A0A096NDG7_PAPAN Loading...

BARX homeobox 2

AlphaFold DB (A0A2K6AR14), UniProt , Accession A0A096NDG7, Species PAPAN (Papio anubis, Olive baboon), Gene BARX2, Length 279 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
1M38.4Very low40.2Very low227 Ų227155 Ų155100%1.11882%0.821SS**  0122.90-77.7-65.9177.800108.4
2H38.4Very low40.4Very low178 Ų178153.6 Ų153.682%0.82483%0.828SS**  trans65.3111.8159.3-80.277.7000121.1
3C37.6Very low41Very low117 Ų117145.8 Ų145.879%0.79181%0.806SS**  trans-60.5147.1152.2-55.20000110.8
4H35Very low41.7Very low161 Ų161148.4 Ų148.475%0.74581%0.809SS**  trans-133103.8151-121-96.9000108.4E6H4-E6 IonicContact ND1-OE1 3.64Å
5A40.7Very low42.5Very low92 Ų92149.2 Ų149.276%0.7681%0.811SS**  trans-90.4107164.900000107L7A5-L7 PolarHBondContact O-N 3.39Å
6E41.2Very low42.6Very low158 Ų158152.9 Ų152.974%0.73882%0.817SS**  trans-80.1104.9171.9-81.8-76.7127.200109.2H4 R8H4-E6 IonicContact ND1-OE1 3.64Å; E6-R8 PolarHBondContact O-N 3.37Å
7L40.3Very low42.5Very low154 Ų154148.9 Ų148.981%0.80681%0.81SS**  trans-66.394.5167.7-85.4157.4000109.6A5 L9A5-L7 PolarHBondContact O-N 3.39Å; L7-L9 PolarHBondContact O-N 3.31Å
8R44.9Very low42.9Very low242 Ų242146.6 Ų146.691%0.91382%0.815SS**  trans-69.298.5160.3-86.5-161.8169.5108.9-0.2109.2E6 S10E6-R8 PolarHBondContact O-N 3.37Å; R8-S10 PolarHBondContact O-N 3.04Å
9L40.6Very low43.1Very low165 Ų165151.5 Ų151.586%0.86482%0.82SS**  trans-62.197.4165.6-70.5164.7000108.7L7L7-L9 PolarHBondContact O-N 3.31Å
10S43.2Very low43.7Very low112 Ų112156.2 Ų156.278%0.78383%0.825SS**  trans-70.4133.6166.2-165.60000109.2R8R8-S10 PolarHBondContact O-N 3.04Å
11S42.5Very low44.4Very low99 Ų99159 Ų15969%0.69282%0.824SS**  trans-34.7126.2178.8-1750000114.2G13S11-G13 PolarHBondContact O-N 3.44Å
12P42.6Very low45.2Very low138 Ų138159 Ų15990%0.89681%0.813SS**  trans-81.468172.233.5-31.2000109.8
13G47.8Very low45.8Very low53 Ų53159.7 Ų159.755%0.54681%0.814SS.*  trans-95.1116.8156.700000108.4S11S11-G13 PolarHBondContact O-N 3.44Å
14Q51.4Low46.5Very low182 Ų182159.7 Ų159.785%0.8581%0.81SS**SBendtrans111.9132.3157.8-51.3-138.771.400117.5
15L53.4Low47.7Very low160 Ų160159.3 Ų159.384%0.83881%0.807SS**  trans75.872.5164.8-63.2125.3000116.9
16K43.8Very low49.1Very low208 Ų208160.6 Ų160.690%0.90480%0.799SS**  trans-129.4106.2136.8-100.2174.1-175.1167.90111.7
17A41.3Very low50.1Low85 Ų85159.1 Ų159.170%0.70279%0.794SS**  trans67.1106.5135.600000117.7R19A17-R19 VanDerWaalsContact C-N 3.33Å; A17-R19 PolarHBondContact O-N 3.05Å
18A50.2Low51.2Low108 Ų108157.6 Ų157.689%0.89379%0.787SS**  -11.487128.500000114.6
19R45.3Very low52.2Low240 Ų240150.8 Ų150.891%0.90677%0.766SS**  trans-147.450.2158.4-131.5178.2-170.8-130.94.8110.2A17 R21A17-R19 VanDerWaalsContact C-N 3.33Å; A17-R19 PolarHBondContact O-N 3.05Å; R19-R21 VanDerWaalsContact C-N 3.29Å; R19-R21 PolarHBondContact O-N 3.29Å
20R56.2Low53.4Low245 Ų245147.9 Ų147.993%0.92575%0.75SS**  trans-67.894.9158.5-69.6-159.6-172.5-1564107.3
21R58.6Low54.1Low215 Ų215148.5 Ų148.581%0.81174%0.744SS**SBendtrans-168102149.3-106-178.7-80.8-172.91.9108.2R19R19-R21 VanDerWaalsContact C-N 3.29Å; R19-R21 PolarHBondContact O-N 3.29Å
22Y54.4Low55.5Low226 Ų226145.2 Ų145.289%0.88672%0.721SS**  trans74.682.8170.5-52.9-78.4000116
23K51.5Low56.3Low193 Ų193145.7 Ų145.784%0.83971%0.709SS**  trans-120.8122149.5-162.8142.1177.6161.10106.5F25K23-F25 PolarHBondContact O-N 2.92Å; K23-F25 VanDerWaalsContact O-N 3.15Å
24T52.5Low57.2Low117 Ų117150.8 Ų150.872%0.71872%0.719SS**  trans-37.5110.8174.625.80000111.6M26T24-M26 VanDerWaalsContact C-N 3.32Å; T24-M26 PolarHBondContact O-N 2.96Å
25F59.1Low57.7Low153 Ų153144.9 Ų144.967%0.67170%0.695SS**  trans-64.1103.5154.4-78.4-82000105.5K23 I27 I30K23-F25 PolarHBondContact O-N 2.92Å; K23-F25 VanDerWaalsContact O-N 3.15Å; F25-I27 PolarHBondContact O-N 3.23Å; F25-I30 HydrophobicContact CB-CD1 4.05Å; F25-I30 HydrophobicContact CB-CG1 4.32Å; F25-I30 HydrophobicContact CD1-CG1 4.33Å
26M70.3Confident58Low120 Ų120140.8 Ų140.859%0.59168%0.679SS**  trans-61.3137.9167-65.7-171.5-68.200106.2T24 D28 E29T24-M26 VanDerWaalsContact C-N 3.32Å; T24-M26 PolarHBondContact O-N 2.96Å; M26-D28 PolarHBondContact O-N 3.35Å; M26-E29 WeakPolarHBondContact O-CB 3.37Å; M26-E29 PolarHBondContact O-N 3.33Å
27I62.2Low58.9Low126 Ų126134.4 Ų134.465%0.64666%0.655SS**Hα-helixtrans-55.4-29.7179.6-64.1171.4000109.7F25 E29 I30 L31F25-I27 PolarHBondContact O-N 3.23Å; I27-E29 VanDerWaalsContact C-N 3.29Å; I27-E29 PolarHBondContact O-N 2.97Å; I27-I30 PolarHBondContact O-N 3.36Å; I27-L31 HydrophobicContact CG2-CD1 3.83Å; I27-L31 HydrophobicContact CG2-CG 4.32Å; I27-L31 WeakPolarHBondContact O-CG 3.44Å; I27-L31 PolarHBondContact O-N 3.01Å
28D63.3Low59.9Low123 Ų123138 Ų13866%0.65865%0.651SS**Hα-helixtrans-65.1-25.6175.1-52.4-50.1000114M26 S32M26-D28 PolarHBondContact O-N 3.35Å; D28-S32 PolarHBondContact O-N 3.38Å
29E66.3Low60.4Low98 Ų98140.4 Ų140.446%0.45864%0.642SS.*Hα-helixtrans-77-34.5176.1-166.3179.1174.400111.5M26 I27 S32 T35M26-E29 WeakPolarHBondContact O-CB 3.37Å; M26-E29 PolarHBondContact O-N 3.33Å; I27-E29 VanDerWaalsContact C-N 3.29Å; I27-E29 PolarHBondContact O-N 2.97Å; E29-S32 WeakPolarHBondContact O-CB 3.44Å; E29-S32 PolarHBondContact O-N 3.36Å; E29-S32 PolarHBondContact O-OG 3.45Å; E29-T35 PolarHBondContact O-OG1 2.9Å
30I66.2Low61.4Low105 Ų105135 Ų13554%0.53863%0.627SS.*Hα-helixtrans-76.1-29.4175.9-59.8174000111.3F25 I27 T35F25-I30 HydrophobicContact CB-CD1 4.05Å; F25-I30 HydrophobicContact CB-CG1 4.32Å; F25-I30 HydrophobicContact CD1-CG1 4.33Å; I27-I30 PolarHBondContact O-N 3.36Å; I30-T35 PolarHBondContact O-OG1 3.16Å; I30-T35 VanDerWaalsContact O-OG1 3.12Å
31L56.5Low61.4Low124 Ų124130.9 Ų130.965%0.64962%0.616SS**SBendtrans-94.84.3175.6-61.3178.7000112.6I27 K33I27-L31 HydrophobicContact CG2-CD1 3.83Å; I27-L31 HydrophobicContact CG2-CG 4.32Å; I27-L31 WeakPolarHBondContact O-CG 3.44Å; I27-L31 PolarHBondContact O-N 3.01Å; L31-K33 PolarHBondContact O-N 3.47Å
32S72.1Confident61.6Low30 Ų30125.1 Ų125.121%0.2160%0.6CS.*  trans-59.8134.4174.9670000108.9D28 E29 E34 T35 C36D28-S32 PolarHBondContact O-N 3.38Å; E29-S32 WeakPolarHBondContact O-CB 3.44Å; E29-S32 PolarHBondContact O-N 3.36Å; E29-S32 PolarHBondContact O-OG 3.45Å; S32-E34 PolarHBondContact O-N 2.89Å; S32-T35 PolarHBondContact O-N 3.21Å; S32-T35 PolarHBondContact O-OG1 3.01Å; S32-T35 WeakPolarHBondContact OG-CG2 3.3Å; S32-T35 PolarHBondContact OG-OG1 2.95Å; S32-C36 PolarHBondContact O-N 3.05Å; S32-C36 VanDerWaalsContact O-N 3.14Å
33K59.1Low61.6Low148 Ų148118.1 Ų118.164%0.64358%0.584SS**Hα-helixtrans-53.7-30.9-175.8-170.2179.5-179.5-58.50112.3L31 C36 D37L31-K33 PolarHBondContact O-N 3.47Å; K33-C36 PolarHBondContact O-N 3.36Å; K33-D37 IonicContact NZ-OD1 3.45Å; K33-D37 IonicContact NZ-OD2 2.71Å; K33-D37 PolarHBondContact NZ-OD2 2.85Å; K33-D37 WeakPolarHBondContact O-CB 3.46Å; K33-D37 PolarHBondContact O-N 3.41Å
34E67.1Low61.8Low161 Ų161115.4 Ų115.475%0.75258%0.578SS**Hα-helixtrans-65.7-41.3179.1-39.6-179.9-152.300112.7S32 Y38S32-E34 PolarHBondContact O-N 2.89Å; E34-Y38 WeakPolarHBondContact O-CB 3.43Å; E34-Y38 PolarHBondContact O-N 3.16Å; E34-Y38 VanDerWaalsContact O-N 3.12Å
35T62.8Low62Low57 Ų57120.2 Ų120.235%0.3559%0.585SS.*Hα-helixtrans-78.2-32.517855.60000112.1E29 I30 S32 Y38 F39E29-T35 PolarHBondContact O-OG1 2.9Å; I30-T35 PolarHBondContact O-OG1 3.16Å; I30-T35 VanDerWaalsContact O-OG1 3.12Å; S32-T35 PolarHBondContact O-N 3.21Å; S32-T35 PolarHBondContact O-OG1 3.01Å; S32-T35 WeakPolarHBondContact OG-CG2 3.3Å; S32-T35 PolarHBondContact OG-OG1 2.95Å; T35-Y38 PolarHBondContact O-N 3.43Å; T35-F39 PolarHBondContact O-N 3.09Å
36C59.9Low61.4Low75 Ų75117.7 Ų117.751%0.50759%0.586SS.*Hα-helixtrans-65.5-48.2173.6-143.40000110.9S32 K33 Y38 F39 E40S32-C36 PolarHBondContact O-N 3.05Å; S32-C36 VanDerWaalsContact O-N 3.14Å; K33-C36 PolarHBondContact O-N 3.36Å; C36-Y38 PolarHBondContact O-N 2.99Å; C36-F39 PolarHBondContact O-N 3.19Å; C36-F39 VanDerWaalsContact O-N 3.17Å; C36-E40 WeakPolarHBondContact O-CB 3.45Å; C36-E40 PolarHBondContact O-N 2.84Å
37D62.1Low60.6Low74 Ų74117.4 Ų117.440%0.39659%0.591SS.*Hα-helixtrans-61.4-34.6175.7-70.8-11.1000110.8K33 K41K33-D37 IonicContact NZ-OD1 3.45Å; K33-D37 IonicContact NZ-OD2 2.71Å; K33-D37 PolarHBondContact NZ-OD2 2.85Å; K33-D37 WeakPolarHBondContact O-CB 3.46Å; K33-D37 PolarHBondContact O-N 3.41Å; D37-K41 VanDerWaalsContact O-CB 3.28Å; D37-K41 WeakPolarHBondContact O-CB 3.5Å; D37-K41 PolarHBondContact O-N 3.11Å
38Y62Low59.7Low159 Ų159116.3 Ų116.362%0.62459%0.593SS**Hα-helixtrans-68.3-42.1175-171.5-104.5000112.8E34 T35 C36 K41 L42E34-Y38 WeakPolarHBondContact O-CB 3.43Å; E34-Y38 PolarHBondContact O-N 3.16Å; E34-Y38 VanDerWaalsContact O-N 3.12Å; T35-Y38 PolarHBondContact O-N 3.43Å; C36-Y38 PolarHBondContact O-N 2.99Å; Y38-K41 PolarHBondContact O-N 2.89Å; Y38-L42 HydrophobicContact CD1-CD1 3.45Å; Y38-L42 VanDerWaalsContact CD1-CD1 3.45Å; Y38-L42 HydrophobicContact CE1-CD1 3.1Å; Y38-L42 HydrophobicContact CE2-CD1 4.27Å; Y38-L42 HydrophobicContact CG-CD1 4.17Å; Y38-L42 WeakPolarHBondContact O-CD1 3.32Å; Y38-L42 PolarHBondContact O-N 3.4Å
