D119-T123 PolarHBondContact O-N 3.33Å; D119-T123 PolarHBondContact O-OG1 2.86Å; D119-T123 VanDerWaalsContact O-OG1 3.05Å; L120-T123 PolarHBondContact O-N 2.96Å; T123-F126 PolarHBondContact O-N 3.08Å; T123-I127 HydrophobicContact CG2-CD1 3.9Å; T123-I127 HydrophobicContact CG2-CG1 4.45Å; T123-I127 WeakPolarHBondContact O-CG1 3.43Å; T123-I127 PolarHBondContact O-N 3.24Å
124L90.1Very high84.9Confident109 Ų109109.1 Ų109.157%0.57154%0.541SS*.Hα-helixtrans-59.9-49176.5-171.482.9000111.1L120 K121 S122 F126 I127 T128L120-L124 WeakPolarHBondContact O-CB 3.48Å; L120-L124 PolarHBondContact O-N 3.16Å; K121-L124 PolarHBondContact O-N 3.2Å; S122-L124 VanDerWaalsContact C-N 3.34Å; S122-L124 PolarHBondContact O-N 3.2Å; L124-F126 VanDerWaalsContact C-N 3.28Å; L124-F126 PolarHBondContact O-N 3.37Å; L124-I127 PolarHBondContact O-N 3.2Å; L124-T128 WeakPolarHBondContact O-CB 3.49Å; L124-T128 PolarHBondContact O-N 2.93Å; L124-T128 PolarHBondContact O-OG1 3.4Å
125V92.4Very high85.4Confident90 Ų90109.2 Ų109.255%0.54555%0.548SS..Hα-helixtrans-58.6-42.2177.8170.10000111.1K121 S122 F129K121-V125 VanDerWaalsContact O-CG2 3.29Å; K121-V125 WeakPolarHBondContact O-CG2 3.37Å; K121-V125 PolarHBondContact O-N 2.9Å; S122-V125 PolarHBondContact O-N 3.3Å; V125-F129 VanDerWaalsContact O-CB 3.3Å; V125-F129 WeakPolarHBondContact O-CB 3.42Å; V125-F129 PolarHBondContact O-N 3.04Å
126F89.1Confident85.5Confident135 Ų135110.7 Ų110.759%0.59255%0.55SS**Hα-helixtrans-63.2-47.8176-95-79.3000112.4S122 T123 L124 T128 F129 T130S122-F126 WeakPolarHBondContact O-CD2 3.3Å; S122-F126 PolarHBondContact O-N 3.07Å; T123-F126 PolarHBondContact O-N 3.08Å; L124-F126 VanDerWaalsContact C-N 3.28Å; L124-F126 PolarHBondContact O-N 3.37Å; F126-T128 VanDerWaalsContact C-N 3.35Å; F126-T128 PolarHBondContact O-N 2.93Å; F126-F129 PolarHBondContact O-N 2.95Å; F126-T130 WeakPolarHBondContact O-CB 3.5Å; F126-T130 PolarHBondContact O-N 3.47Å; F126-T130 PolarHBondContact O-OG1 3.15Å; F126-T130 VanDerWaalsContact O-OG1 3.08Å
127I89.7Confident85.8Confident91 Ų91109.3 Ų109.347%0.46755%0.553SS.*Hα-helixtrans-61-46.5178.2-68.6168.8000110.3T123 L124 F129 T130 Y131T123-I127 HydrophobicContact CG2-CD1 3.9Å; T123-I127 HydrophobicContact CG2-CG1 4.45Å; T123-I127 WeakPolarHBondContact O-CG1 3.43Å; T123-I127 PolarHBondContact O-N 3.24Å; L124-I127 PolarHBondContact O-N 3.2Å; I127-F129 VanDerWaalsContact C-N 3.29Å; I127-F129 PolarHBondContact O-N 2.87Å; I127-T130 PolarHBondContact O-N 2.94Å; I127-Y131 HydrophobicContact CG2-CD2 4.02Å; I127-Y131 WeakPolarHBondContact O-CD2 3.45Å; I127-Y131 PolarHBondContact O-N 3.08Å
128T90.3Very high86Confident87 Ų87103.6 Ų103.653%0.53454%0.54SS..Hα-helixtrans-62.1-37.8177.8-55.40000111.7L124 F126 G132L124-T128 WeakPolarHBondContact O-CB 3.49Å; L124-T128 PolarHBondContact O-N 2.93Å; L124-T128 PolarHBondContact O-OG1 3.4Å; F126-T128 VanDerWaalsContact C-N 3.35Å; F126-T128 PolarHBondContact O-N 2.93Å; T128-G132 WeakPolarHBondContact O-CA 3.11Å; T128-G132 PolarHBondContact O-N 3.07Å
129F92.2Very high86.1Confident149 Ų149108.2 Ų108.265%0.65456%0.557SS**Hα-helixtrans-71.3-40176.7-177.1-102000112.7V125 F126 I127V125-F129 VanDerWaalsContact O-CB 3.3Å; V125-F129 WeakPolarHBondContact O-CB 3.42Å; V125-F129 PolarHBondContact O-N 3.04Å; F126-F129 PolarHBondContact O-N 2.95Å; I127-F129 VanDerWaalsContact C-N 3.29Å; I127-F129 PolarHBondContact O-N 2.87Å
130T88.6Confident86.1Confident86 Ų86113.3 Ų113.353%0.52858%0.583SS.*Hα-helixtrans-75-31.8-177.5-62.80000113.3F126 I127F126-T130 WeakPolarHBondContact O-CB 3.5Å; F126-T130 PolarHBondContact O-N 3.47Å; F126-T130 PolarHBondContact O-OG1 3.15Å; F126-T130 VanDerWaalsContact O-OG1 3.08Å; I127-T130 PolarHBondContact O-N 2.94Å
131Y83.6Confident86Confident167 Ų167114.1 Ų114.166%0.65559%0.586SS**Hα-helixtrans-115.5-5.2-176.1-65.5-78.9000114.3I127I127-Y131 HydrophobicContact CG2-CD2 4.02Å; I127-Y131 WeakPolarHBondContact O-CD2 3.45Å; I127-Y131 PolarHBondContact O-N 3.08Å
132G78.8Confident85.6Confident58 Ų58110.8 Ų110.860%0.59858%0.579SS**  trans-98.35.2-177.800000115T128T128-G132 WeakPolarHBondContact O-CA 3.11Å; T128-G132 PolarHBondContact O-N 3.07Å
133F55.1Low85.3Confident241 Ų241117.1 Ų117.1100%1.05761%0.605SS**  trans-118.10168.6-110.5-80.7000109.2

Retrieved 133 of 133 residues in 24.5 ms (Link to these results)