A0A087WRR2_MOUSE Loading...

Keratinocyte differentiation associated protein

AlphaFold DB , UniProt , Accession A0A087WRR2, Species MOUSE (Mus musculus, Mouse), Gene Krtdap, Length 88 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
1M48.7Very low66.8Low240 Ų240120.7 Ų120.7100%1.18265%0.647SS**  0120.30-71.3165.3140.400107.8I3M1-I3 PolarHBondContact O-N 3.08Å
2K55.9Low67.3Low213 Ų213119.6 Ų119.693%0.92664%0.64SS**  trans-81.6106.2179.1-84.9166.3168.3173.50108
3I62.4Low67.9Low129 Ų129116 Ų11666%0.66263%0.63SS**  trans-70.3125174.5-56.9169.5000106.7M1 I5 V8M1-I3 PolarHBondContact O-N 3.08Å; I3-I5 PolarHBondContact O-N 3.05Å; I3-V8 HydrophobicContact CG2-CG2 3.83Å
4P62.6Low68.2Low84 Ų84115.1 Ų115.155%0.54562%0.624SS.*  trans-61.9121.4175.823.9-30.5000108.5L6 P7P4-L6 PolarHBondContact O-N 3.31Å; P4-P7 HydrophobicContact CB-CG 3.93Å; P4-P7 HydrophobicContact CG-CG 3.63Å; P4-P7 WeakPolarHBondContact O-CD 3.17Å; P4-P7 WeakPolarHBondContact O-CG 3.35Å
5I68.4Low68.6Low136 Ų136115.4 Ų115.470%0.69762%0.624SS**Hα-helixtrans-66.7-29.5-175-63.4163000110.7I3 V8 V9I3-I5 PolarHBondContact O-N 3.05Å; I5-V8 PolarHBondContact O-N 3.16Å; I5-V9 HydrophobicContact CG2-CG2 4.1Å; I5-V9 WeakPolarHBondContact O-CG2 3.22Å; I5-V9 PolarHBondContact O-N 2.89Å
6L63.8Low68.7Low147 Ų147112.3 Ų112.377%0.7762%0.618SS**Hα-helixtrans-59.5-51.1-176.6-159.668.9000114.1P4 V8 V9 A10P4-L6 PolarHBondContact O-N 3.31Å; L6-V8 VanDerWaalsContact C-N 3.3Å; L6-V8 PolarHBondContact O-N 3.42Å; L6-V9 PolarHBondContact O-N 2.61Å; L6-A10 PolarHBondContact O-N 3.48Å
7P71.8Confident68.5Low60 Ų60109.9 Ų109.939%0.3961%0.605SS.*Hα-helixtrans-65.8-31175.521.9-32.8000113.2P4 A10 L11P4-P7 HydrophobicContact CB-CG 3.93Å; P4-P7 HydrophobicContact CG-CG 3.63Å; P4-P7 WeakPolarHBondContact O-CD 3.17Å; P4-P7 WeakPolarHBondContact O-CG 3.35Å; P7-A10 PolarHBondContact O-N 3.18Å; P7-L11 WeakPolarHBondContact O-CB 3.45Å; P7-L11 WeakPolarHBondContact O-CG 3.15Å; P7-L11 PolarHBondContact O-N 3.22Å
8V75.7Confident68Low67 Ų67110.8 Ų110.841%0.40660%0.603SS.*Hα-helixtrans-65-43.6177.4-1800000110.7I3 I5 L6 L11 L12I3-V8 HydrophobicContact CG2-CG2 3.83Å; I5-V8 PolarHBondContact O-N 3.16Å; L6-V8 VanDerWaalsContact C-N 3.3Å; L6-V8 PolarHBondContact O-N 3.42Å; V8-L11 PolarHBondContact O-N 3.13Å; V8-L12 HydrophobicContact CG1-CD1 4.23Å; V8-L12 PolarHBondContact O-N 2.86Å
9V76.1Confident67.6Low79 Ų79108.9 Ų108.948%0.47960%0.604SS.*Hα-helixtrans-65.3-42.4175.7176.60000111I5 L6 L11 L12 S13I5-V9 HydrophobicContact CG2-CG2 4.1Å; I5-V9 WeakPolarHBondContact O-CG2 3.22Å; I5-V9 PolarHBondContact O-N 2.89Å; L6-V9 PolarHBondContact O-N 2.61Å; V9-L11 VanDerWaalsContact C-N 3.34Å; V9-L11 PolarHBondContact O-N 3.06Å; V9-L12 PolarHBondContact O-N 3.25Å; V9-S13 PolarHBondContact O-N 3.5Å; V9-S13 PolarHBondContact O-OG 3.04Å
10A74.5Confident67.1Low52 Ų52108.2 Ų108.243%0.4360%0.602SS.*Hα-helixtrans-61.5-41.4177.400000112.6L6 P7 S13 L14L6-A10 PolarHBondContact O-N 3.48Å; P7-A10 PolarHBondContact O-N 3.18Å; A10-S13 PolarHBondContact O-N 3.5Å; A10-L14 PolarHBondContact O-N 3.4Å
11L74.9Confident66.6Low121 Ų121109.8 Ų109.863%0.63461%0.606SS**Hα-helixtrans-66.8-39.8177-70.9170.5000112.1P7 V8 V9 L14 L15P7-L11 WeakPolarHBondContact O-CB 3.45Å; P7-L11 WeakPolarHBondContact O-CG 3.15Å; P7-L11 PolarHBondContact O-N 3.22Å; V8-L11 PolarHBondContact O-N 3.13Å; V9-L11 VanDerWaalsContact C-N 3.34Å; V9-L11 PolarHBondContact O-N 3.06Å; L11-L14 PolarHBondContact O-N 3.46Å; L11-L15 VanDerWaalsContact O-CB 3.32Å; L11-L15 WeakPolarHBondContact O-CB 3.29Å; L11-L15 PolarHBondContact O-N 3.24Å
12L73Confident66.9Low107 Ų107101.8 Ų101.856%0.5659%0.585SS**Hα-helixtrans-63.9-40.3174.2-85.3161.4000112.1V8 V9 L15 A16V8-L12 HydrophobicContact CG1-CD1 4.23Å; V8-L12 PolarHBondContact O-N 2.86Å; V9-L12 PolarHBondContact O-N 3.25Å; L12-L15 PolarHBondContact O-N 3.39Å; L12-A16 WeakPolarHBondContact O-CB 3.34Å; L12-A16 PolarHBondContact O-N 2.93Å