39F61.6Low59.4Low160 Ų160116.9 Ų116.970%0.70260%0.604SS**Hα-helixtrans-68.4-36.5178-150.6-91.4000111.9T35 C36 L42 S43T35-F39 PolarHBondContact O-N 3.09Å; C36-F39 PolarHBondContact O-N 3.19Å; C36-F39 VanDerWaalsContact O-N 3.17Å; F39-L42 PolarHBondContact O-N 3.44Å; F39-S43 PolarHBondContact O-N 3.07Å
40E64.8Low58.8Low127 Ų127116.6 Ų116.659%0.59361%0.613SS**Hα-helixtrans-66.8-38.4174.4-158.4169.4-157.700111.4C36 S43 L44C36-E40 WeakPolarHBondContact O-CB 3.45Å; C36-E40 PolarHBondContact O-N 2.84Å; E40-S43 WeakPolarHBondContact O-CB 3.14Å; E40-S43 PolarHBondContact O-N 3.48Å; E40-L44 PolarHBondContact O-N 2.96Å
41K57.5Low58.1Low158 Ų158119 Ų11969%0.68763%0.626SS**Hα-helixtrans-68.5-35174.6-150.5172.7-168.8178.40113D37 Y38 L44 Y45D37-K41 VanDerWaalsContact O-CB 3.28Å; D37-K41 WeakPolarHBondContact O-CB 3.5Å; D37-K41 PolarHBondContact O-N 3.11Å; Y38-K41 PolarHBondContact O-N 2.89Å; K41-L44 PolarHBondContact O-N 3.45Å; K41-Y45 PolarHBondContact O-N 3.2Å
42L61.9Low58Low93 Ų93119.7 Ų119.749%0.48764%0.635SS.*Hα-helixtrans-68.1-35.5170.1-97.3130.1000112.3Y38 F39 Y45Y38-L42 HydrophobicContact CD1-CD1 3.45Å; Y38-L42 VanDerWaalsContact CD1-CD1 3.45Å; Y38-L42 HydrophobicContact CE1-CD1 3.1Å; Y38-L42 HydrophobicContact CE2-CD1 4.27Å; Y38-L42 HydrophobicContact CG-CD1 4.17Å; Y38-L42 WeakPolarHBondContact O-CD1 3.32Å; Y38-L42 PolarHBondContact O-N 3.4Å; F39-L42 PolarHBondContact O-N 3.44Å; L42-Y45 PolarHBondContact O-N 3.23Å
43S54.2Low56.9Low79 Ų79124.2 Ų124.255%0.55266%0.661SS**Hα-helixtrans-66.4-36.7174.7-169.10000112.2F39 E40 Y45 S46F39-S43 PolarHBondContact O-N 3.07Å; E40-S43 WeakPolarHBondContact O-CB 3.14Å; E40-S43 PolarHBondContact O-N 3.48Å; S43-Y45 VanDerWaalsContact C-N 3.31Å; S43-Y45 PolarHBondContact O-N 2.89Å; S43-S46 PolarHBondContact O-N 3.39Å
44L55.5Low56.6Low136 Ų136127.9 Ų127.971%0.71267%0.671SS**Hα-helixtrans-68.2-26.3176.1-89.1159.4000113.5E40 K41E40-L44 PolarHBondContact O-N 2.96Å; K41-L44 PolarHBondContact O-N 3.45Å
45Y57Low55.8Low219 Ų219125.7 Ų125.786%0.85967%0.67SS**THydrogen-bonded Turntrans-87.6-2179.1-152.8-104.5000113.9K41 L42 S43K41-Y45 PolarHBondContact O-N 3.2Å; L42-Y45 PolarHBondContact O-N 3.23Å; S43-Y45 VanDerWaalsContact C-N 3.31Å; S43-Y45 PolarHBondContact O-N 2.89Å
46S46.8Very low55Low100 Ų100131.9 Ų131.970%0.69969%0.692SS**THydrogen-bonded Turntrans-93.1-0177.7-173.80000114.1S43S43-S46 PolarHBondContact O-N 3.39Å
47V52.8Low54.5Low113 Ų113134.2 Ų134.269%0.68571%0.707SS**  trans-96.8102.5178.1-170.90000109.3P49V47-P49 WeakPolarHBondContact O-CD 3.43Å
48C44.4Very low53.8Low103 Ų103138 Ų13870%0.69673%0.726SS**  trans-57.5122.2169.2-70.30000110.5S50C48-S50 VanDerWaalsContact C-N 3.27Å; C48-S50 PolarHBondContact O-N 3.1Å; C48-S50 VanDerWaalsContact O-N 3.08Å
49P56.3Low52.9Low135 Ų135138.2 Ų138.288%0.87773%0.732SS**SBendtrans-87.658.9178.235.7-32.8000111.1V47V47-P49 WeakPolarHBondContact O-CD 3.43Å
50S54.9Low52.2Low93 Ų93136.6 Ų136.665%0.6574%0.741SS**  trans-153.428.2177.3630000116.6C48C48-S50 VanDerWaalsContact C-N 3.27Å; C48-S50 PolarHBondContact O-N 3.1Å; C48-S50 VanDerWaalsContact O-N 3.08Å
51L50.7Low51Low156 Ų156136.4 Ų136.482%0.81775%0.752SS**  trans-116.570.9162.6-62.9179.7000110.1V53L51-V53 PolarHBondContact O-N 3.41Å
52V54Low50.6Low137 Ų137136.2 Ų136.283%0.8376%0.764SS**  trans-70.187.5160.5-179.90000107R54V52-R54 PolarHBondContact O-N 3.46Å; V52-R54 VanDerWaalsContact O-N 3.08Å
53V49.3Very low49.5Very low125 Ų125135.4 Ų135.476%0.75878%0.779SS**  trans-73.897.5165.7179.30000106.7L51 P55L51-V53 PolarHBondContact O-N 3.41Å; V53-P55 VanDerWaalsContact O-CD 3.29Å; V53-P55 WeakPolarHBondContact O-CD 3.38Å
54R52.4Low49.1Very low226 Ų226137.6 Ų137.685%0.85379%0.794SS**PPolyproline II helixtrans-62.8116.6173.7-155.6175.4-166.4143.30.1108.5V52 K56V52-R54 PolarHBondContact O-N 3.46Å; V52-R54 VanDerWaalsContact O-N 3.08Å; R54-K56 PolarHBondContact O-N 2.92Å
55P49.8Very low49.3Very low114 Ų114136.9 Ų136.974%0.7480%0.797SS**PPolyproline II helixtrans-68.3122.6171.726-30.1000108.9V53V53-P55 VanDerWaalsContact O-CD 3.29Å; V53-P55 WeakPolarHBondContact O-CD 3.38Å
56K46.4Very low48.9Very low188 Ų188131.6 Ų131.682%0.81779%0.793SS**PPolyproline II helixtrans-64.6126.7166.5-87.1167171.1163.30108R54 L58R54-K56 PolarHBondContact O-N 2.92Å; K56-L58 PolarHBondContact O-N 3.35Å; K56-L58 VanDerWaalsContact O-N 3.11Å
57P50.6Low49.2Very low124 Ų124134.4 Ų134.481%0.80580%0.799SS**  trans-74.2105.3173.129.3-28.3000107.6
58L45.9Very low49.4Very low152 Ų152139 Ų13980%0.79680%0.804SS**  trans-87.1111.5160.9-72.2179.6000107.8K56K56-L58 PolarHBondContact O-N 3.35Å; K56-L58 VanDerWaalsContact O-N 3.11Å
59H44.7Very low49.4Very low165 Ų165138.8 Ų138.876%0.76481%0.81SS**  trans44.6114.1142.4-72.9-92.6000118.4C61H59-C61 PolarHBondContact O-N 2.87Å
60S46.4Very low48.8Very low126 Ų126140.3 Ų140.388%0.88180%0.799SS**  trans-47.9116.1158.9-47.10000111.7
61C39.1Very low49.1Very low122 Ų122141.8 Ų141.882%0.82481%0.806SS**  trans-127.5108.5157.4-69.50000107.7H59H59-C61 PolarHBondContact O-N 2.87Å
62T49.3Very low49.2Very low154 Ų154142.1 Ų142.195%0.94581%0.808SS**  trans-63.2123.5167.4270000109.9
63G39.3Very low49.1Very low77 Ų77143.4 Ų143.479%0.79481%0.81SS**  trans-176.1132.9175.100000112.3
64S46.4Very low49Very low125 Ų125142.9 Ų142.987%0.87481%0.812SS**  trans-61.3162.8-165.6-140.10000116.5
65P58Low48.8Very low120 Ų120137.9 Ų137.978%0.77981%0.806SS**  trans-93.6133.8-169.835.6-27.6000112.4
66S49.3Very low48.8Very low109 Ų109139.8 Ų139.876%0.76281%0.808SS**  trans-152.9110.8160.8-165.30000112.9
67L53.6Low48.8Very low158 Ų158135.5 Ų135.583%0.82780%0.798SS**  trans45.8106145.8-55.6-178.4000120.3
68R56.5Low48.6Very low210 Ų210140.5 Ų140.579%0.79280%0.8SS**  trans44.998130.4-150.8-146.4-86.6-170.4-4.5117.1Y70R68-Y70 HydrophobicContact CG-CE2 4.17Å
69A45.4Very low48.2Very low99 Ų99140.7 Ų140.782%0.81880%0.797SS**  trans-137.9111157.100000110.2
70Y43.4Very low48.1Very low166 Ų166137.7 Ų137.765%0.65179%0.793SS**  trans-62.1148.4175.2-66.7-88.1000111R68 L72R68-Y70 HydrophobicContact CG-CE2 4.17Å; Y70-L72 PolarHBondContact O-N 3.48Å
71P59.6Low48Very low124 Ų124137.7 Ų137.781%0.80579%0.788SS**  trans-65.9110.8170.727.6-31.7000108.8L73P71-L73 PolarHBondContact O-N 3.5Å
72L52.9Low48.3Very low163 Ų163138.2 Ų138.285%0.85379%0.787SS**  trans-63.4120.3170.2-69.2177.7000108.5Y70 S74Y70-L72 PolarHBondContact O-N 3.48Å; L72-S74 PolarHBondContact O-N 2.71Å; L72-S74 VanDerWaalsContact O-N 3.16Å
73L53.2Low48.3Very low165 Ų165137.8 Ų137.886%0.86478%0.777SS**  trans-57.2115.5164.9-71.2160000108P71 V75P71-L73 PolarHBondContact O-N 3.5Å; L73-V75 PolarHBondContact O-N 3.08Å
74S46.9Very low48.2Very low114 Ų114139.4 Ų139.480%0.79778%0.776SS**  trans-63.197.5173.7-42.60000109.2L72 I76L72-S74 PolarHBondContact O-N 2.71Å; L72-S74 VanDerWaalsContact O-N 3.16Å; S74-I76 PolarHBondContact O-N 3.22Å; S74-I76 VanDerWaalsContact O-N 3.11Å
75V47.9Very low47.8Very low121 Ų121142.4 Ų142.473%0.73378%0.777SS**  trans-65108.9165.2173.20000106.7L73 T77L73-V75 PolarHBondContact O-N 3.08Å; V75-T77 HydrophobicContact CG1-CG2 4.42Å; V75-T77 PolarHBondContact O-N 3.02Å
76I51Low47.1Very low154 Ų154144.6 Ų144.679%0.7978%0.781SS**  trans-70.680.7168.1-60.4165.9000106.8S74 R78S74-I76 PolarHBondContact O-N 3.22Å; S74-I76 VanDerWaalsContact O-N 3.11Å; I76-R78 HydrophobicContact CG2-CG 4.48Å; I76-R78 PolarHBondContact O-N 2.89Å
77T45.1Very low47.3Very low97 Ų97144.8 Ų144.860%0.59578%0.777SS**  trans-76.3104.7160.4152.50000106.5V75 Q79V75-T77 HydrophobicContact CG1-CG2 4.42Å; V75-T77 PolarHBondContact O-N 3.02Å; T77-Q79 PolarHBondContact O-N 3.14Å
78R46.9Very low47.1Very low229 Ų229143.1 Ų143.186%0.86478%0.776SS**  trans-63.897.5167.4-80.6-176.4155.2-105.4-2.5108.1I76I76-R78 HydrophobicContact CG2-CG 4.48Å; I76-R78 PolarHBondContact O-N 2.89Å
79Q37.5Very low46.2Very low156 Ų156137.2 Ų137.273%0.72977%0.771SS**  trans-65.1132.8161.6-69-75.237.800108.6T77T77-Q79 PolarHBondContact O-N 3.14Å
80P43Very low46.2Very low103 Ų103139.2 Ų139.267%0.66977%0.774SS**  trans-74124.3165.129.5-28.2000108.4V82P80-V82 PolarHBondContact O-N 2.81Å
81T44.3Very low46.7Very low126 Ų126137.5 Ų137.577%0.77378%0.783SS**  trans-57.9109168.9-58.40000108.9I83T81-I83 HydrophobicContact CG2-CG1 4.08Å; T81-I83 PolarHBondContact O-N 2.98Å
82V44.1Very low45.5Very low133 Ų133134.8 Ų134.881%0.80678%0.777SS**  trans-75.5107.1164.2-165.40000105.8P80 S84P80-V82 PolarHBondContact O-N 2.81Å; V82-S84 PolarHBondContact O-N 2.88Å
83I50.2Low44.9Very low145 Ų145134.8 Ų134.874%0.74478%0.777SS**  trans-75.8114.5172.2-66.3175.3000106.7T81 Q85T81-I83 HydrophobicContact CG2-CG1 4.08Å; T81-I83 PolarHBondContact O-N 2.98Å; I83-Q85 PolarHBondContact O-N 3.43Å
84S36.2Very low44.2Very low111 Ų111130.9 Ų130.978%0.77677%0.768SS**  trans-56.4128170.8-71.50000110.6V82V82-S84 PolarHBondContact O-N 2.88Å
85Q39.2Very low43.8Very low188 Ų188134.3 Ų134.388%0.87977%0.772SS**  trans-61.5129.3167.3-62.1-179.3-3600109.6I83I83-Q85 PolarHBondContact O-N 3.43Å
86L43.8Very low43.2Very low166 Ų166132 Ų13287%0.86977%0.765SS**  trans-129.3107.3158.2-165.273.6000108.1
87V52Low42.4Very low113 Ų113132.8 Ų132.869%0.68577%0.77SS**  trans-75.9147.3164.4173.70000107.7
88P49.9Very low41.8Very low123 Ų123132.6 Ų132.680%0.79977%0.773SS**  -133.3133.6114.618.41.1000112.2
89A37.8Very low41.1Very low85 Ų85127.2 Ų127.270%0.70277%0.769SS**  trans-74.1145.2166.800000110.6
90T44.7Very low41.2Very low141 Ų141128.5 Ų128.587%0.86578%0.775SS**  trans-150.6155.9141.440.20000109.8
91P53.7Low41.3Very low130 Ų130129.5 Ų129.584%0.84478%0.781SS**  trans-106.3166.7-153.338.7-30.2000114.1
92G34.4Very low40.7Very low67 Ų67129.2 Ų129.269%0.69178%0.779SS**  trans129.4101.4140.500000119
93I40.5Very low40.4Very low164 Ų164129.8 Ų129.884%0.84178%0.783SS**  trans63.9120.8130.8-56.4166.9000120.2
94A39.2Very low39.6Very low83 Ų83131.8 Ų131.869%0.68679%0.789SS**  trans139.7101135.200000109.8
95Q38.7Very low39.5Very low185 Ų185130.9 Ų130.986%0.86479%0.788SS**  79.3134.686.1-83.1-167.356.600115.2
96A34.6Very low39.2Very low73 Ų73128.2 Ų128.260%0.60379%0.785SS**  trans87.6119.3144.800000118.9
97L34.1Very low38.6Very low171 Ų171125.4 Ų125.490%0.89578%0.779SS**  60.4150.1127.8-55.8174.6000116.4
98S32.4Very low37.9Very low93 Ų93124.2 Ų124.265%0.6578%0.781SS**  cis173.6164.7-3.4174.90000103.8
99C32.3Very low37Very low115 Ų115127.2 Ų127.278%0.77778%0.784SS**  trans80.9115.3157.3-590000119.5
100H41.3Very low37.1Very low183 Ų183127 Ų12785%0.84778%0.782SS**  trans-55.7166.9141.5-47.6-88000110.6
101P44.4Very low37.2Very low124 Ų124126.1 Ų126.181%0.80578%0.779SS**  -144.4161.576.730.5-8.9000116.3
102V32.2Very low36.3Very low121 Ų121123.8 Ų123.873%0.73378%0.779SS**  trans-24.4136.4149.81710000115.4
103T36.8Very low36.4Very low145 Ų145124.3 Ų124.389%0.8978%0.784SS**  trans-147.4114143.9440000110.1
104E33.6Very low36.6Very low186 Ų186125.7 Ų125.787%0.86979%0.787SS**  trans-74.4146.1159.7-69.4-179.69600110.6
105A34.3Very low36.6Very low92 Ų92126.5 Ų126.576%0.7679%0.794SS**  trans177.8105.2148.600000108
106V32Very low36.9Very low133 Ų133126.5 Ų126.581%0.80680%0.799SS**  80.4125.883.8101.50000115.4
107S30.9Very low37.4Very low106 Ų106127.9 Ų127.974%0.74181%0.81SS**  trans67.6115147.9-78.70000124
108A37.9Very low37.9Very low89 Ų89125.4 Ų125.474%0.73681%0.807SS**  84136.7108.400000122.4
109E31.8Very low38.5Very low185 Ų185126.1 Ų126.186%0.86481%0.812SS**  trans85.2131.7146.9-80.1-99.570.800121.3
110A39Very low39.2Very low80 Ų80129 Ų12966%0.66181%0.814SS**  trans-78-169.7169.500000109.1
111P46.2Very low39Very low123 Ų123125.8 Ų125.880%0.79981%0.812SS**  cis-151.6-179.638.236.8-11.1000117.1
112G35.1Very low39.2Very low81 Ų81129 Ų12984%0.83582%0.817SS**  trans48.5119.1134.300000121.6
113G38.1Very low39.6Very low78 Ų78129.1 Ų129.180%0.80482%0.818SS**  trans-161.688166.500000112.2
114E43.7Very low39.9Very low193 Ų193131.1 Ų131.190%0.90282%0.817SS**  trans-66.3132.7164.953-151.383.600112
115A39.7Very low40.6Very low101 Ų101129.2 Ų129.284%0.83581%0.808SS**  trans-148.6107.2165.400000110.3
116L45.6Very low41Very low185 Ų185129.8 Ų129.897%0.96980%0.804SS**  trans-68.1130.6161.9-70.1163.1000109
117A43.8Very low41.8Very low101 Ų101128.8 Ų128.884%0.83580%0.799SS**  trans-145.7108.1161.200000109.5
118S44.1Very low42.9Very low119 Ų119129 Ų12983%0.83280%0.798SS**  trans-72.6137160.6-64.60000109.9
119S45.3Very low43.9Very low108 Ų108136.3 Ų136.376%0.75581%0.806SS**  trans-177.8129.6137.6-87.70000110.5
120E47.1Very low45.3Very low175 Ų175135.8 Ų135.882%0.81880%0.804SS**  trans-49.5141.2165.455.2-11763.900114.6
121S38.2Very low46.7Very low116 Ų116141.6 Ų141.681%0.81181%0.814SS**  trans-163.5114.9139.8-60000109.8T123S121-T123 PolarHBondContact O-N 2.63Å
122E47.2Very low47.9Very low191 Ų191144.7 Ų144.789%0.89382%0.815SS**  trans-58.4129.8166-73.4-174.879.800110.8
123T40.8Very low49.7Very low124 Ų124146.6 Ų146.676%0.76181%0.813SS**  trans-154.487.6147.7-62.30000106.5S121 Q125S121-T123 PolarHBondContact O-N 2.63Å; T123-Q125 VanDerWaalsContact C-N 3.32Å; T123-Q125 HydrophobicContact CG2-CG 4.34Å; T123-Q125 PolarHBondContact O-N 3.22Å
124E44.4Very low51.6Low188 Ų188154.6 Ų154.688%0.87982%0.818SS**  trans-73.988.2172.8-149.5-160.3132.100109.2
125Q46.8Very low53.3Low145 Ų145157 Ų15768%0.67882%0.82SS**  trans-90.1124.7161.6-94.7-8917.700108.2T123 T127T123-Q125 VanDerWaalsContact C-N 3.32Å; T123-Q125 HydrophobicContact CG2-CG 4.34Å; T123-Q125 PolarHBondContact O-N 3.22Å; Q125-T127 VanDerWaalsContact C-N 3.28Å; Q125-T127 PolarHBondContact O-N 3.09Å
126P42.5Very low55.2Low104 Ų104157.7 Ų157.768%0.67582%0.818SS**  trans-73.485.9178.129.7-32000109
127T50.1Low57.4Low113 Ų113160 Ų16069%0.69381%0.813SS**  trans-60.6127.9170.755.40000108.7Q125 R129Q125-T127 VanDerWaalsContact C-N 3.28Å; Q125-T127 PolarHBondContact O-N 3.09Å; T127-R129 PolarHBondContact O-N 3.08Å
128P53.6Low59.5Low111 Ų111159.4 Ų159.472%0.72180%0.8SS**  trans-62113.417824-31.5000107.4Q130P128-Q130 VanDerWaalsContact C-N 3.29Å; P128-Q130 PolarHBondContact O-N 3.29Å
129R58.9Low61.9Low241 Ų241160.8 Ų160.891%0.90980%0.796SS**  trans-53.893.6179.4-61.5179.1-166-111.1-0.6108.5T127 K131T127-R129 PolarHBondContact O-N 3.08Å; R129-K131 PolarHBondContact O-N 3.15Å
130Q61.9Low64.4Low174 Ų174157.9 Ų157.981%0.81377%0.77SS**  trans-62.3111.3177.2-67.3-155-14.300106.8P128 K132P128-Q130 VanDerWaalsContact C-N 3.29Å; P128-Q130 PolarHBondContact O-N 3.29Å; Q130-K132 PolarHBondContact O-N 3.5Å
131K66.8Low66.8Low203 Ų203153.2 Ų153.288%0.88375%0.754SS**  trans-58.4107.6177.6-65.5177.3-178.2176.80106.1R129 P133R129-K131 PolarHBondContact O-N 3.15Å; K131-P133 WeakPolarHBondContact O-CD 3.37Å; K131-P133 VanDerWaalsContact O-N 3.1Å
132K71.4Confident69.7Low187 Ų187154.7 Ų154.781%0.81375%0.748SS**PPolyproline II helixtrans-47.9121.6179.5-86.382.2175.5-178.40108Q130 R134Q130-K132 PolarHBondContact O-N 3.5Å; K132-R134 PolarHBondContact O-N 3.29Å
133P73.4Confident72.1Confident121 Ų121151.3 Ų151.379%0.78674%0.735SS**PPolyproline II helixtrans-53.6133.1178.4-2633.5000109.9K131 R135K131-P133 WeakPolarHBondContact O-CD 3.37Å; K131-P133 VanDerWaalsContact O-N 3.1Å; P133-R135 PolarHBondContact O-N 3.16Å
134R78.3Confident74.8Confident246 Ų246147.1 Ų147.193%0.92871%0.707SS**PPolyproline II helixtrans-57.8126.7171.8-72.5-177.2164.7-166.8-3.8107.6K132 S136K132-R134 PolarHBondContact O-N 3.29Å; R134-S136 PolarHBondContact O-N 2.89Å
135R79.1Confident77.4Confident245 Ų245141 Ų14193%0.92568%0.68SS**PPolyproline II helixtrans-56.6125.9175.5-70-179.2-174.8141.70.5109P133P133-R135 PolarHBondContact O-N 3.16Å
136S80.6Confident79.8Confident114 Ų114139.7 Ų139.780%0.79768%0.675SS**PPolyproline II helixtrans-55.3140.5173.8-62.80000110.1R134 T138R134-S136 PolarHBondContact O-N 2.89Å; S136-T138 PolarHBondContact O-N 2.71Å
137R90.3Very high82.5Confident233 Ų233135.6 Ų135.688%0.87965%0.652SS**PPolyproline II helixtrans-68.5130.2177.5-70.8179.4176.3169.3-1.9109.3
138T88.6Confident84.8Confident89 Ų89130.2 Ų130.255%0.54662%0.619SS.*PPolyproline II helixtrans-74.4137.2170-44.30000110.2S136 F140S136-T138 PolarHBondContact O-N 2.71Å; T138-F140 HydrophobicContact CG2-CE1 4.43Å
139I94.5Very high86.9Confident148 Ų148127.1 Ų127.176%0.75960%0.595SS**  trans-106.3131169.7-54.1-60.2000107.6
140F97.6Very high88.8Confident48 Ų48122 Ų12221%0.21158%0.58CS.*  trans-86.7146.8176.1-58.7-54000110.2T138 Q144 L145 L172 Q176 W180T138-F140 HydrophobicContact CG2-CE1 4.43Å; F140-Q144 HydrophobicContact CB-CB 4.27Å; F140-L145 HydrophobicContact CB-CD2 3.88Å; F140-L145 HydrophobicContact CB-CG 4.03Å; F140-L145 HydrophobicContact CD2-CD2 4.09Å; F140-L145 HydrophobicContact CG-CD2 4.43Å; F140-L172 HydrophobicContact CD1-CD1 4.31Å; F140-L172 HydrophobicContact CD1-CD2 3.8Å; F140-L172 HydrophobicContact CE1-CD1 4.28Å; F140-L172 HydrophobicContact CE1-CD2 3.81Å; F140-Q176 HydrophobicContact CE1-CB 4.12Å; F140-Q176 HydrophobicContact CE1-CG 4.26Å; F140-Q176 HydrophobicContact CZ-CB 4.1Å; F140-Q176 HydrophobicContact CZ-CG 4.37Å; F140-W180 AromaticContact CD2-CD1 3.89Å; F140-W180 HydrophobicContact CE2-CB 4.47Å; F140-W180 AromaticContact CE2-CD1 3.71Å; F140-W180 HydrophobicContact CE2-CG 4.47Å
141T98.3Very high90.6Very high76 Ų76116.5 Ų116.547%0.46655%0.553SS.*  trans-72.4161.4173.770.20000110.9L143 Q144 L145T141-L143 VanDerWaalsContact C-N 3.29Å; T141-L143 PolarHBondContact O-N 3.31Å; T141-Q144 WeakPolarHBondContact O-CB 3.22Å; T141-Q144 PolarHBondContact O-N 3.45Å; T141-Q144 VanDerWaalsContact O-N 3.16Å; T141-Q144 VanDerWaalsContact OG1-CG 3.3Å; T141-Q144 WeakPolarHBondContact OG1-CG 3.26Å; T141-Q144 PolarHBondContact OG1-N 3.33Å; T141-L145 WeakPolarHBondContact O-CG 3.3Å; T141-L145 PolarHBondContact O-N 3.35Å
142E97.8Very high92.1Very high147 Ų147106.9 Ų106.969%0.68751%0.511SS*.Hα-helixtrans-58.9-41.9178.1-168.859.8-151.100111.9Q144 L145 M146E142-Q144 VanDerWaalsContact C-N 3.32Å; E142-Q144 PolarHBondContact O-N 2.86Å; E142-L145 PolarHBondContact O-N 2.71Å; E142-M146 WeakPolarHBondContact O-CB 3.23Å; E142-M146 PolarHBondContact O-N 3.29Å
143L98.1Very high93.3Very high121 Ų121104 Ų10463%0.63450%0.5SS*.Hα-helixtrans-59.8-42176.9-177.762.8000111.9T141 M146 G147T141-L143 VanDerWaalsContact C-N 3.29Å; T141-L143 PolarHBondContact O-N 3.31Å; L143-M146 HydrophobicContact CD1-CE 3.96Å; L143-M146 PolarHBondContact O-N 3.24Å; L143-G147 PolarHBondContact O-N 2.78Å