13S74.9Confident66.6Low73 Ų7396.2 Ų96.251%0.5158%0.578SS.*Hα-helixtrans-64.7-43.2175.1-63.30000112.4V9 A10 A16 L17V9-S13 PolarHBondContact O-N 3.5Å; V9-S13 PolarHBondContact O-OG 3.04Å; A10-S13 PolarHBondContact O-N 3.5Å; S13-A16 PolarHBondContact O-N 2.89Å; S13-L17 WeakPolarHBondContact O-CB 3.43Å; S13-L17 PolarHBondContact O-N 3.34Å
14L72.6Confident66.2Low104 Ų10494.7 Ų94.755%0.54559%0.585SS.*Hα-helixtrans-62.9-42.2174.7-109.686000111.8A10 L11 L17 H18A10-L14 PolarHBondContact O-N 3.4Å; L11-L14 PolarHBondContact O-N 3.46Å; L14-L17 PolarHBondContact O-N 3.33Å; L14-H18 PolarHBondContact O-N 2.9Å
15L73.7Confident65.6Low119 Ų11999 Ų9962%0.62360%0.602SS**Hα-helixtrans-63.1-43.3178.7-17763.9000111.5L11 L12 H18 A19L11-L15 VanDerWaalsContact O-CB 3.32Å; L11-L15 WeakPolarHBondContact O-CB 3.29Å; L11-L15 PolarHBondContact O-N 3.24Å; L12-L15 PolarHBondContact O-N 3.39Å; L15-H18 PolarHBondContact O-N 3.08Å; L15-A19 WeakPolarHBondContact O-CB 3.47Å; L15-A19 PolarHBondContact O-N 3.42Å
16A70.4Confident64.4Low65 Ų6596 Ų9654%0.53761%0.605SS.*Hα-helixtrans-64-39.2175.300000112.2L12 S13 A19 V20L12-A16 WeakPolarHBondContact O-CB 3.34Å; L12-A16 PolarHBondContact O-N 2.93Å; S13-A16 PolarHBondContact O-N 2.89Å; A16-A19 PolarHBondContact O-N 3.35Å; A16-V20 PolarHBondContact O-N 3.02Å
17L65.3Low63.4Low73 Ų7396 Ų9638%0.38260%0.6SS.*Hα-helixtrans-67.5-39.1177.9-171.462.8000112.2S13 L14 V20 F47S13-L17 WeakPolarHBondContact O-CB 3.43Å; S13-L17 PolarHBondContact O-N 3.34Å; L14-L17 PolarHBondContact O-N 3.33Å; L17-V20 WeakPolarHBondContact O-CG1 3.22Å; L17-V20 PolarHBondContact O-N 3.26Å; L17-F47 HydrophobicContact CD1-CD1 4.43Å; L17-F47 HydrophobicContact CD1-CE1 3.79Å; L17-F47 HydrophobicContact CD1-CE2 4.17Å; L17-F47 HydrophobicContact CD1-CZ 3.7Å
18H59.5Low62.4Low125 Ų12599.3 Ų99.358%0.57962%0.622SS**Hα-helixtrans-71.5-33.9174.2-82.6-159.4000112.9L14 L15 V20 Q21L14-H18 PolarHBondContact O-N 2.9Å; L15-H18 PolarHBondContact O-N 3.08Å; H18-V20 PolarHBondContact O-N 3.37Å; H18-Q21 PolarHBondContact O-N 2.76Å; H18-Q21 VanDerWaalsContact O-N 3.11Å
19A61.3Low61.2Low76 Ų76100.7 Ų100.763%0.62863%0.631SS**Hα-helixtrans-62-25.8176.800000112.7L15 A16 Q21L15-A19 WeakPolarHBondContact O-CB 3.47Å; L15-A19 PolarHBondContact O-N 3.42Å; A16-A19 PolarHBondContact O-N 3.35Å; A19-Q21 VanDerWaalsContact C-N 3.29Å; A19-Q21 PolarHBondContact O-N 3.43Å
20V57.6Low59.7Low93 Ų93104.8 Ų104.856%0.56465%0.648SS**THydrogen-bonded Turntrans-71.5-21177.4113.90000113.3A16 L17 H18 G22A16-V20 PolarHBondContact O-N 3.02Å; L17-V20 WeakPolarHBondContact O-CG1 3.22Å; L17-V20 PolarHBondContact O-N 3.26Å; H18-V20 PolarHBondContact O-N 3.37Å; V20-G22 VanDerWaalsContact C-N 3.28Å; V20-G22 PolarHBondContact O-N 3.38Å
21Q56.7Low58.1Low143 Ų143112.8 Ų112.867%0.66867%0.669SS**THydrogen-bonded Turntrans-83.5-1.8-177.3-62.8179-40.800113.3H18 A19 A23H18-Q21 PolarHBondContact O-N 2.76Å; H18-Q21 VanDerWaalsContact O-N 3.11Å; A19-Q21 VanDerWaalsContact C-N 3.29Å; A19-Q21 PolarHBondContact O-N 3.43Å; Q21-A23 PolarHBondContact O-N 3.12Å
22G54.3Low57.3Low72 Ų72111.5 Ų111.574%0.74267%0.668SS**THydrogen-bonded Turntrans-90.619.7-171.800000117.2V20V20-G22 VanDerWaalsContact C-N 3.28Å; V20-G22 PolarHBondContact O-N 3.38Å
23A49.8Very low56.3Low96 Ų96113.9 Ų113.979%0.79368%0.676SS**THydrogen-bonded Turntrans-131.815.3-179.400000115.2Q21Q21-A23 PolarHBondContact O-N 3.12Å
24A53Low55Low96 Ų96117.8 Ų117.879%0.79369%0.691SS**  trans-10553.4174.100000111.2
25L49.4Very low53.8Low176 Ų176117.6 Ų117.692%0.92170%0.699SS**  trans-117.332.6170.6-99.1164.2000111.7H27L25-H27 PolarHBondContact O-N 3.18Å
26G44.8Very low52.6Low73 Ų73116.3 Ų116.375%0.75370%0.699SS**  trans-80.194.3158.700000109.3
27H41.8Very low51.3Low145 Ų145124.8 Ų124.867%0.67172%0.719SS**  trans-41126.1170.1-169.597.8000112.8L25 T29L25-H27 PolarHBondContact O-N 3.18Å; H27-T29 WeakPolarHBondContact CD2-CG2 3.48Å; H27-T29 PolarHBondContact CD2-OG1 3.44Å; H27-T29 WeakPolarHBondContact NE2-CG2 3.48Å; H27-T29 PolarHBondContact O-N 2.87Å; H27-T29 VanDerWaalsContact O-N 3.13Å