144Q98.4Very high94.5Very high35 Ų35106.2 Ų106.216%0.16450%0.498CS..Hα-helixtrans-64.5-45.1176.5-72.7172.7-22.300111.4F140 T141 E142 M146 G147 L148 L170 L172F140-Q144 HydrophobicContact CB-CB 4.27Å; T141-Q144 WeakPolarHBondContact O-CB 3.22Å; T141-Q144 PolarHBondContact O-N 3.45Å; T141-Q144 VanDerWaalsContact O-N 3.16Å; T141-Q144 VanDerWaalsContact OG1-CG 3.3Å; T141-Q144 WeakPolarHBondContact OG1-CG 3.26Å; T141-Q144 PolarHBondContact OG1-N 3.33Å; E142-Q144 VanDerWaalsContact C-N 3.32Å; E142-Q144 PolarHBondContact O-N 2.86Å; Q144-M146 VanDerWaalsContact C-N 3.34Å; Q144-M146 PolarHBondContact O-N 3.31Å; Q144-G147 PolarHBondContact O-N 3.23Å; Q144-L148 WeakPolarHBondContact O-CB 3.44Å; Q144-L148 WeakPolarHBondContact O-CD1 3.43Å; Q144-L148 VanDerWaalsContact O-CG 3.22Å; Q144-L148 WeakPolarHBondContact O-CG 3.45Å; Q144-L148 PolarHBondContact O-N 3.41Å; Q144-L170 HydrophobicContact CG-CB 4.46Å; Q144-L170 PolarHBondContact NE2-O 2.82Å; Q144-L172 HydrophobicContact CB-CD1 4.5Å
145L98.4Very high95.5Very high60 Ų6097.1 Ų97.131%0.31447%0.466SS..Hα-helixtrans-61.4-43.7177.9-68175.8000111.6F140 T141 E142 L148 E149F140-L145 HydrophobicContact CB-CD2 3.88Å; F140-L145 HydrophobicContact CB-CG 4.03Å; F140-L145 HydrophobicContact CD2-CD2 4.09Å; F140-L145 HydrophobicContact CG-CD2 4.43Å; T141-L145 WeakPolarHBondContact O-CG 3.3Å; T141-L145 PolarHBondContact O-N 3.35Å; E142-L145 PolarHBondContact O-N 2.71Å; L145-L148 PolarHBondContact O-N 2.87Å; L145-E149 WeakPolarHBondContact O-CB 3.47Å; L145-E149 PolarHBondContact O-N 3.13Å
146M98.3Very high96.3Very high117 Ų11788.2 Ų88.258%0.57643%0.434SS*.Hα-helixtrans-62.9-43.7177.7-171.9173.263.400111.8E142 L143 Q144 E149 K150E142-M146 WeakPolarHBondContact O-CB 3.23Å; E142-M146 PolarHBondContact O-N 3.29Å; L143-M146 HydrophobicContact CD1-CE 3.96Å; L143-M146 PolarHBondContact O-N 3.24Å; Q144-M146 VanDerWaalsContact C-N 3.34Å; Q144-M146 PolarHBondContact O-N 3.31Å; M146-E149 PolarHBondContact O-N 3.41Å; M146-K150 VanDerWaalsContact O-CB 3.3Å; M146-K150 WeakPolarHBondContact O-CB 3.35Å; M146-K150 PolarHBondContact O-N 2.91Å
147G98.3Very high97.2Very high19 Ų1989.6 Ų89.620%0.19642%0.422CS..Hα-helixtrans-62-45.1175.600000113L143 Q144 K150 K151L143-G147 PolarHBondContact O-N 2.78Å; Q144-G147 PolarHBondContact O-N 3.23Å; G147-K150 PolarHBondContact O-N 2.94Å; G147-K151 PolarHBondContact O-N 2.95Å; G147-K151 VanDerWaalsContact O-N 3.1Å
148L98.6Very high97.6Very high0 Ų079.4 Ų79.40%039%0.386CS..Hα-helixtrans-61.2-45.2175.9-71.5164.5000111.6Q144 L145 F152 L166 L170 L172 V177 W180 Y181Q144-L148 WeakPolarHBondContact O-CB 3.44Å; Q144-L148 WeakPolarHBondContact O-CD1 3.43Å; Q144-L148 VanDerWaalsContact O-CG 3.22Å; Q144-L148 WeakPolarHBondContact O-CG 3.45Å; Q144-L148 PolarHBondContact O-N 3.41Å; L145-L148 PolarHBondContact O-N 2.87Å; L148-F152 VanDerWaalsContact O-CB 3.26Å; L148-F152 WeakPolarHBondContact O-CB 3.49Å; L148-F152 PolarHBondContact O-N 3.39Å; L148-L166 HydrophobicContact CD2-CD2 3.96Å; L148-L170 HydrophobicContact CD2-CD1 3.97Å; L148-L170 HydrophobicContact CG-CD1 3.73Å; L148-L172 HydrophobicContact CD1-CD1 4.01Å; L148-L172 HydrophobicContact CD2-CD1 4.48Å; L148-V177 HydrophobicContact CD2-CG1 4.28Å; L148-V177 HydrophobicContact CD2-CG2 4.4Å; L148-W180 HydrophobicContact CB-CD2 3.95Å; L148-W180 HydrophobicContact CB-CE3 3.92Å; L148-W180 HydrophobicContact CB-CH2 3.7Å; L148-W180 HydrophobicContact CB-CZ2 3.69Å; L148-W180 HydrophobicContact CB-CZ3 3.81Å; L148-W180 HydrophobicContact CD1-CB 4.46Å; L148-W180 HydrophobicContact CD1-CD2 3.84Å; L148-W180 HydrophobicContact CD1-CE3 4.48Å; L148-W180 HydrophobicContact CD1-CG 3.79Å; L148-W180 HydrophobicContact CD2-CD2 4.33Å; L148-W180 HydrophobicContact CD2-CE3 4.22Å; L148-W180 HydrophobicContact CG-CD2 4.26Å; L148-W180 HydrophobicContact CG-CE3 4.43Å; L148-Y181 HydrophobicContact CD2-CE2 4.28Å
149E98.5Very high98Very high46 Ų4677.6 Ų77.622%0.21538%0.376CS..Hα-helixtrans-66.3-43.9179.3-169.861.7-144.200111.7L145 M146 K151 F152 Q153 R184L145-E149 WeakPolarHBondContact O-CB 3.47Å; L145-E149 PolarHBondContact O-N 3.13Å; M146-E149 PolarHBondContact O-N 3.41Å; E149-K151 PolarHBondContact O-N 2.95Å; E149-F152 WeakPolarHBondContact O-CB 3.28Å; E149-F152 PolarHBondContact O-N 3.41Å; E149-F152 VanDerWaalsContact O-N 3.13Å; E149-Q153 WeakPolarHBondContact O-CG 3.48Å; E149-Q153 PolarHBondContact O-N 3.26Å; E149-R184 VanDerWaalsContact CD-NH2 3.34Å; E149-R184 IonicContact OE1-CZ 3.35Å; E149-R184 IonicContact OE1-NE 2.71Å; E149-R184 PolarHBondContact OE1-NE 3.34Å; E149-R184 IonicContact OE1-NH2 3.35Å; E149-R184 PolarHBondContact OE1-NH2 2.97Å; E149-R184 IonicContact OE2-CZ 3.29Å; E149-R184 IonicContact OE2-NE 2.8Å; E149-R184 PolarHBondContact OE2-NE 3.3Å; E149-R184 IonicContact OE2-NH2 3.57Å; E149-R184 PolarHBondContact OE2-NH2 3.41Å
150K98.4Very high98.2Very high134 Ų13474.7 Ų74.758%0.58337%0.366SS*.Hα-helixtrans-58-45.7177.3-176.7179.1-177.2178.20111.6M146 G147M146-K150 VanDerWaalsContact O-CB 3.3Å; M146-K150 WeakPolarHBondContact O-CB 3.35Å; M146-K150 PolarHBondContact O-N 2.91Å; G147-K150 PolarHBondContact O-N 2.94Å
151K98.3Very high98.2Very high57 Ų5776.5 Ų76.525%0.24838%0.382CS..Hα-helixtrans-68.6-38.8175.9-168.478.1174.4-1710111G147 E149 Q153 K154 Q155 L158 L166 Y181G147-K151 PolarHBondContact O-N 2.95Å; G147-K151 VanDerWaalsContact O-N 3.1Å; E149-K151 PolarHBondContact O-N 2.95Å; K151-Q153 VanDerWaalsContact C-N 3.33Å; K151-Q153 PolarHBondContact O-N 3.46Å; K151-K154 PolarHBondContact O-N 2.86Å; K151-Q155 PolarHBondContact O-N 3.26Å; K151-L158 HydrophobicContact CG-CD2 4.07Å; K151-L166 HydrophobicContact CB-CD1 4.17Å; K151-L166 HydrophobicContact CB-CD2 4.12Å; K151-L166 HydrophobicContact CG-CD1 4.39Å; K151-L166 HydrophobicContact CG-CD2 4.07Å; K151-Y181 WeakPolarHBondContact CB-OH 3.4Å; K151-Y181 WeakPolarHBondContact CG-OH 3.49Å
152F98.6Very high98.2Very high1 Ų175 Ų750%0.00437%0.371CS..Hα-helixtrans-63.8-34.5178.1-176.1-99.4000113.5L148 E149 K154 Q155 K156 W180 Y181 R184 R185 W188L148-F152 VanDerWaalsContact O-CB 3.26Å; L148-F152 WeakPolarHBondContact O-CB 3.49Å; L148-F152 PolarHBondContact O-N 3.39Å; E149-F152 WeakPolarHBondContact O-CB 3.28Å; E149-F152 PolarHBondContact O-N 3.41Å; E149-F152 VanDerWaalsContact O-N 3.13Å; F152-K154 VanDerWaalsContact C-N 3.29Å; F152-K154 PolarHBondContact O-N 2.89Å; F152-Q155 WeakPolarHBondContact CA-O 3.38Å; F152-Q155 CarbonylContact O-C 3.53Å; F152-K156 HydrophobicContact CD1-CD 4.1Å; F152-K156 HydrophobicContact CD2-CD 4.39Å; F152-K156 HydrophobicContact CE1-CD 3.58Å; F152-K156 HydrophobicContact CE2-CB 4.19Å; F152-K156 HydrophobicContact CE2-CD 3.91Å; F152-K156 HydrophobicContact CG-CD 4.47Å; F152-K156 HydrophobicContact CZ-CB 4.42Å; F152-K156 HydrophobicContact CZ-CD 3.47Å; F152-K156 VanDerWaalsContact CZ-CD 3.47Å; F152-K156 VanDerWaalsContact O-CD 3.32Å; F152-K156 WeakPolarHBondContact O-CD 3.38Å; F152-K156 WeakPolarHBondContact O-CE 3.45Å; F152-K156 PolarHBondContact O-NZ 2.97Å; F152-W180 HydrophobicContact CB-CH2 4.23Å; F152-W180 HydrophobicContact CB-CZ3 4Å; F152-W180 HydrophobicContact CD2-CZ3 4.4Å; F152-W180 HydrophobicContact CG-CZ3 4.29Å; F152-Y181 HydrophobicContact CB-CE1 4.37Å; F152-Y181 AromaticContact CD2-CD1 3.87Å; F152-Y181 HydrophobicContact CD2-CD1 3.87Å; F152-Y181 AromaticContact CD2-CE1 3.65Å; F152-Y181 HydrophobicContact CD2-CE1 3.65Å; F152-Y181 HydrophobicContact CE2-CD1 4.38Å; F152-Y181 HydrophobicContact CE2-CE1 4.5Å; F152-Y181 PolarHBondContact N-OH 2.9Å; F152-R184 HydrophobicContact CD1-CG 3.63Å; F152-R184 HydrophobicContact CD2-CB 4.38Å; F152-R184 HydrophobicContact CD2-CG 3.8Å; F152-R184 HydrophobicContact CE1-CG 3.56Å; F152-R184 HydrophobicContact CE2-CB 4.21Å; F152-R184 HydrophobicContact CE2-CG 3.75Å; F152-R184 HydrophobicContact CG-CG 3.76Å; F152-R184 HydrophobicContact CZ-CB 4.4Å; F152-R184 HydrophobicContact CZ-CG 3.62Å; F152-R185 HydrophobicContact CE2-CG 3.81Å; F152-R185 HydrophobicContact CZ-CG 4.22Å; F152-W188 HydrophobicContact CE1-CB 4.35Å; F152-W188 HydrophobicContact CE1-CG 4.46Å; F152-W188 HydrophobicContact CZ-CB 4.16Å; F152-W188 HydrophobicContact CZ-CG 4.36Å
153Q98Very high98.3Very high127 Ų12770.6 Ų70.659%0.59335%0.348SS*.Hα-helixtrans-58.7-44.3175.1-76.1173.8100111.3E149 K151 K156E149-Q153 WeakPolarHBondContact O-CG 3.48Å; E149-Q153 PolarHBondContact O-N 3.26Å; K151-Q153 VanDerWaalsContact C-N 3.33Å; K151-Q153 PolarHBondContact O-N 3.46Å; Q153-K156 PolarHBondContact O-NZ 3.15Å
154K98Very high98.3Very high168 Ų16868.1 Ų68.173%0.7334%0.336SS*.Hα-helixtrans-74.3-40.8178.7-58.7-178.5179.8-168.90112.9K151 F152K151-K154 PolarHBondContact O-N 2.86Å; F152-K154 VanDerWaalsContact C-N 3.29Å; F152-K154 PolarHBondContact O-N 2.89Å
155Q98.1Very high98.3Very high55 Ų5570.5 Ų70.526%0.25735%0.349SS..  trans-141.6108.8-170.9-174.2-179.2-400110.5K151 F152 Y157 L158 D162 Y181K151-Q155 PolarHBondContact O-N 3.26Å; F152-Q155 WeakPolarHBondContact CA-O 3.38Å; F152-Q155 CarbonylContact O-C 3.53Å; Q155-Y157 VanDerWaalsContact C-N 3.28Å; Q155-Y157 WeakPolarHBondContact CG-O 3.36Å; Q155-Y157 PolarHBondContact NE2-O 3.25Å; Q155-Y157 PolarHBondContact O-N 3.04Å; Q155-L158 HydrophobicContact CB-CD2 4.41Å; Q155-L158 HydrophobicContact CG-CD2 4.11Å; Q155-D162 PolarHBondContact NE2-OD2 3.37Å; Q155-Y181 WeakPolarHBondContact O-CE1 3.37Å
156K97.8Very high98.3Very high58 Ų5868.3 Ų68.325%0.25234%0.338SS..SBendtrans-72.9-21-177.5-53.1-63.5165.7-158.10113.3F152 Q153 R185F152-K156 HydrophobicContact CD1-CD 4.1Å; F152-K156 HydrophobicContact CD2-CD 4.39Å; F152-K156 HydrophobicContact CE1-CD 3.58Å; F152-K156 HydrophobicContact CE2-CB 4.19Å; F152-K156 HydrophobicContact CE2-CD 3.91Å; F152-K156 HydrophobicContact CG-CD 4.47Å; F152-K156 HydrophobicContact CZ-CB 4.42Å; F152-K156 HydrophobicContact CZ-CD 3.47Å; F152-K156 VanDerWaalsContact CZ-CD 3.47Å; F152-K156 VanDerWaalsContact O-CD 3.32Å; F152-K156 WeakPolarHBondContact O-CD 3.38Å; F152-K156 WeakPolarHBondContact O-CE 3.45Å; F152-K156 PolarHBondContact O-NZ 2.97Å; Q153-K156 PolarHBondContact O-NZ 3.15Å; K156-R185 WeakPolarHBondContact O-CD 3.47Å
157Y98.3Very high98.3Very high142 Ų14263 Ų6356%0.55731%0.313SS*.SBendtrans-132.8116.4-176.4-64.6-108.6000109.2Q155Q155-Y157 VanDerWaalsContact C-N 3.28Å; Q155-Y157 WeakPolarHBondContact CG-O 3.36Å; Q155-Y157 PolarHBondContact NE2-O 3.25Å; Q155-Y157 PolarHBondContact O-N 3.04Å
158L98.2Very high98.3Very high20 Ų2069.3 Ų69.311%0.10534%0.337CS..  trans-87.8136.9176.4-61.5-177.1000111.6K151 Q155 D162 R163 L166 V177 Y181K151-L158 HydrophobicContact CG-CD2 4.07Å; Q155-L158 HydrophobicContact CB-CD2 4.41Å; Q155-L158 HydrophobicContact CG-CD2 4.11Å; L158-D162 HydrophobicContact CB-CB 4.22Å; L158-D162 HydrophobicContact CD2-CB 4.05Å; L158-R163 HydrophobicContact CB-CB 4.37Å; L158-R163 HydrophobicContact CD1-CB 4.41Å; L158-L166 HydrophobicContact CD1-CD2 3.69Å; L158-V177 HydrophobicContact CD1-CG1 3.96Å; L158-Y181 HydrophobicContact CD1-CD1 4.39Å; L158-Y181 HydrophobicContact CD1-CD2 3.98Å; L158-Y181 HydrophobicContact CD1-CE1 3.9Å; L158-Y181 HydrophobicContact CD1-CE2 3.44Å; L158-Y181 VanDerWaalsContact CD1-CE2 3.44Å; L158-Y181 HydrophobicContact CD1-CG 4.43Å; L158-Y181 HydrophobicContact CD2-CE1 4Å; L158-Y181 HydrophobicContact CG-CD1 4.04Å; L158-Y181 HydrophobicContact CG-CD2 4.5Å; L158-Y181 HydrophobicContact CG-CE1 3.48Å; L158-Y181 VanDerWaalsContact CG-CE1 3.48Å; L158-Y181 HydrophobicContact CG-CE2 4.02Å; L158-Y181 VanDerWaalsContact CG-CZ 3.47Å
159S98.3Very high98.3Very high50 Ų5073.3 Ų73.335%0.3537%0.365SS..  trans-67.9169.116372.70000110.5P161 D162 R163S159-P161 WeakPolarHBondContact OG-CD 3.38Å; S159-P161 WeakPolarHBondContact OG-CG 3.39Å; S159-D162 WeakPolarHBondContact CB-OD2 3.4Å; S159-D162 PolarHBondContact N-OD2 3.34Å; S159-D162 PolarHBondContact OG-N 3.01Å; S159-D162 PolarHBondContact OG-OD2 3.01Å; S159-R163 WeakPolarHBondContact O-CB 3.32Å; S159-R163 PolarHBondContact O-N 3.5Å; S159-R163 VanDerWaalsContact O-N 3.09Å
160T98.2Very high98.3Very high88 Ų8872.6 Ų72.654%0.5436%0.362SS..Hα-helixtrans-58.2-49.6174.5-54.90000112.8R163 L164T160-R163 WeakPolarHBondContact O-CB 3.48Å; T160-R163 PolarHBondContact O-N 3.39Å; T160-L164 PolarHBondContact O-N 3.05Å; T160-L164 VanDerWaalsContact O-N 3.15Å
161P98.3Very high98.3Very high86 Ų8669.4 Ų69.456%0.55837%0.368SS*.Hα-helixtrans-64.2-41.917823.3-32.9000112.9S159 R163 L164 D165S159-P161 WeakPolarHBondContact OG-CD 3.38Å; S159-P161 WeakPolarHBondContact OG-CG 3.39Å; P161-R163 PolarHBondContact O-N 3.27Å; P161-L164 WeakPolarHBondContact O-CB 3.49Å; P161-L164 PolarHBondContact O-N 3.11Å; P161-L164 VanDerWaalsContact O-N 3.08Å; P161-D165 PolarHBondContact O-N 3.31Å; P161-D165 VanDerWaalsContact O-N 3.07Å
162D98.4Very high98.3Very high44 Ų4467.6 Ų67.624%0.23536%0.361CS..Hα-helixtrans-61.3-33.8177.7-62.6-40.4000112.4Q155 L158 S159 L166Q155-D162 PolarHBondContact NE2-OD2 3.37Å; L158-D162 HydrophobicContact CB-CB 4.22Å; L158-D162 HydrophobicContact CD2-CB 4.05Å; S159-D162 WeakPolarHBondContact CB-OD2 3.4Å; S159-D162 PolarHBondContact N-OD2 3.34Å; S159-D162 PolarHBondContact OG-N 3.01Å; S159-D162 PolarHBondContact OG-OD2 3.01Å; D162-L166 WeakPolarHBondContact O-CB 3.29Å; D162-L166 PolarHBondContact O-N 3.28Å; D162-L166 VanDerWaalsContact O-N 3.09Å
163R98.6Very high98.2Very high54 Ų5471.2 Ų71.220%0.20438%0.383CS..Hα-helixtrans-69.7-38.5177.4-171.6-172.6-55.1155.410.7111.6L158 S159 T160 P161 A167 Q174 V177L158-R163 HydrophobicContact CB-CB 4.37Å; L158-R163 HydrophobicContact CD1-CB 4.41Å; S159-R163 WeakPolarHBondContact O-CB 3.32Å; S159-R163 PolarHBondContact O-N 3.5Å; S159-R163 VanDerWaalsContact O-N 3.09Å; T160-R163 WeakPolarHBondContact O-CB 3.48Å; T160-R163 PolarHBondContact O-N 3.39Å; P161-R163 PolarHBondContact O-N 3.27Å; R163-A167 WeakPolarHBondContact O-CB 3.49Å; R163-A167 PolarHBondContact O-N 3.33Å; R163-Q174 WeakPolarHBondContact CD-O 3.42Å; R163-V177 HydrophobicContact CG-CB 4.03Å; R163-V177 HydrophobicContact CG-CG1 3.82Å
164L98.6Very high98.3Very high70 Ų7069.4 Ų69.437%0.36637%0.374SS..Hα-helixtrans-61.6-51.2176.4-77.2164.6000110.4T160 P161 L166 A167 Q168 Q174T160-L164 PolarHBondContact O-N 3.05Å; T160-L164 VanDerWaalsContact O-N 3.15Å; P161-L164 WeakPolarHBondContact O-CB 3.49Å; P161-L164 PolarHBondContact O-N 3.11Å; P161-L164 VanDerWaalsContact O-N 3.08Å; L164-L166 PolarHBondContact O-N 2.89Å; L164-A167 WeakPolarHBondContact O-CB 3.47Å; L164-A167 PolarHBondContact O-N 3.04Å; L164-Q168 WeakPolarHBondContact O-CG 3.4Å; L164-Q168 PolarHBondContact O-N 3.38Å; L164-Q174 HydrophobicContact CD2-CG 3.73Å; L164-Q174 HydrophobicContact CG-CG 4.39Å
165D98.5Very high98.2Very high85 Ų8566.9 Ų66.946%0.45537%0.368SS..Hα-helixtrans-58.8-46.7179.5176.646.6000112.1P161 A167 Q168 S169P161-D165 PolarHBondContact O-N 3.31Å; P161-D165 VanDerWaalsContact O-N 3.07Å; D165-A167 VanDerWaalsContact C-N 3.34Å; D165-A167 PolarHBondContact O-N 2.97Å; D165-Q168 PolarHBondContact O-N 3.36Å; D165-S169 WeakPolarHBondContact O-CB 3.46Å; D165-S169 PolarHBondContact O-N 3.2Å; D165-S169 PolarHBondContact O-OG 2.99Å
166L98.6Very high98.2Very high14 Ų1466.5 Ų66.57%0.07337%0.366CS..Hα-helixtrans-65.5-37.5177.8-173.563.2000112.7L148 K151 L158 D162 L164 L170 V177 Y181L148-L166 HydrophobicContact CD2-CD2 3.96Å; K151-L166 HydrophobicContact CB-CD1 4.17Å; K151-L166 HydrophobicContact CB-CD2 4.12Å; K151-L166 HydrophobicContact CG-CD1 4.39Å; K151-L166 HydrophobicContact CG-CD2 4.07Å; L158-L166 HydrophobicContact CD1-CD2 3.69Å; D162-L166 WeakPolarHBondContact O-CB 3.29Å; D162-L166 PolarHBondContact O-N 3.28Å; D162-L166 VanDerWaalsContact O-N 3.09Å; L164-L166 PolarHBondContact O-N 2.89Å; L166-L170 HydrophobicContact CD1-CD1 3.73Å; L166-L170 HydrophobicContact CD1-CG 4.14Å; L166-L170 HydrophobicContact CG-CD1 4.05Å; L166-L170 WeakPolarHBondContact O-CB 3.33Å; L166-L170 WeakPolarHBondContact O-CG 3.47Å; L166-L170 PolarHBondContact O-N 3.01Å; L166-L170 VanDerWaalsContact O-N 3.16Å; L166-V177 HydrophobicContact CD2-CG1 3.95Å; L166-Y181 HydrophobicContact CD2-CE2 3.82Å
167A98.5Very high98.3Very high5 Ų563.8 Ų63.84%0.04136%0.355CS..Hα-helixtrans-64-46.4177.500000110.9R163 L164 D165 L170 G171 L172 Q174 V177R163-A167 WeakPolarHBondContact O-CB 3.49Å; R163-A167 PolarHBondContact O-N 3.33Å; L164-A167 WeakPolarHBondContact O-CB 3.47Å; L164-A167 PolarHBondContact O-N 3.04Å; D165-A167 VanDerWaalsContact C-N 3.34Å; D165-A167 PolarHBondContact O-N 2.97Å; A167-L170 PolarHBondContact O-N 3.32Å; A167-G171 PolarHBondContact O-N 3.08Å; A167-L172 CarbonylContact C-O 3.5Å; A167-L172 VanDerWaalsContact CB-O 3.32Å; A167-L172 WeakPolarHBondContact CB-O 3.16Å; A167-L172 PolarHBondContact O-N 2.93Å; A167-Q174 HydrophobicContact CB-CG 4.46Å; A167-V177 HydrophobicContact CB-CG2 3.95Å
168Q98.4Very high98.2Very high152 Ų15261.3 Ų61.371%0.7135%0.347SS*.Hα-helixtrans-61.5-48175.7-72.2176-4800111.4L164 D165 L170 G171L164-Q168 WeakPolarHBondContact O-CG 3.4Å; L164-Q168 PolarHBondContact O-N 3.38Å; D165-Q168 PolarHBondContact O-N 3.36Å; Q168-L170 VanDerWaalsContact C-N 3.26Å; Q168-L170 PolarHBondContact O-N 2.85Å; Q168-G171 PolarHBondContact O-N 2.95Å
169S98.2Very high98.2Very high84 Ų8463.1 Ų63.159%0.58736%0.359SS*.Hα-helixtrans-60-31.7-179.1-65.90000113.9D165D165-S169 WeakPolarHBondContact O-CB 3.46Å; D165-S169 PolarHBondContact O-N 3.2Å; D165-S169 PolarHBondContact O-OG 2.99Å
170L97.9Very high98.2Very high31 Ų3162.3 Ų62.316%0.16235%0.348CS..Hα-helixtrans-104.80.9-176.7-60.8-179.4000114.1Q144 L148 L166 A167 Q168 L172Q144-L170 HydrophobicContact CG-CB 4.46Å; Q144-L170 PolarHBondContact NE2-O 2.82Å; L148-L170 HydrophobicContact CD2-CD1 3.97Å; L148-L170 HydrophobicContact CG-CD1 3.73Å; L166-L170 HydrophobicContact CD1-CD1 3.73Å; L166-L170 HydrophobicContact CD1-CG 4.14Å; L166-L170 HydrophobicContact CG-CD1 4.05Å; L166-L170 WeakPolarHBondContact O-CB 3.33Å; L166-L170 WeakPolarHBondContact O-CG 3.47Å; L166-L170 PolarHBondContact O-N 3.01Å; L166-L170 VanDerWaalsContact O-N 3.16Å; A167-L170 PolarHBondContact O-N 3.32Å; Q168-L170 VanDerWaalsContact C-N 3.26Å; Q168-L170 PolarHBondContact O-N 2.85Å; L170-L172 VanDerWaalsContact C-N 3.3Å; L170-L172 HydrophobicContact CB-CD1 4.19Å; L170-L172 HydrophobicContact CB-CG 4.13Å; L170-L172 PolarHBondContact O-N 3.3Å
171G98.1Very high98.3Very high67 Ų6758.6 Ų58.669%0.69132%0.324SS*.THydrogen-bonded Turntrans62.635.5-175.200000113.1A167 Q168A167-G171 PolarHBondContact O-N 3.08Å; Q168-G171 PolarHBondContact O-N 2.95Å