28P50.7Low50.6Low130 Ų130127.7 Ų127.784%0.84474%0.735SS**  trans-84.785.4172.832.6-29000108.9
29T50.8Low50.4Low97 Ų97128.4 Ų128.460%0.59574%0.743SS**  trans-98.2128.2157.534.80000108.9H27H27-T29 WeakPolarHBondContact CD2-CG2 3.48Å; H27-T29 PolarHBondContact CD2-OG1 3.44Å; H27-T29 WeakPolarHBondContact NE2-CG2 3.48Å; H27-T29 PolarHBondContact O-N 2.87Å; H27-T29 VanDerWaalsContact O-N 3.13Å
30I45.5Very low49.6Very low164 Ų164135 Ų13584%0.84175%0.753SS**SBendtrans97.7105.8167-47.3-170000115
31Y41.2Very low49.2Very low221 Ų221134.2 Ų134.287%0.86775%0.75SS**  trans-61.8-179.8164.8-63.7-89.9000112.7
32P56.3Low49Very low93 Ų93131.2 Ų131.260%0.60474%0.742SS**  cis-127.2-179.3-27.319.95000111.8
33E52.1Low48.9Very low158 Ų158130.2 Ų130.274%0.73873%0.727SS**  trans57.2135.1153.276.4-149.4133.200120.9
34D49.3Very low48.9Very low155 Ų155130.7 Ų130.783%0.82972%0.72SS**  trans96.518.5148.899.2-6.7000123.8
35S47.3Very low48.8Very low100 Ų100131.9 Ų131.970%0.69971%0.709SS**SBendtrans-128.39916846.60000113.5Y37S35-Y37 PolarHBondContact O-N 2.93Å
36S47.2Very low48.9Very low91 Ų91127.1 Ų127.164%0.63670%0.695SS**  trans38.777.5141.7-170.70000114.6N38S36-N38 PolarHBondContact O-N 2.98Å
37Y44.1Very low49.2Very low244 Ų244127.1 Ų127.196%0.95767%0.674SS**  trans-64.524.2158.2-95.3-88.1000112.6S35S35-Y37 PolarHBondContact O-N 2.93Å
38N49.2Very low49.8Very low133 Ų133124.3 Ų124.371%0.71166%0.662SS**  trans-98.3118172.7-64.7-50.8000108.4S36S36-N38 PolarHBondContact O-N 2.98Å
39N56.4Low50Low140 Ų140122.7 Ų122.775%0.74965%0.653SS**  trans88.655.1150.8-150.77.5000117.1
40Y44.2Very low50.2Low215 Ų215125 Ų12584%0.84366%0.657SS**  trans-110121.5130.9-90.1-91.5000106.5T42Y40-T42 VanDerWaalsContact C-N 3.32Å; Y40-T42 PolarHBondContact O-N 3.49Å
41P48.8Very low50.5Low76 Ų76120.3 Ų120.349%0.49463%0.634SS.*  trans-58.5110.6166.224.8-29.2000104.7A43 E45P41-A43 PolarHBondContact O-N 2.94Å; P41-E45 WeakPolarHBondContact CA-OE2 3.27Å
42T52.2Low51.2Low80 Ų80114.8 Ų114.849%0.49162%0.615SS.*  trans-49.6134172.3-54.20000104.4Y40 T44 E45 A46Y40-T42 VanDerWaalsContact C-N 3.32Å; Y40-T42 PolarHBondContact O-N 3.49Å; T42-T44 WeakPolarHBondContact CG2-OG1 3.27Å; T42-T44 CarbonylContact O-C 3.27Å; T42-T44 PolarHBondContact O-N 2.96Å; T42-E45 PolarHBondContact N-OE2 3.24Å; T42-E45 WeakPolarHBondContact O-CA 3.33Å; T42-E45 WeakPolarHBondContact O-CB 3.35Å; T42-E45 PolarHBondContact O-N 3.18Å; T42-A46 PolarHBondContact O-N 2.95Å
43A52.4Low51.3Low52 Ų52117.8 Ų117.843%0.4363%0.625SS.*Hα-helixtrans-45.6-37.2-176.700000110.6P41 E45 A46 F47P41-A43 PolarHBondContact O-N 2.94Å; A43-E45 VanDerWaalsContact C-N 3.3Å; A43-E45 PolarHBondContact O-N 3.17Å; A43-A46 CarbonylContact O-C 3.16Å; A43-A46 PolarHBondContact O-N 3.01Å; A43-F47 VanDerWaalsContact C-CD2 3.44Å; A43-F47 HydrophobicContact CB-CD2 3.93Å; A43-F47 HydrophobicContact CB-CE2 4.02Å; A43-F47 VanDerWaalsContact O-CB 3.3Å; A43-F47 WeakPolarHBondContact O-CB 3.28Å; A43-F47 WeakPolarHBondContact O-CD2 3.13Å; A43-F47 WeakPolarHBondContact O-CG 3.12Å; A43-F47 PolarHBondContact O-N 3.16Å
44T49.6Very low52Low105 Ų105113 Ų11364%0.64460%0.604SS**Hα-helixtrans-47.9-35.6169.8-39.20000116.8T42 F47T42-T44 WeakPolarHBondContact CG2-OG1 3.27Å; T42-T44 CarbonylContact O-C 3.27Å; T42-T44 PolarHBondContact O-N 2.96Å; T44-F47 CarbonylContact O-C 3.55Å; T44-F47 VanDerWaalsContact O-O 3.09Å
45E51.9Low52.7Low121 Ų121114.7 Ų114.757%0.56560%0.599SS**Hα-helixtrans-83.5-31.2177-58.9178157.600112.2P41 T42 A43 F47 Q48P41-E45 WeakPolarHBondContact CA-OE2 3.27Å; T42-E45 PolarHBondContact N-OE2 3.24Å; T42-E45 WeakPolarHBondContact O-CA 3.33Å; T42-E45 WeakPolarHBondContact O-CB 3.35Å; T42-E45 PolarHBondContact O-N 3.18Å; A43-E45 VanDerWaalsContact C-N 3.3Å; A43-E45 PolarHBondContact O-N 3.17Å; E45-F47 VanDerWaalsContact C-N 3.29Å; E45-Q48 WeakPolarHBondContact O-CG 3.2Å