172L97.9Very high98.3Very high19 Ų1958.2 Ų58.210%0.09932%0.315CS..  trans-111.7161.5179.5-65.3-179.3000110.9F140 Q144 L148 A167 L170 V177F140-L172 HydrophobicContact CD1-CD1 4.31Å; F140-L172 HydrophobicContact CD1-CD2 3.8Å; F140-L172 HydrophobicContact CE1-CD1 4.28Å; F140-L172 HydrophobicContact CE1-CD2 3.81Å; Q144-L172 HydrophobicContact CB-CD1 4.5Å; L148-L172 HydrophobicContact CD1-CD1 4.01Å; L148-L172 HydrophobicContact CD2-CD1 4.48Å; A167-L172 CarbonylContact C-O 3.5Å; A167-L172 VanDerWaalsContact CB-O 3.32Å; A167-L172 WeakPolarHBondContact CB-O 3.16Å; A167-L172 PolarHBondContact O-N 2.93Å; L170-L172 VanDerWaalsContact C-N 3.3Å; L170-L172 HydrophobicContact CB-CD1 4.19Å; L170-L172 HydrophobicContact CB-CG 4.13Å; L170-L172 PolarHBondContact O-N 3.3Å; L172-V177 HydrophobicContact CB-CG2 4.07Å; L172-V177 HydrophobicContact CD1-CG2 4.38Å
173T98.3Very high98.2Very high77 Ų7761.1 Ų61.147%0.47233%0.331SS..  trans-81.6151.5169.563.60000110.9L175 Q176 V177T173-L175 PolarHBondContact O-N 3.24Å; T173-L175 VanDerWaalsContact O-N 3.14Å; T173-Q176 WeakPolarHBondContact O-CB 3.38Å; T173-Q176 PolarHBondContact O-N 3.5Å; T173-Q176 WeakPolarHBondContact OG1-CB 3.3Å; T173-Q176 VanDerWaalsContact OG1-CD 3.28Å; T173-Q176 VanDerWaalsContact OG1-CG 3.23Å; T173-Q176 WeakPolarHBondContact OG1-CG 3.38Å; T173-Q176 PolarHBondContact OG1-N 2.89Å; T173-Q176 PolarHBondContact OG1-OE1 3.41Å; T173-V177 PolarHBondContact O-N 3.08Å; T173-V177 VanDerWaalsContact O-N 3.08Å
174Q98.2Very high98.2Very high89 Ų8961 Ų6142%0.41633%0.33SS..Hα-helixtrans-53.1-36.4173.2-66.9178.160.100112.5R163 L164 A167 V177 K178R163-Q174 WeakPolarHBondContact CD-O 3.42Å; L164-Q174 HydrophobicContact CD2-CG 3.73Å; L164-Q174 HydrophobicContact CG-CG 4.39Å; A167-Q174 HydrophobicContact CB-CG 4.46Å; Q174-V177 PolarHBondContact O-N 2.96Å; Q174-K178 VanDerWaalsContact O-CB 3.28Å; Q174-K178 WeakPolarHBondContact O-CB 3.37Å; Q174-K178 PolarHBondContact O-N 3.43Å
175L97.8Very high98.2Very high115 Ų11560.9 Ų60.960%0.60233%0.325SS*.Hα-helixtrans-65.8-43.7178179.560.3000111.4T173 K178 T179T173-L175 PolarHBondContact O-N 3.24Å; T173-L175 VanDerWaalsContact O-N 3.14Å; L175-K178 WeakPolarHBondContact O-CB 3.38Å; L175-K178 PolarHBondContact O-N 2.94Å; L175-T179 WeakPolarHBondContact O-CB 3.33Å; L175-T179 PolarHBondContact O-N 3.49Å; L175-T179 PolarHBondContact O-OG1 3.49Å
176Q97.9Very high98.2Very high46 Ų4662.4 Ų62.422%0.21533%0.331CS..Hα-helixtrans-61.4-45.4176.7-75.7164.2-42.900111.4F140 T173 K178 T179 W180F140-Q176 HydrophobicContact CE1-CB 4.12Å; F140-Q176 HydrophobicContact CE1-CG 4.26Å; F140-Q176 HydrophobicContact CZ-CB 4.1Å; F140-Q176 HydrophobicContact CZ-CG 4.37Å; T173-Q176 WeakPolarHBondContact O-CB 3.38Å; T173-Q176 PolarHBondContact O-N 3.5Å; T173-Q176 WeakPolarHBondContact OG1-CB 3.3Å; T173-Q176 VanDerWaalsContact OG1-CD 3.28Å; T173-Q176 VanDerWaalsContact OG1-CG 3.23Å; T173-Q176 WeakPolarHBondContact OG1-CG 3.38Å; T173-Q176 PolarHBondContact OG1-N 2.89Å; T173-Q176 PolarHBondContact OG1-OE1 3.41Å; Q176-K178 PolarHBondContact O-N 3.33Å; Q176-T179 PolarHBondContact O-N 3.17Å; Q176-W180 WeakPolarHBondContact O-CB 3.37Å; Q176-W180 PolarHBondContact O-N 3.46Å
177V98.4Very high98Very high1 Ų167.9 Ų67.91%0.00635%0.354CS..Hα-helixtrans-60.9-45.5175.3179.70000110.6L148 L158 R163 L166 A167 L172 T173 Q174 T179 W180 Y181L148-V177 HydrophobicContact CD2-CG1 4.28Å; L148-V177 HydrophobicContact CD2-CG2 4.4Å; L158-V177 HydrophobicContact CD1-CG1 3.96Å; R163-V177 HydrophobicContact CG-CB 4.03Å; R163-V177 HydrophobicContact CG-CG1 3.82Å; L166-V177 HydrophobicContact CD2-CG1 3.95Å; A167-V177 HydrophobicContact CB-CG2 3.95Å; L172-V177 HydrophobicContact CB-CG2 4.07Å; L172-V177 HydrophobicContact CD1-CG2 4.38Å; T173-V177 PolarHBondContact O-N 3.08Å; T173-V177 VanDerWaalsContact O-N 3.08Å; Q174-V177 PolarHBondContact O-N 2.96Å; V177-T179 PolarHBondContact O-N 3.39Å; V177-W180 PolarHBondContact O-N 2.98Å; V177-Y181 HydrophobicContact CG1-CD2 3.87Å; V177-Y181 HydrophobicContact CG1-CE2 4.06Å; V177-Y181 WeakPolarHBondContact O-CB 3.27Å; V177-Y181 WeakPolarHBondContact O-CD2 3.4Å; V177-Y181 PolarHBondContact O-N 3.4Å
178K97.9Very high97.9Very high91 Ų9172.3 Ų72.340%0.39637%0.37SS..Hα-helixtrans-57.7-49.2176.8179.9-176.1178.1-179.20111.8Q174 L175 Q176 Y181 Q182Q174-K178 VanDerWaalsContact O-CB 3.28Å; Q174-K178 WeakPolarHBondContact O-CB 3.37Å; Q174-K178 PolarHBondContact O-N 3.43Å; L175-K178 WeakPolarHBondContact O-CB 3.38Å; L175-K178 PolarHBondContact O-N 2.94Å; Q176-K178 PolarHBondContact O-N 3.33Å; K178-Y181 PolarHBondContact O-N 2.98Å; K178-Q182 WeakPolarHBondContact O-CG 3.46Å; K178-Q182 PolarHBondContact O-N 3Å
179T98.2Very high97.7Very high58 Ų5870.7 Ų70.736%0.35636%0.36SS..Hα-helixtrans-65.2-42.1179.9-63.90000111.3L175 Q176 V177 Q182 N183L175-T179 WeakPolarHBondContact O-CB 3.33Å; L175-T179 PolarHBondContact O-N 3.49Å; L175-T179 PolarHBondContact O-OG1 3.49Å; Q176-T179 PolarHBondContact O-N 3.17Å; V177-T179 PolarHBondContact O-N 3.39Å; T179-Q182 PolarHBondContact O-N 3.22Å; T179-N183 VanDerWaalsContact O-CG 3.31Å; T179-N183 PolarHBondContact O-N 3.36Å; T179-N183 PolarHBondContact O-ND2 3.36Å
180W98.3Very high97.5Very high33 Ų3373.7 Ų73.713%0.12536%0.363CS..Hα-helixtrans-61.1-46.6176.2-170.8100.3000111.2F140 L148 F152 Q176 V177 Q182 N183 R184F140-W180 AromaticContact CD2-CD1 3.89Å; F140-W180 HydrophobicContact CE2-CB 4.47Å; F140-W180 AromaticContact CE2-CD1 3.71Å; F140-W180 HydrophobicContact CE2-CG 4.47Å; L148-W180 HydrophobicContact CB-CD2 3.95Å; L148-W180 HydrophobicContact CB-CE3 3.92Å; L148-W180 HydrophobicContact CB-CH2 3.7Å; L148-W180 HydrophobicContact CB-CZ2 3.69Å; L148-W180 HydrophobicContact CB-CZ3 3.81Å; L148-W180 HydrophobicContact CD1-CB 4.46Å; L148-W180 HydrophobicContact CD1-CD2 3.84Å; L148-W180 HydrophobicContact CD1-CE3 4.48Å; L148-W180 HydrophobicContact CD1-CG 3.79Å; L148-W180 HydrophobicContact CD2-CD2 4.33Å; L148-W180 HydrophobicContact CD2-CE3 4.22Å; L148-W180 HydrophobicContact CG-CD2 4.26Å; L148-W180 HydrophobicContact CG-CE3 4.43Å; F152-W180 HydrophobicContact CB-CH2 4.23Å; F152-W180 HydrophobicContact CB-CZ3 4Å; F152-W180 HydrophobicContact CD2-CZ3 4.4Å; F152-W180 HydrophobicContact CG-CZ3 4.29Å; Q176-W180 WeakPolarHBondContact O-CB 3.37Å; Q176-W180 PolarHBondContact O-N 3.46Å; V177-W180 PolarHBondContact O-N 2.98Å; W180-Q182 VanDerWaalsContact C-N 3.33Å; W180-Q182 PolarHBondContact O-N 2.95Å; W180-N183 PolarHBondContact O-N 3.15Å; W180-R184 HydrophobicContact CD2-CB 4.44Å; W180-R184 HydrophobicContact CE3-CB 3.92Å; W180-R184 HydrophobicContact CE3-CG 4.42Å; W180-R184 HydrophobicContact CH2-CB 4.04Å; W180-R184 HydrophobicContact CH2-CG 3.67Å; W180-R184 HydrophobicContact CZ2-CG 4.39Å; W180-R184 HydrophobicContact CZ3-CB 3.69Å; W180-R184 HydrophobicContact CZ3-CG 3.69Å; W180-R184 VanDerWaalsContact O-CB 3.29Å; W180-R184 WeakPolarHBondContact O-CB 3.29Å; W180-R184 PolarHBondContact O-N 2.98Å
181Y98.6Very high97.1Very high9 Ų976.9 Ų76.94%0.03538%0.378CS..Hα-helixtrans-63.5-35.5176.9-95.8-102.3000113.1L148 K151 F152 Q155 L158 L166 V177 K178 R185L148-Y181 HydrophobicContact CD2-CE2 4.28Å; K151-Y181 WeakPolarHBondContact CB-OH 3.4Å; K151-Y181 WeakPolarHBondContact CG-OH 3.49Å; F152-Y181 HydrophobicContact CB-CE1 4.37Å; F152-Y181 AromaticContact CD2-CD1 3.87Å; F152-Y181 HydrophobicContact CD2-CD1 3.87Å; F152-Y181 AromaticContact CD2-CE1 3.65Å; F152-Y181 HydrophobicContact CD2-CE1 3.65Å; F152-Y181 HydrophobicContact CE2-CD1 4.38Å; F152-Y181 HydrophobicContact CE2-CE1 4.5Å; F152-Y181 PolarHBondContact N-OH 2.9Å; Q155-Y181 WeakPolarHBondContact O-CE1 3.37Å; L158-Y181 HydrophobicContact CD1-CD1 4.39Å; L158-Y181 HydrophobicContact CD1-CD2 3.98Å; L158-Y181 HydrophobicContact CD1-CE1 3.9Å; L158-Y181 HydrophobicContact CD1-CE2 3.44Å; L158-Y181 VanDerWaalsContact CD1-CE2 3.44Å; L158-Y181 HydrophobicContact CD1-CG 4.43Å; L158-Y181 HydrophobicContact CD2-CE1 4Å; L158-Y181 HydrophobicContact CG-CD1 4.04Å; L158-Y181 HydrophobicContact CG-CD2 4.5Å; L158-Y181 HydrophobicContact CG-CE1 3.48Å; L158-Y181 VanDerWaalsContact CG-CE1 3.48Å; L158-Y181 HydrophobicContact CG-CE2 4.02Å; L158-Y181 VanDerWaalsContact CG-CZ 3.47Å; L166-Y181 HydrophobicContact CD2-CE2 3.82Å; V177-Y181 HydrophobicContact CG1-CD2 3.87Å; V177-Y181 HydrophobicContact CG1-CE2 4.06Å; V177-Y181 WeakPolarHBondContact O-CB 3.27Å; V177-Y181 WeakPolarHBondContact O-CD2 3.4Å; V177-Y181 PolarHBondContact O-N 3.4Å; K178-Y181 PolarHBondContact O-N 2.98Å; Y181-R185 WeakPolarHBondContact O-CB 3.46Å; Y181-R185 VanDerWaalsContact O-CG 3.3Å; Y181-R185 WeakPolarHBondContact O-CG 3.3Å; Y181-R185 PolarHBondContact O-N 2.98Å; Y181-R185 PolarHBondContact O-NE 3.37Å
182Q98.5Very high96.7Very high79 Ų7977.9 Ų77.937%0.36937%0.37SS..Hα-helixtrans-62.5-52.1172.2-75.4174.71.700111K178 T179 W180 R184 R185 M186K178-Q182 WeakPolarHBondContact O-CG 3.46Å; K178-Q182 PolarHBondContact O-N 3Å; T179-Q182 PolarHBondContact O-N 3.22Å; W180-Q182 VanDerWaalsContact C-N 3.33Å; W180-Q182 PolarHBondContact O-N 2.95Å; Q182-R184 VanDerWaalsContact C-N 3.31Å; Q182-R184 PolarHBondContact O-N 2.86Å; Q182-R185 PolarHBondContact O-N 3.14Å; Q182-M186 WeakPolarHBondContact O-CG 3.41Å; Q182-M186 PolarHBondContact O-N 3.27Å
183N97.9Very high95.9Very high105 Ų10584.1 Ų84.156%0.56140%0.403SS*.Hα-helixtrans-60.7-42.1178.8-68.7-19.9000111.7T179 W180 M186 K187T179-N183 VanDerWaalsContact O-CG 3.31Å; T179-N183 PolarHBondContact O-N 3.36Å; T179-N183 PolarHBondContact O-ND2 3.36Å; W180-N183 PolarHBondContact O-N 3.15Å; N183-M186 PolarHBondContact O-N 3.04Å; N183-K187 PolarHBondContact O-N 3.38Å
184R98.1Very high95Very high50 Ų5088.6 Ų88.619%0.18942%0.416CS..Hα-helixtrans-63.6-44.4179.9-171.866.3-176.9119.9-6.6111.8E149 F152 W180 Q182 M186 K187 W188E149-R184 VanDerWaalsContact CD-NH2 3.34Å; E149-R184 IonicContact OE1-CZ 3.35Å; E149-R184 IonicContact OE1-NE 2.71Å; E149-R184 PolarHBondContact OE1-NE 3.34Å; E149-R184 IonicContact OE1-NH2 3.35Å; E149-R184 PolarHBondContact OE1-NH2 2.97Å; E149-R184 IonicContact OE2-CZ 3.29Å; E149-R184 IonicContact OE2-NE 2.8Å; E149-R184 PolarHBondContact OE2-NE 3.3Å; E149-R184 IonicContact OE2-NH2 3.57Å; E149-R184 PolarHBondContact OE2-NH2 3.41Å; F152-R184 HydrophobicContact CD1-CG 3.63Å; F152-R184 HydrophobicContact CD2-CB 4.38Å; F152-R184 HydrophobicContact CD2-CG 3.8Å; F152-R184 HydrophobicContact CE1-CG 3.56Å; F152-R184 HydrophobicContact CE2-CB 4.21Å; F152-R184 HydrophobicContact CE2-CG 3.75Å; F152-R184 HydrophobicContact CG-CG 3.76Å; F152-R184 HydrophobicContact CZ-CB 4.4Å; F152-R184 HydrophobicContact CZ-CG 3.62Å; W180-R184 HydrophobicContact CD2-CB 4.44Å; W180-R184 HydrophobicContact CE3-CB 3.92Å; W180-R184 HydrophobicContact CE3-CG 4.42Å; W180-R184 HydrophobicContact CH2-CB 4.04Å; W180-R184 HydrophobicContact CH2-CG 3.67Å; W180-R184 HydrophobicContact CZ2-CG 4.39Å; W180-R184 HydrophobicContact CZ3-CB 3.69Å; W180-R184 HydrophobicContact CZ3-CG 3.69Å; W180-R184 VanDerWaalsContact O-CB 3.29Å; W180-R184 WeakPolarHBondContact O-CB 3.29Å; W180-R184 PolarHBondContact O-N 2.98Å; Q182-R184 VanDerWaalsContact C-N 3.31Å; Q182-R184 PolarHBondContact O-N 2.86Å; R184-M186 PolarHBondContact O-N 3Å; R184-K187 PolarHBondContact O-N 3.12Å; R184-W188 WeakPolarHBondContact O-CB 3.42Å; R184-W188 PolarHBondContact O-N 3.32Å
185R98.1Very high93.2Very high68 Ų6887.2 Ų87.226%0.25743%0.426SS..Hα-helixtrans-63.3-38.6174.7-75.1-177.4-63.6174.56.7112.6F152 K156 Y181 Q182 W188 K189F152-R185 HydrophobicContact CE2-CG 3.81Å; F152-R185 HydrophobicContact CZ-CG 4.22Å; K156-R185 WeakPolarHBondContact O-CD 3.47Å; Y181-R185 WeakPolarHBondContact O-CB 3.46Å; Y181-R185 VanDerWaalsContact O-CG 3.3Å; Y181-R185 WeakPolarHBondContact O-CG 3.3Å; Y181-R185 PolarHBondContact O-N 2.98Å; Y181-R185 PolarHBondContact O-NE 3.37Å; Q182-R185 PolarHBondContact O-N 3.14Å; R185-W188 PolarHBondContact O-N 3.17Å; R185-K189 WeakPolarHBondContact O-CB 3.41Å; R185-K189 PolarHBondContact O-N 2.84Å
186M97.7Very high91.4Very high118 Ų11885.3 Ų85.358%0.58143%0.434SS*.Hα-helixtrans-63-44.5175.7-67.3-57.7176.800111.6Q182 N183 R184 K190Q182-M186 WeakPolarHBondContact O-CG 3.41Å; Q182-M186 PolarHBondContact O-N 3.27Å; N183-M186 PolarHBondContact O-N 3.04Å; R184-M186 PolarHBondContact O-N 3Å; M186-K190 WeakPolarHBondContact O-CB 3.28Å; M186-K190 PolarHBondContact O-N 3.46Å
187K95.9Very high89.1Confident128 Ų12891.1 Ų91.156%0.55746%0.461SS*.Hα-helixtrans-61.9-47.6174.4-175.3177.7177.5-175.90111.1N183 R184 K190 M191N183-K187 PolarHBondContact O-N 3.38Å; R184-K187 PolarHBondContact O-N 3.12Å; K187-K190 PolarHBondContact O-N 2.92Å; K187-M191 WeakPolarHBondContact O-CG 3.39Å; K187-M191 PolarHBondContact O-N 3.06Å
188W95.5Very high86.7Confident99 Ų9999 Ų9938%0.37550%0.497SS..Hα-helixtrans-58.6-49.6178.417564.7000111.8F152 R184 R185 K190 M191 V192F152-W188 HydrophobicContact CE1-CB 4.35Å; F152-W188 HydrophobicContact CE1-CG 4.46Å; F152-W188 HydrophobicContact CZ-CB 4.16Å; F152-W188 HydrophobicContact CZ-CG 4.36Å; R184-W188 WeakPolarHBondContact O-CB 3.42Å; R184-W188 PolarHBondContact O-N 3.32Å; R185-W188 PolarHBondContact O-N 3.17Å; W188-K190 VanDerWaalsContact C-N 3.3Å; W188-K190 PolarHBondContact O-N 3.48Å; W188-M191 PolarHBondContact O-N 3Å; W188-V192 HydrophobicContact CD2-CG2 4.28Å; W188-V192 HydrophobicContact CG-CG2 4.38Å; W188-V192 HydrophobicContact CZ2-CG2 4.18Å; W188-V192 WeakPolarHBondContact O-CG2 3.32Å; W188-V192 PolarHBondContact O-N 3.33Å
189K95.2Very high84.2Confident117 Ų11798.8 Ų98.851%0.50951%0.513SS..Hα-helixtrans-55.4-45.5174.8-175.5179.766.3169.70111.3R185 M191 V192 L193R185-K189 WeakPolarHBondContact O-CB 3.41Å; R185-K189 PolarHBondContact O-N 2.84Å; K189-M191 VanDerWaalsContact C-N 3.29Å; K189-M191 PolarHBondContact O-N 2.98Å; K189-V192 PolarHBondContact O-N 3.23Å; K189-L193 VanDerWaalsContact O-CB 3.3Å; K189-L193 WeakPolarHBondContact O-CB 3.41Å; K189-L193 PolarHBondContact O-N 2.72Å
190K92.9Very high82.3Confident148 Ų148102.2 Ų102.264%0.64354%0.536SS*.Hα-helixtrans-61.6-36.3177.6-174.2176.8179.31780112.4M186 K187 W188 K194M186-K190 WeakPolarHBondContact O-CB 3.28Å; M186-K190 PolarHBondContact O-N 3.46Å; K187-K190 PolarHBondContact O-N 2.92Å; W188-K190 VanDerWaalsContact C-N 3.3Å; W188-K190 PolarHBondContact O-N 3.48Å; K190-K194 VanDerWaalsContact O-CB 3.27Å; K190-K194 WeakPolarHBondContact O-CB 3.48Å; K190-K194 PolarHBondContact O-N 3.38Å
191M90.3Very high80.2Confident98 Ų98106.7 Ų106.748%0.48357%0.567SS.*Hα-helixtrans-74.1-39.5177.4-65.7-163.580.600112.2K187 W188 K189K187-M191 WeakPolarHBondContact O-CG 3.39Å; K187-M191 PolarHBondContact O-N 3.06Å; W188-M191 PolarHBondContact O-N 3Å; K189-M191 VanDerWaalsContact C-N 3.29Å; K189-M191 PolarHBondContact O-N 2.98Å
192V88.3Confident77.5Confident87 Ų87115.9 Ų115.953%0.52761%0.608SS.*Hα-helixtrans-68.5-45.5178.4175.10000111.3W188 K189 K194 G195W188-V192 HydrophobicContact CD2-CG2 4.28Å; W188-V192 HydrophobicContact CG-CG2 4.38Å; W188-V192 HydrophobicContact CZ2-CG2 4.18Å; W188-V192 WeakPolarHBondContact O-CG2 3.32Å; W188-V192 PolarHBondContact O-N 3.33Å; K189-V192 PolarHBondContact O-N 3.23Å; V192-K194 PolarHBondContact O-N 3.12Å; V192-G195 PolarHBondContact O-N 3.04Å
193L83.1Confident75.3Confident151 Ų151118.1 Ų118.179%0.79163%0.629SS**Hα-helixtrans-70.9-15.8-176.3-139.372.6000113.6K189K189-L193 VanDerWaalsContact O-CB 3.3Å; K189-L193 WeakPolarHBondContact O-CB 3.41Å; K189-L193 PolarHBondContact O-N 2.72Å
194K77.9Confident72.8Confident170 Ų170123 Ų12374%0.73965%0.645SS**THydrogen-bonded Turntrans-102.414.1-176.5-142172.2-178.8-163.80113.2K190 V192K190-K194 VanDerWaalsContact O-CB 3.27Å; K190-K194 WeakPolarHBondContact O-CB 3.48Å; K190-K194 PolarHBondContact O-N 3.38Å; V192-K194 PolarHBondContact O-N 3.12Å
195G60.6Low70.2Confident61 Ų61123.9 Ų123.963%0.62967%0.67SS**THydrogen-bonded Turntrans64.769.8169.900000113.5V192 Q197V192-G195 PolarHBondContact O-N 3.04Å; G195-Q197 PolarHBondContact O-N 2.82Å
196G60.7Low67.9Low74 Ų74132.1 Ų132.176%0.76370%0.701SS**SBendtrans35.654.6148.300000119.1
197Q50.2Low65.7Low168 Ų168132.6 Ų132.679%0.78571%0.712SS**  trans-140.4121.7149.7-80-156-4.500107.7G195G195-Q197 PolarHBondContact O-N 2.82Å
198E47.9Very low63.3Low166 Ų166135.7 Ų135.778%0.77673%0.726SS**  trans-170.198.3140-69.5-41.8153.800105.7
199A45.5Very low60.9Low88 Ų88140.6 Ų140.673%0.72775%0.75SS**  trans-66.5138.1168.300000109.6T201A199-T201 PolarHBondContact O-N 3.2Å
200P57.8Low58.9Low130 Ų130141.4 Ų141.484%0.84476%0.76SS**SBendtrans-8281.1-174.332.2-35.4000112
201T53.1Low57Low126 Ų126139.7 Ų139.777%0.77377%0.767SS**  trans-143.2121.2158.153.10000112.6A199A199-T201 PolarHBondContact O-N 3.2Å
202K42.4Very low55.2Low203 Ų203142.7 Ų142.788%0.88378%0.783SS**  trans86.4137.9160.3-110.8152.1178.8173.80119.6K204K202-K204 PolarHBondContact O-N 3.5Å
203P52.1Low53.5Low126 Ų126142.1 Ų142.182%0.81878%0.781SS**  trans-81.1112.8-179.732.5-27.7000109.2
204K44.8Very low52.5Low208 Ų208139.3 Ų139.390%0.90477%0.77SS**  trans-110.2123.3167.4-15077.9171.2-172.90108.9K202K202-K204 PolarHBondContact O-N 3.5Å
205G45.2Very low51.7Low68 Ų68135.6 Ų135.670%0.70177%0.766SS**  trans-64.5165.1-171.800000114.6
206R48.3Very low51.6Low241 Ų241139.9 Ų139.991%0.90977%0.769SS**  trans3.4115.2153.3-166.1178.9-171.3-166.32.8115.3K208R206-K208 PolarHBondContact O-N 3.41Å
207P51.6Low51.6Low127 Ų127142.2 Ų142.283%0.82576%0.76SS**  trans-64.1127174.722.6-27.7000110.8
208K46.1Very low52.1Low194 Ų194138.9 Ų138.984%0.84375%0.747SS**  trans-75.1133.1166.8-113.7174.6174.4179.90108.2R206 N210R206-K208 PolarHBondContact O-N 3.41Å; K208-N210 PolarHBondContact O-N 2.94Å
209K45.2Very low52.9Low202 Ų202138 Ų13888%0.87874%0.743SS**SBendtrans-84.171-17447.6166.1-176.3179.20111.6
210N53.3Low53.8Low133 Ų133136.6 Ų136.671%0.71173%0.731SS**  trans-168.983.2169.610.211000109.6K208K208-N210 PolarHBondContact O-N 2.94Å
211S51.8Low54.1Low113 Ų113137.5 Ų137.579%0.7972%0.724SS**  trans-159.868.4156.7-169.40000106.8
212I53.4Low54.7Low161 Ų161137.8 Ų137.883%0.82672%0.716SS**  trans-105.6111.6156.5-59.4175.4000102.5T214I212-T214 PolarHBondContact O-N 2.99Å
213P52.4Low55.7Low74 Ų74135.8 Ų135.848%0.48171%0.708SS.*  trans-57.9132.6173.3-19.831.9000108.7
214T63.1Low56Low92 Ų92136.5 Ų136.556%0.56470%0.702SS**  trans-63.9142.8177.7-23.70000108.3I212 E216 E217I212-T214 PolarHBondContact O-N 2.99Å; T214-E216 PolarHBondContact O-N 2.8Å; T214-E217 WeakPolarHBondContact O-CB 3.32Å; T214-E217 PolarHBondContact O-N 3.25Å