46A51.8Low53.9Low76 Ų76115.8 Ų115.863%0.62859%0.593SS**Hα-helixtrans-73.5-27.5167.400000111.5T42 A43 Q48T42-A46 PolarHBondContact O-N 2.95Å; A43-A46 CarbonylContact O-C 3.16Å; A43-A46 PolarHBondContact O-N 3.01Å; A46-Q48 PolarHBondContact O-N 3.34Å
47F51.4Low55.1Low73 Ų73114.7 Ų114.732%0.3258%0.582SS.*THydrogen-bonded Turntrans-88.946.5169.1-70.1-75.8000110.1L17 A43 T44 E45 S49 F52L17-F47 HydrophobicContact CD1-CD1 4.43Å; L17-F47 HydrophobicContact CD1-CE1 3.79Å; L17-F47 HydrophobicContact CD1-CE2 4.17Å; L17-F47 HydrophobicContact CD1-CZ 3.7Å; A43-F47 VanDerWaalsContact C-CD2 3.44Å; A43-F47 HydrophobicContact CB-CD2 3.93Å; A43-F47 HydrophobicContact CB-CE2 4.02Å; A43-F47 VanDerWaalsContact O-CB 3.3Å; A43-F47 WeakPolarHBondContact O-CB 3.28Å; A43-F47 WeakPolarHBondContact O-CD2 3.13Å; A43-F47 WeakPolarHBondContact O-CG 3.12Å; A43-F47 PolarHBondContact O-N 3.16Å; T44-F47 CarbonylContact O-C 3.55Å; T44-F47 VanDerWaalsContact O-O 3.09Å; E45-F47 VanDerWaalsContact C-N 3.29Å; F47-S49 PolarHBondContact O-N 3.29Å; F47-F52 HydrophobicContact CB-CD2 4.49Å; F47-F52 HydrophobicContact CD1-CD1 4.43Å; F47-F52 AromaticContact CD1-CD2 3.37Å; F47-F52 HydrophobicContact CD1-CD2 3.37Å; F47-F52 HydrophobicContact CD1-CE1 4.05Å; F47-F52 AromaticContact CD1-CE2 2.96Å; F47-F52 HydrophobicContact CD1-CE2 2.96Å; F47-F52 HydrophobicContact CD1-CG 4.13Å; F47-F52 AromaticContact CD1-CZ 3.33Å; F47-F52 HydrophobicContact CD1-CZ 3.33Å; F47-F52 AromaticContact CE1-CD2 3.99Å; F47-F52 HydrophobicContact CE1-CD2 3.99Å; F47-F52 HydrophobicContact CE1-CE1 4.23Å; F47-F52 AromaticContact CE1-CE2 3.08Å; F47-F52 HydrophobicContact CE1-CE2 3.08Å; F47-F52 AromaticContact CE1-CZ 3.22Å; F47-F52 HydrophobicContact CE1-CZ 3.22Å; F47-F52 HydrophobicContact CG-CD2 4.37Å; F47-F52 HydrophobicContact CG-CE2 4.23Å; F47-F52 HydrophobicContact CZ-CE2 4.42Å
48Q54.3Low56.5Low87 Ų87107 Ų10741%0.40756%0.557SS.*  trans-53.8107.8166.4-66.6-157-60.400107.4E45 A46 E50 N51 F52E45-Q48 WeakPolarHBondContact O-CG 3.2Å; A46-Q48 PolarHBondContact O-N 3.34Å; Q48-E50 HydrophobicContact CB-CG 3.76Å; Q48-E50 PolarHBondContact NE2-OE1 2.95Å; Q48-E50 VanDerWaalsContact NE2-OE1 3.13Å; Q48-E50 PolarHBondContact O-N 3.43Å; Q48-N51 HydrophobicContact CB-CB 4.31Å; Q48-N51 CarbonylContact O-C 3.52Å; Q48-N51 WeakPolarHBondContact O-CA 3.41Å; Q48-N51 PolarHBondContact O-N 3.05Å; Q48-N51 PolarHBondContact OE1-ND2 3.38Å; Q48-F52 PolarHBondContact O-N 3.06Å
49S53.6Low57.6Low96 Ų96102 Ų10267%0.67153%0.531SS*.Hα-helixtrans-56.3-27.1-176.750.50000112.5F47 N51 F52F47-S49 PolarHBondContact O-N 3.29Å; S49-N51 VanDerWaalsContact C-N 3.35Å; S49-F52 PolarHBondContact O-N 3.42Å
50E54.6Low58.4Low144 Ų14498 Ų9867%0.67351%0.51SS*.Hα-helixtrans-63.9-30.5170.346.9-163.6171.600114.1Q48Q48-E50 HydrophobicContact CB-CG 3.76Å; Q48-E50 PolarHBondContact NE2-OE1 2.95Å; Q48-E50 VanDerWaalsContact NE2-OE1 3.13Å; Q48-E50 PolarHBondContact O-N 3.43Å
51N53.4Low59.7Low67 Ų6794.4 Ų94.436%0.35850%0.502SS..Hα-helixtrans-101.9-14.5171.8-79.7-48.3000113.9Q48 S49 L53 N54Q48-N51 HydrophobicContact CB-CB 4.31Å; Q48-N51 CarbonylContact O-C 3.52Å; Q48-N51 WeakPolarHBondContact O-CA 3.41Å; Q48-N51 PolarHBondContact O-N 3.05Å; Q48-N51 PolarHBondContact OE1-ND2 3.38Å; S49-N51 VanDerWaalsContact C-N 3.35Å; N51-L53 PolarHBondContact O-N 3.35Å; N51-N54 HydrophobicContact CB-CB 4.46Å; N51-N54 WeakPolarHBondContact O-CB 3.39Å; N51-N54 PolarHBondContact O-N 3.22Å; N51-N54 PolarHBondContact OD1-ND2 3.18Å
52F56.1Low61.1Low105 Ų10595.8 Ų95.846%0.46150%0.501SS..Hα-helixtrans-72.2-20.6-179.2-145.9-111.6000113.3F47 Q48 S49F47-F52 HydrophobicContact CB-CD2 4.49Å; F47-F52 HydrophobicContact CD1-CD1 4.43Å; F47-F52 AromaticContact CD1-CD2 3.37Å; F47-F52 HydrophobicContact CD1-CD2 3.37Å; F47-F52 HydrophobicContact CD1-CE1 4.05Å; F47-F52 AromaticContact CD1-CE2 2.96Å; F47-F52 HydrophobicContact CD1-CE2 2.96Å; F47-F52 HydrophobicContact CD1-CG 4.13Å; F47-F52 AromaticContact CD1-CZ 3.33Å; F47-F52 HydrophobicContact CD1-CZ 3.33Å; F47-F52 AromaticContact CE1-CD2 3.99Å; F47-F52 HydrophobicContact CE1-CD2 3.99Å; F47-F52 HydrophobicContact CE1-CE1 4.23Å; F47-F52 AromaticContact CE1-CE2 3.08Å; F47-F52 HydrophobicContact CE1-CE2 3.08Å; F47-F52 AromaticContact CE1-CZ 3.22Å; F47-F52 HydrophobicContact CE1-CZ 3.22Å; F47-F52 HydrophobicContact CG-CD2 4.37Å; F47-F52 HydrophobicContact CG-CE2 4.23Å; F47-F52 HydrophobicContact CZ-CE2 4.42Å; Q48-F52 PolarHBondContact O-N 3.06Å; S49-F52 PolarHBondContact O-N 3.42Å
53L57.9Low62.1Low156 Ų15696 Ų9682%0.81750%0.495SS*.THydrogen-bonded Turntrans-10312.3167.1-65.5175.9000112.4N51 W55N51-L53 PolarHBondContact O-N 3.35Å; L53-W55 VanDerWaalsContact C-N 3.35Å; L53-W55 PolarHBondContact O-N 2.79Å
54N65.2Low63.3Low58 Ų5899.6 Ų99.631%0.3151%0.507SS..  trans-77.593.4175.2-166.8-22.1000108.5N51 H56 V57 I58N51-N54 HydrophobicContact CB-CB 4.46Å; N51-N54 WeakPolarHBondContact O-CB 3.39Å; N51-N54 PolarHBondContact O-N 3.22Å; N51-N54 PolarHBondContact OD1-ND2 3.18Å; N54-H56 PolarHBondContact O-N 3.42Å; N54-H56 WeakPolarHBondContact OD1-CB 3.45Å; N54-H56 PolarHBondContact OD1-N 3.36Å; N54-V57 HydrophobicContact CB-CB 4.33Å; N54-V57 HydrophobicContact CB-CG2 3.99Å; N54-V57 PolarHBondContact O-N 3.06Å; N54-I58 PolarHBondContact O-N 3.44Å; N54-I58 VanDerWaalsContact O-N 3.17Å
55W66.1Low64.4Low190 Ų19097.6 Ų97.672%0.7250%0.501SS*.Hα-helixtrans-47.2-35.1178.5179-104.4000112.4L53 T59L53-W55 VanDerWaalsContact C-N 3.35Å; L53-W55 PolarHBondContact O-N 2.79Å; W55-T59 HydrophobicContact CD2-CG2 4.1Å; W55-T59 HydrophobicContact CG-CG2 4.41Å; W55-T59 HydrophobicContact CZ2-CG2 3.89Å; W55-T59 WeakPolarHBondContact O-CB 3.44Å; W55-T59 VanDerWaalsContact O-CG2 3.27Å; W55-T59 WeakPolarHBondContact O-CG2 3.21Å; W55-T59 PolarHBondContact O-N 3.05Å; W55-T59 PolarHBondContact O-OG1 3.44Å; W55-T59 VanDerWaalsContact O-OG1 3.08Å
56H71.2Confident65.5Low123 Ų12395.4 Ų95.457%0.56949%0.49SS*.Hα-helixtrans-63.7-49.5179.2-15573.3000112N54 I58 T59 D60N54-H56 PolarHBondContact O-N 3.42Å; N54-H56 WeakPolarHBondContact OD1-CB 3.45Å; N54-H56 PolarHBondContact OD1-N 3.36Å; H56-I58 VanDerWaalsContact C-N 3.35Å; H56-I58 PolarHBondContact O-N 2.76Å; H56-T59 WeakPolarHBondContact CA-OG1 3.44Å; H56-T59 PolarHBondContact O-N 3.42Å; H56-T59 PolarHBondContact O-OG1 3.39Å; H56-D60 IonicContact CD2-OD2 3.35Å; H56-D60 PolarHBondContact CD2-OD2 2.75Å; H56-D60 IonicContact NE2-OD2 3.51Å; H56-D60 PolarHBondContact O-N 3.39Å
57V73.1Confident66.5Low67 Ų6796.7 Ų96.741%0.40649%0.492SS..Hα-helixtrans-62.5-43179.7179.40000111N54 T59 D60 M61N54-V57 HydrophobicContact CB-CB 4.33Å; N54-V57 HydrophobicContact CB-CG2 3.99Å; N54-V57 PolarHBondContact O-N 3.06Å; V57-T59 PolarHBondContact O-N 2.99Å; V57-D60 PolarHBondContact O-N 2.96Å; V57-M61 PolarHBondContact O-N 3.34Å
58I72.4Confident67.7Low83 Ų83100.8 Ų100.843%0.42651%0.51SS..Hα-helixtrans-60.9-46.5176.1-63167000110.2N54 H56 D60 F62N54-I58 PolarHBondContact O-N 3.44Å; N54-I58 VanDerWaalsContact O-N 3.17Å; H56-I58 VanDerWaalsContact C-N 3.35Å; H56-I58 PolarHBondContact O-N 2.76Å; I58-D60 VanDerWaalsContact C-N 3.33Å; I58-D60 PolarHBondContact O-N 2.92Å; I58-F62 VanDerWaalsContact O-CB 3.28Å; I58-F62 WeakPolarHBondContact O-CB 3.44Å; I58-F62 PolarHBondContact O-N 3.42Å
59T72.8Confident68.5Low29 Ų2999.3 Ų99.318%0.17850%0.504CS..Hα-helixtrans-66.2-35.6179.755.30000112.8W55 H56 V57 F62 K63W55-T59 HydrophobicContact CD2-CG2 4.1Å; W55-T59 HydrophobicContact CG-CG2 4.41Å; W55-T59 HydrophobicContact CZ2-CG2 3.89Å; W55-T59 WeakPolarHBondContact O-CB 3.44Å; W55-T59 VanDerWaalsContact O-CG2 3.27Å; W55-T59 WeakPolarHBondContact O-CG2 3.21Å; W55-T59 PolarHBondContact O-N 3.05Å; W55-T59 PolarHBondContact O-OG1 3.44Å; W55-T59 VanDerWaalsContact O-OG1 3.08Å; H56-T59 WeakPolarHBondContact CA-OG1 3.44Å; H56-T59 PolarHBondContact O-N 3.42Å; H56-T59 PolarHBondContact O-OG1 3.39Å; V57-T59 PolarHBondContact O-N 2.99Å; T59-F62 PolarHBondContact O-N 3.01Å; T59-K63 WeakPolarHBondContact O-CB 3.3Å; T59-K63 WeakPolarHBondContact O-CG 3.06Å; T59-K63 PolarHBondContact O-N 2.86Å