215S59.3Low56.8Low93 Ų93131.6 Ų131.665%0.6569%0.685SS**Hα-helixtrans-54.5-23.8-175.447.30000114.7
216E60.3Low57.5Low151 Ų151132 Ų13271%0.70668%0.678SS**Hα-helixtrans-70.6-26.2175.9-71.5179.8136.200113.8T214 A220T214-E216 PolarHBondContact O-N 2.8Å; E216-A220 PolarHBondContact O-N 3.31Å
217E60.1Low58Low122 Ų122127.7 Ų127.757%0.5767%0.668SS**Hα-helixtrans-77.7-32-177.7-144.2168.5179.300111.1T214 A220 E221T214-E217 WeakPolarHBondContact O-CB 3.32Å; T214-E217 PolarHBondContact O-N 3.25Å; E217-A220 PolarHBondContact O-N 3.07Å; E217-E221 PolarHBondContact O-N 3.43Å
218I60.2Low58.3Low98 Ų98125.3 Ų125.350%0.50366%0.659SS.*Hα-helixtrans-69.1-39.1177.4-49.1172.1000110.4A220 E221 E222I218-A220 VanDerWaalsContact C-N 3.35Å; I218-E221 PolarHBondContact O-N 3.14Å; I218-E222 PolarHBondContact O-N 3.33Å
219E64.4Low58.7Low149 Ų149123.6 Ų123.670%0.69665%0.654SS**Hα-helixtrans-72.4-29.9178.8-134174.2-171.100112K223E219-K223 PolarHBondContact O-N 3.42Å
220A64.3Low58.9Low57 Ų57117.4 Ų117.447%0.47165%0.648SS.*Hα-helixtrans-71.1-38.417500000112.7E216 E217 I218 M224E216-A220 PolarHBondContact O-N 3.31Å; E217-A220 PolarHBondContact O-N 3.07Å; I218-A220 VanDerWaalsContact C-N 3.35Å; A220-M224 WeakPolarHBondContact O-CG 3.46Å; A220-M224 PolarHBondContact O-N 2.79Å
221E64.8Low58.7Low149 Ų149119.7 Ų119.770%0.69665%0.654SS**Hα-helixtrans-68.6-38.7175.2-88.5-179.4118.800112.6E217 I218 K223 M224 N225E217-E221 PolarHBondContact O-N 3.43Å; I218-E221 PolarHBondContact O-N 3.14Å; E221-K223 VanDerWaalsContact C-N 3.31Å; E221-K223 PolarHBondContact O-N 3.3Å; E221-M224 PolarHBondContact O-N 3.23Å; E221-N225 PolarHBondContact O-N 3.29Å; E221-N225 VanDerWaalsContact O-N 3.14Å
222E65.4Low58.5Low132 Ų132123.6 Ų123.662%0.61766%0.66SS**Hα-helixtrans-66.4-34.7179-165.2175.3141.300112.1I218 N225 S226I218-E222 PolarHBondContact O-N 3.33Å; E222-N225 PolarHBondContact O-N 3.46Å; E222-S226 PolarHBondContact O-N 2.99Å; E222-S226 VanDerWaalsContact O-N 3.07Å; E222-S226 PolarHBondContact O-OG 3.34Å
223K63.7Low58.2Low162 Ų162127 Ų12770%0.70466%0.662SS**Hα-helixtrans-70.4-34.2177.1-163.1173.7-179.6-170.70112.9E219 E221E219-K223 PolarHBondContact O-N 3.42Å; E221-K223 VanDerWaalsContact C-N 3.31Å; E221-K223 PolarHBondContact O-N 3.3Å
224M58.3Low57.8Low140 Ų140131.3 Ų131.369%0.6968%0.681SS**Hα-helixtrans-71.6-35174.7-67-128.172.800112.3A220 E221A220-M224 WeakPolarHBondContact O-CG 3.46Å; A220-M224 PolarHBondContact O-N 2.79Å; E221-M224 PolarHBondContact O-N 3.23Å
225N61.4Low56.4Low105 Ų105135.6 Ų135.656%0.56169%0.694SS**Hα-helixtrans-71.4-37.9178.3-166.47.5000112.3E221 E222 Q227 A228E221-N225 PolarHBondContact O-N 3.29Å; E221-N225 VanDerWaalsContact O-N 3.14Å; E222-N225 PolarHBondContact O-N 3.46Å; N225-Q227 VanDerWaalsContact C-N 3.25Å; N225-Q227 PolarHBondContact O-N 2.91Å; N225-A228 PolarHBondContact O-N 3.01Å
226S60Low55.7Low77 Ų77136.6 Ų136.654%0.53870%0.699SS.*Hα-helixtrans-65.3-27177.6-560000113.3E222E222-S226 PolarHBondContact O-N 2.99Å; E222-S226 VanDerWaalsContact O-N 3.07Å; E222-S226 PolarHBondContact O-OG 3.34Å
227Q58.7Low54.3Low150 Ų150134.5 Ų134.570%0.70170%0.7SS**Hα-helixtrans-80.1-20.9179.6-162.9169.7-4.100112.8N225N225-Q227 VanDerWaalsContact C-N 3.25Å; N225-Q227 PolarHBondContact O-N 2.91Å
228A57.9Low53.2Low77 Ų77137.6 Ų137.664%0.63672%0.715SS**Hα-helixtrans-81.5-21.817900000113.8N225N225-A228 PolarHBondContact O-N 3.01Å
229Q54.2Low52Low158 Ų158136.3 Ų136.374%0.73873%0.726SS**G310 helixtrans-87.7-5.4-178-70.6-174.4-10.700114.6Q231Q229-Q231 PolarHBondContact O-N 3.33Å
230G49Very low50.5Low73 Ų73138.3 Ų138.375%0.75374%0.735SS**G310 helixtrans-82.7-0.5-177.600000116
231Q50.4Low49.5Very low181 Ų181143.4 Ų143.485%0.84675%0.75SS**G310 helixtrans-116.94.1-168.2-133.1174.4-3300116.1Q229Q229-Q231 PolarHBondContact O-N 3.33Å
232E47.3Very low48.3Very low194 Ų194144.1 Ų144.191%0.90775%0.753SS**  trans-11377.1171-102.7-165.597.700111.3
233R47.4Very low46.6Very low232 Ų232145.2 Ų145.288%0.87576%0.762SS**  trans-156.485155.4-167.3173.5-160.4-156.72.4111.6
234L44.2Very low45.1Very low166 Ų166142.6 Ų142.687%0.86976%0.763SS**  trans-159.2113.9149.4-75.4-175.4000108.7
235E33.8Very low43.9Very low181 Ų181144.7 Ų144.785%0.84677%0.771SS**  trans-164.7126.9144.9-91.8-52.487.900109.1
236P43.2Very low42.7Very low115 Ų115143.7 Ų143.775%0.74778%0.777SS**  trans-120.3135.8163.335.5-21.5000112.3
237S31.5Very low41.5Very low106 Ų106149 Ų14974%0.74179%0.793SS**  trans-160.2110.9159.9-162.90000108.6
238Q36.7Very low40.5Very low187 Ų187149.8 Ų149.887%0.87480%0.797SS**  41.4110.787-65.1-173.6-31.500110.6
239G34.8Very low40.1Very low72 Ų72150.6 Ų150.674%0.74280%0.796SS**  cis99.495.643.600000107.7
240Q34.5Very low39.1Very low190 Ų190151.1 Ų151.189%0.88880%0.796SS**  trans-160.5136.8162.4-114.5170.14.600112.2
241E43.3Very low38.3Very low165 Ų165153.1 Ų153.177%0.77179%0.794SS**  trans-87.5171.2-174.555.8-128.187.600114.5
242E38.3Very low37.7Very low163 Ų163152.6 Ų152.676%0.76279%0.791SS**  trans70.5113.9155.6-86.1-115.8101.900120.7
243L30.3Very low37.1Very low156 Ų156150.2 Ų150.282%0.81779%0.785SS**  -175.9128100.3-167.675.3000111.2
244C32.7Very low36.8Very low107 Ų107144.8 Ų144.872%0.72378%0.777SS**  trans-87.6150.9173.1-74.10000112.8
245E32.2Very low37.1Very low183 Ų183142.7 Ų142.786%0.85577%0.773SS**  trans-163.7105.5136.9-118.9179.398.900109.2
246A37Very low37.8Very low84 Ų84141.9 Ų141.969%0.69477%0.774SS**  64127.1110.500000113.9
247Q33.5Very low37.8Very low188 Ų188145.7 Ų145.788%0.87978%0.781SS**  cis-171.4137.238.9-167.4143.1-30.500110.5
248E38.7Very low38.5Very low167 Ų167148.4 Ų148.478%0.7879%0.785SS**  trans-76.2179.8162.9-111.1-113110.200110.2
249P48.5Very low38.9Very low94 Ų94144.4 Ų144.461%0.6178%0.783SS**  cis-146.1-179.28.133-8.3000118
250K33.6Very low39.2Very low169 Ų169149.1 Ų149.174%0.73579%0.786SS**  trans99.6107.5131.6-103.1176.9167.8168.80123.1
251T32.8Very low40.3Very low115 Ų115145 Ų14571%0.70678%0.776SS**  49.7123.6120.564.70000121.2
252H36.8Very low40.8Very low171 Ų171142.8 Ų142.879%0.79278%0.775SS**  175.7127.7100.978.3-65.3000107.2
253D35.3Very low41.3Very low144 Ų144142.2 Ų142.277%0.7778%0.778SS**  72.413386.1-132.4-56.2000114.6
254V41.3Very low42.9Very low117 Ų117139.7 Ų139.771%0.70977%0.771SS**  trans-75.7160.3-164.4-163.10000110.2
255P51.3Low44Very low123 Ų123140.8 Ų140.880%0.79978%0.776SS**  -150.6141.497.427-4.6000117.5
256L48Very low44.8Very low164 Ų164140.6 Ų140.686%0.85978%0.775SS**  trans1.2125.4140.4-13981.8000119
257E42Very low45.2Very low194 Ų194145.6 Ų145.691%0.90779%0.785SS**  trans-151.6141.2144.2-154.7-175.5127.200112
258M46.3Very low46.1Very low164 Ų164143.3 Ų143.381%0.80878%0.778SS**  trans-67148.8-175.2-68175.356.900115
259A45.6Very low46.8Very low102 Ų102141.1 Ų141.184%0.84378%0.778SS**  trans-155.9115.7145.700000111.6
260E42Very low46.9Very low172 Ų172144.2 Ų144.280%0.80479%0.788SS**  trans-65.4176.1153.6-136.4-176.987.300109.9
261P56.5Low47.7Very low103 Ų103141.4 Ų141.467%0.66979%0.787SS**  cis-136.6-152.8-1.144-22.3000111.3
262P54Low48.4Very low118 Ų118141.5 Ų141.577%0.76679%0.792SS**  cis-133.7172.4-637.8-16.6000117.5
263D48.9Very low49.2Very low151 Ų151141.5 Ų141.581%0.80780%0.797SS**  trans-39.3146.5170.1-111.5-53.9000117.7
264P63.1Low50.7Low104 Ų104142.8 Ų142.868%0.67580%0.799SS**PPolyproline II helixtrans-91.6136.8155.833.2-27.1000112
265P56.6Low52.1Low129 Ų129142.4 Ų142.484%0.83880%0.798SS**PPolyproline II helixtrans-71.1137.7178.927.6-31.3000112.1
266Q48.9Very low53Low179 Ų179142.1 Ų142.184%0.83680%0.797SS**PPolyproline II helixtrans-66.5130.3166-57-171.47.100110
267E46.6Very low53.7Low190 Ų190140 Ų14089%0.88879%0.793SS**  trans-111.1127.4158.3-107.9-163.6128.200110.2
268L52.3Low54.3Low140 Ų140139.3 Ų139.373%0.73379%0.794SS**PPolyproline II helixtrans-79.7165.7-176-73.3173.5000111.9
269P53.4Low55.3Low121 Ų121140.7 Ų140.779%0.78682%0.82SS**PPolyproline II helixtrans-83.3130.9-169.931-27.2000111.8
270I49Very low55.8Low158 Ų158142.6 Ų142.681%0.8182%0.819SS**PPolyproline II helixtrans-90136.6175.3-63.4-177.5000109.6
271P51.1Low56.5Low111 Ų111141.1 Ų141.172%0.72182%0.819SS**PPolyproline II helixtrans-85.9155.9-153.733.5-36.3000115.4L273P271-L273 PolarHBondContact O-N 3.07Å
272S46.5Very low56.5Low117 Ų117143.2 Ų143.282%0.81883%0.828SS**PPolyproline II helixtrans-55.1120.5168.2-169.70000111.7
273L54.7Low56.7Low171 Ų171144.6 Ų144.690%0.89583%0.831SS**  trans-92.2102.3169.4-106.9144.2000108.5P271P271-L273 PolarHBondContact O-N 3.07Å
274E65.8Low57.1Low171 Ų171144.3 Ų144.380%0.79983%0.833SS**PPolyproline II helixtrans-89.4134.1168.7-168.5177158.400109.1
275P71.1Confident56.8Low108 Ų108146.9 Ų146.970%0.70184%0.843SS**PPolyproline II helixtrans-83.7145.6175.731.4-32000112.4
276P71.6Confident56.8Low118 Ų118148.2 Ų148.277%0.76684%0.844SS**PPolyproline II helixtrans-76.7162.8-174.831.7-35.6000113.8
277P61.6Low57.4Low120 Ų120145.8 Ų145.878%0.77984%0.844SS**PPolyproline II helixtrans-77.8149.1-171.131.6-34.8000113.5
278L54.1Low58.3Low179 Ų179142.2 Ų142.294%0.93784%0.841SS**PPolyproline II helixtrans-62.2130.6168.6-72.8155000110.2
279S68Low58.8Low192 Ų192142.4 Ų142.4100%1.34385%0.851SS**  trans-105.50158-640000109.2

Retrieved 279 of 279 residues in 98.9 ms (Link to these results)