60D73.1Confident69.3Low55 Ų5598.7 Ų98.729%0.29449%0.493SS..Hα-helixtrans-75.2-40.8-179.8-73.2-22.5000112H56 V57 I58 F62 K63 N64H56-D60 IonicContact CD2-OD2 3.35Å; H56-D60 PolarHBondContact CD2-OD2 2.75Å; H56-D60 IonicContact NE2-OD2 3.51Å; H56-D60 PolarHBondContact O-N 3.39Å; V57-D60 PolarHBondContact O-N 2.96Å; I58-D60 VanDerWaalsContact C-N 3.33Å; I58-D60 PolarHBondContact O-N 2.92Å; D60-F62 VanDerWaalsContact C-N 3.27Å; D60-F62 PolarHBondContact O-N 2.94Å; D60-K63 PolarHBondContact O-N 3.13Å; D60-K63 IonicContact OD1-NZ 3.51Å; D60-N64 WeakPolarHBondContact O-CB 3.48Å; D60-N64 VanDerWaalsContact O-CG 3.24Å; D60-N64 PolarHBondContact O-N 3.21Å; D60-N64 PolarHBondContact O-ND2 3.39Å
61M72.4Confident70Confident140 Ų14095 Ų9569%0.6947%0.473SS*.Hα-helixtrans-57.6-42.6168.8-98.1-178.96200111.5V57 N64 A65V57-M61 PolarHBondContact O-N 3.34Å; M61-N64 PolarHBondContact O-N 3.49Å; M61-A65 VanDerWaalsContact O-CB 3.27Å; M61-A65 WeakPolarHBondContact O-CB 3.32Å; M61-A65 PolarHBondContact O-N 2.93Å
62F76.6Confident70.8Confident105 Ų10598.8 Ų98.846%0.46149%0.494SS..Hα-helixtrans-66.6-41.5179.5-167.9-121.5000112.1I58 T59 D60 N64 A65 F66 W71I58-F62 VanDerWaalsContact O-CB 3.28Å; I58-F62 WeakPolarHBondContact O-CB 3.44Å; I58-F62 PolarHBondContact O-N 3.42Å; T59-F62 PolarHBondContact O-N 3.01Å; D60-F62 VanDerWaalsContact C-N 3.27Å; D60-F62 PolarHBondContact O-N 2.94Å; F62-N64 PolarHBondContact O-N 3.42Å; F62-A65 PolarHBondContact O-N 3.44Å; F62-F66 AromaticContact CD2-CD2 3.71Å; F62-F66 HydrophobicContact CD2-CD2 3.71Å; F62-F66 AromaticContact CD2-CE2 3.68Å; F62-F66 HydrophobicContact CD2-CE2 3.68Å; F62-F66 AromaticContact CE2-CD2 3.65Å; F62-F66 HydrophobicContact CE2-CD2 3.65Å; F62-F66 AromaticContact CE2-CE2 3.42Å; F62-F66 HydrophobicContact CE2-CE2 3.42Å; F62-F66 VanDerWaalsContact CE2-CE2 3.42Å; F62-F66 HydrophobicContact CE2-CZ 4.37Å; F62-F66 HydrophobicContact CG-CD2 4.37Å; F62-F66 HydrophobicContact CZ-CD2 4.31Å; F62-F66 HydrophobicContact CZ-CE2 4.34Å; F62-F66 WeakPolarHBondContact O-CD2 3.38Å; F62-F66 PolarHBondContact O-N 2.95Å; F62-F66 VanDerWaalsContact O-N 3.12Å; F62-W71 AromaticContact CD1-CH2 3.16Å; F62-W71 HydrophobicContact CD1-CH2 3.16Å; F62-W71 AromaticContact CD1-CZ2 3.81Å; F62-W71 HydrophobicContact CD1-CZ2 3.81Å; F62-W71 AromaticContact CD1-CZ3 3.81Å; F62-W71 HydrophobicContact CD1-CZ3 3.81Å; F62-W71 AromaticContact CE1-CH2 3.1Å; F62-W71 HydrophobicContact CE1-CH2 3.1Å; F62-W71 HydrophobicContact CE1-CZ2 4.07Å; F62-W71 AromaticContact CE1-CZ3 3.73Å; F62-W71 HydrophobicContact CE1-CZ3 3.73Å; F62-W71 HydrophobicContact CG-CH2 4.21Å; F62-W71 HydrophobicContact CZ-CH2 4.04Å
63K74.6Confident71.2Confident83 Ų83101.8 Ų101.836%0.36151%0.506SS..Hα-helixtrans-62.8-43.2174.2-73.4166.9-174.41670112.3T59 D60 F66 W71T59-K63 WeakPolarHBondContact O-CB 3.3Å; T59-K63 WeakPolarHBondContact O-CG 3.06Å; T59-K63 PolarHBondContact O-N 2.86Å; D60-K63 PolarHBondContact O-N 3.13Å; D60-K63 IonicContact OD1-NZ 3.51Å; K63-F66 CarbonylContact O-C 3.45Å; K63-F66 VanDerWaalsContact O-C 3.27Å; K63-F66 PolarHBondContact O-N 3.29Å; K63-W71 HydrophobicContact CG-CD2 3.78Å; K63-W71 HydrophobicContact CG-CE3 4.43Å; K63-W71 HydrophobicContact CG-CG 3.92Å; K63-W71 HydrophobicContact CG-CZ2 4.36Å
64N76.4Confident71.5Confident128 Ų128100.7 Ų100.768%0.68450%0.496SS*.Hα-helixtrans-69.8-34.4-179.9-72.5-34.7000112.6D60 M61 F62 F66D60-N64 WeakPolarHBondContact O-CB 3.48Å; D60-N64 VanDerWaalsContact O-CG 3.24Å; D60-N64 PolarHBondContact O-N 3.21Å; D60-N64 PolarHBondContact O-ND2 3.39Å; M61-N64 PolarHBondContact O-N 3.49Å; F62-N64 PolarHBondContact O-N 3.42Å; N64-F66 VanDerWaalsContact C-N 3.32Å
65A73.9Confident71.1Confident64 Ų64103.2 Ų103.253%0.52952%0.515SS..Hα-helixtrans-71.8-27.5176.300000112.7M61 F62 P67M61-A65 VanDerWaalsContact O-CB 3.27Å; M61-A65 WeakPolarHBondContact O-CB 3.32Å; M61-A65 PolarHBondContact O-N 2.93Å; F62-A65 PolarHBondContact O-N 3.44Å; A65-P67 VanDerWaalsContact O-CD 3.29Å; A65-P67 WeakPolarHBondContact O-CD 3.5Å
66F75.1Confident70.7Confident75 Ų75102.5 Ų102.533%0.32952%0.517SS..  trans-121.767.7179.8-62.4-86000111.2F62 K63 N64 F68 I69 W71F62-F66 AromaticContact CD2-CD2 3.71Å; F62-F66 HydrophobicContact CD2-CD2 3.71Å; F62-F66 AromaticContact CD2-CE2 3.68Å; F62-F66 HydrophobicContact CD2-CE2 3.68Å; F62-F66 AromaticContact CE2-CD2 3.65Å; F62-F66 HydrophobicContact CE2-CD2 3.65Å; F62-F66 AromaticContact CE2-CE2 3.42Å; F62-F66 HydrophobicContact CE2-CE2 3.42Å; F62-F66 VanDerWaalsContact CE2-CE2 3.42Å; F62-F66 HydrophobicContact CE2-CZ 4.37Å; F62-F66 HydrophobicContact CG-CD2 4.37Å; F62-F66 HydrophobicContact CZ-CD2 4.31Å; F62-F66 HydrophobicContact CZ-CE2 4.34Å; F62-F66 WeakPolarHBondContact O-CD2 3.38Å; F62-F66 PolarHBondContact O-N 2.95Å; F62-F66 VanDerWaalsContact O-N 3.12Å; K63-F66 CarbonylContact O-C 3.45Å; K63-F66 VanDerWaalsContact O-C 3.27Å; K63-F66 PolarHBondContact O-N 3.29Å; N64-F66 VanDerWaalsContact C-N 3.32Å; F66-F68 HydrophobicContact CB-CZ 4.42Å; F66-F68 HydrophobicContact CD1-CE1 4.04Å; F66-F68 AromaticContact CD1-CE2 3.93Å; F66-F68 HydrophobicContact CD1-CE2 3.93Å; F66-F68 AromaticContact CD1-CZ 3.39Å; F66-F68 HydrophobicContact CD1-CZ 3.39Å; F66-F68 HydrophobicContact CE1-CZ 4.08Å; F66-F68 HydrophobicContact CG-CZ 4.35Å; F66-F68 PolarHBondContact O-N 2.86Å; F66-I69 HydrophobicContact CB-CB 4.29Å; F66-I69 HydrophobicContact CB-CD1 3.58Å; F66-I69 HydrophobicContact CB-CG1 3.9Å; F66-I69 HydrophobicContact CD1-CD1 3.94Å; F66-I69 HydrophobicContact CG-CD1 3.88Å; F66-I69 PolarHBondContact O-N 3.21Å; F66-W71 HydrophobicContact CB-CZ2 4.01Å; F66-W71 PolarHBondContact O-NE1 3.22Å
67P72.4Confident70.1Confident102 Ų102102.6 Ų102.666%0.66253%0.526SS*.THydrogen-bonded Turntrans-70.8-13.9-177.731.2-36.6000113A65A65-P67 VanDerWaalsContact O-CD 3.29Å; A65-P67 WeakPolarHBondContact O-CD 3.5Å
68F76.6Confident69.1Low159 Ų159107.9 Ų107.970%0.69754%0.543SS*.THydrogen-bonded Turntrans-86.8-10.717753-95.1000113.4F66F66-F68 HydrophobicContact CB-CZ 4.42Å; F66-F68 HydrophobicContact CD1-CE1 4.04Å; F66-F68 AromaticContact CD1-CE2 3.93Å; F66-F68 HydrophobicContact CD1-CE2 3.93Å; F66-F68 AromaticContact CD1-CZ 3.39Å; F66-F68 HydrophobicContact CD1-CZ 3.39Å; F66-F68 HydrophobicContact CE1-CZ 4.08Å; F66-F68 HydrophobicContact CG-CZ 4.35Å; F66-F68 PolarHBondContact O-N 2.86Å
69I71.8Confident68.2Low57 Ų57107.2 Ų107.229%0.29256%0.557SS.*SBendtrans-81.7127.4174.2-67.7-179.7000108.3F66 W71 F74F66-I69 HydrophobicContact CB-CB 4.29Å; F66-I69 HydrophobicContact CB-CD1 3.58Å; F66-I69 HydrophobicContact CB-CG1 3.9Å; F66-I69 HydrophobicContact CD1-CD1 3.94Å; F66-I69 HydrophobicContact CG-CD1 3.88Å; F66-I69 PolarHBondContact O-N 3.21Å; I69-W71 HydrophobicContact CB-CH2 4.49Å; I69-W71 HydrophobicContact CB-CZ2 4Å; I69-W71 HydrophobicContact CD1-CH2 4.24Å; I69-W71 HydrophobicContact CD1-CZ2 4.2Å; I69-W71 HydrophobicContact CG2-CD2 4Å; I69-W71 HydrophobicContact CG2-CE3 4.23Å; I69-W71 HydrophobicContact CG2-CH2 3.99Å; I69-W71 HydrophobicContact CG2-CZ2 3.9Å; I69-W71 HydrophobicContact CG2-CZ3 4.21Å; I69-W71 PolarHBondContact O-N 2.69Å; I69-W71 PolarHBondContact O-NE1 3.06Å; I69-F74 HydrophobicContact CG2-CE2 4.42Å
70N70.4Confident67.1Low83 Ų83113.4 Ų113.444%0.44459%0.588SS.*  trans-77.195.1171.7-166.9-21.8000109.8D72 F73N70-D72 PolarHBondContact O-N 2.85Å; N70-D72 WeakPolarHBondContact OD1-CB 2.93Å; N70-D72 PolarHBondContact OD1-N 3.41Å; N70-D72 VanDerWaalsContact OD1-N 3.16Å; N70-F73 HydrophobicContact CB-CD2 3.69Å; N70-F73 HydrophobicContact CB-CE2 4.28Å; N70-F73 HydrophobicContact CB-CG 4.49Å; N70-F73 WeakPolarHBondContact ND2-CD2 3.48Å; N70-F73 WeakPolarHBondContact ND2-CE2 3.14Å; N70-F73 WeakPolarHBondContact O-CB 3.44Å; N70-F73 PolarHBondContact O-N 3.44Å; N70-F73 VanDerWaalsContact O-N 3.13Å
71W68.4Low66.3Low67 Ų67122.1 Ų122.125%0.25462%0.617SS.*G310 helixtrans-64.9-19.9-178.9-66.6103.3000113.8F62 K63 F66 I69 F73 F74F62-W71 AromaticContact CD1-CH2 3.16Å; F62-W71 HydrophobicContact CD1-CH2 3.16Å; F62-W71 AromaticContact CD1-CZ2 3.81Å; F62-W71 HydrophobicContact CD1-CZ2 3.81Å; F62-W71 AromaticContact CD1-CZ3 3.81Å; F62-W71 HydrophobicContact CD1-CZ3 3.81Å; F62-W71 AromaticContact CE1-CH2 3.1Å; F62-W71 HydrophobicContact CE1-CH2 3.1Å; F62-W71 HydrophobicContact CE1-CZ2 4.07Å; F62-W71 AromaticContact CE1-CZ3 3.73Å; F62-W71 HydrophobicContact CE1-CZ3 3.73Å; F62-W71 HydrophobicContact CG-CH2 4.21Å; F62-W71 HydrophobicContact CZ-CH2 4.04Å; K63-W71 HydrophobicContact CG-CD2 3.78Å; K63-W71 HydrophobicContact CG-CE3 4.43Å; K63-W71 HydrophobicContact CG-CG 3.92Å; K63-W71 HydrophobicContact CG-CZ2 4.36Å; F66-W71 HydrophobicContact CB-CZ2 4.01Å; F66-W71 PolarHBondContact O-NE1 3.22Å; I69-W71 HydrophobicContact CB-CH2 4.49Å; I69-W71 HydrophobicContact CB-CZ2 4Å; I69-W71 HydrophobicContact CD1-CH2 4.24Å; I69-W71 HydrophobicContact CD1-CZ2 4.2Å; I69-W71 HydrophobicContact CG2-CD2 4Å; I69-W71 HydrophobicContact CG2-CE3 4.23Å; I69-W71 HydrophobicContact CG2-CH2 3.99Å; I69-W71 HydrophobicContact CG2-CZ2 3.9Å; I69-W71 HydrophobicContact CG2-CZ3 4.21Å; I69-W71 PolarHBondContact O-N 2.69Å; I69-W71 PolarHBondContact O-NE1 3.06Å; W71-F73 PolarHBondContact O-N 3.41Å; W71-F74 AromaticContact CE3-CD2 3.99Å; W71-F74 HydrophobicContact CE3-CD2 3.99Å; W71-F74 AromaticContact CE3-CE2 3.92Å; W71-F74 HydrophobicContact CE3-CE2 3.92Å; W71-F74 HydrophobicContact CZ3-CD2 4.23Å; W71-F74 AromaticContact CZ3-CE2 3.74Å; W71-F74 HydrophobicContact CZ3-CE2 3.74Å; W71-F74 HydrophobicContact CZ3-CZ 4.46Å; W71-F74 PolarHBondContact O-N 3.44Å
72D69.4Low65.4Low146 Ų146120.3 Ų120.378%0.78162%0.618SS**G310 helixtrans-75.5-12.1175.5-66.7-56.7000113.2N70 F74N70-D72 PolarHBondContact O-N 2.85Å; N70-D72 WeakPolarHBondContact OD1-CB 2.93Å; N70-D72 PolarHBondContact OD1-N 3.41Å; N70-D72 VanDerWaalsContact OD1-N 3.16Å; D72-F74 VanDerWaalsContact C-N 3.33Å
73F65.3Low64.3Low167 Ų167119.8 Ų119.873%0.73263%0.633SS**G310 helixtrans-79-13.9175.2-91.4-104.6000113.8N70 W71 P75N70-F73 HydrophobicContact CB-CD2 3.69Å; N70-F73 HydrophobicContact CB-CE2 4.28Å; N70-F73 HydrophobicContact CB-CG 4.49Å; N70-F73 WeakPolarHBondContact ND2-CD2 3.48Å; N70-F73 WeakPolarHBondContact ND2-CE2 3.14Å; N70-F73 WeakPolarHBondContact O-CB 3.44Å; N70-F73 PolarHBondContact O-N 3.44Å; N70-F73 VanDerWaalsContact O-N 3.13Å; W71-F73 PolarHBondContact O-N 3.41Å; F73-P75 WeakPolarHBondContact O-CD 3.44Å
74F64.1Low63.4Low134 Ų134119.5 Ų119.559%0.58865%0.647SS**SBendtrans-70.8114.2172.7-81.7-85.9000108.3I69 W71 D72 K76I69-F74 HydrophobicContact CG2-CE2 4.42Å; W71-F74 AromaticContact CE3-CD2 3.99Å; W71-F74 HydrophobicContact CE3-CD2 3.99Å; W71-F74 AromaticContact CE3-CE2 3.92Å; W71-F74 HydrophobicContact CE3-CE2 3.92Å; W71-F74 HydrophobicContact CZ3-CD2 4.23Å; W71-F74 AromaticContact CZ3-CE2 3.74Å; W71-F74 HydrophobicContact CZ3-CE2 3.74Å; W71-F74 HydrophobicContact CZ3-CZ 4.46Å; W71-F74 PolarHBondContact O-N 3.44Å; D72-F74 VanDerWaalsContact C-N 3.33Å; F74-K76 PolarHBondContact O-N 3.11Å
75P57.3Low62Low110 Ų110119.2 Ų119.271%0.71465%0.651SS**  trans-59.5111.2175.524.3-31.4000106.9F73 V77F73-P75 WeakPolarHBondContact O-CD 3.44Å; P75-V77 PolarHBondContact O-N 2.85Å
76K58.4Low61Low175 Ų175122.9 Ų122.976%0.76166%0.662SS**  trans-47.7113.8166.9-74.6173.5179.3170.90104.8F74 K78F74-K76 PolarHBondContact O-N 3.11Å; K76-K78 PolarHBondContact O-N 3.26Å
77V57.3Low60Low126 Ų126124.7 Ų124.776%0.76468%0.684SS**  trans-6273.6-179.3-87.70000109.6P75P75-V77 PolarHBondContact O-N 2.85Å
78K52.8Low58.8Low177 Ų177131.5 Ų131.577%0.7771%0.707SS**G310 helixtrans-80.3-2.1172.1-82.3-177.9171.1-175.40111.1K76K76-K78 PolarHBondContact O-N 3.26Å
79G52.7Low57.9Low69 Ų69130.2 Ų130.271%0.71171%0.708SS**G310 helixtrans-85.3-12.4-177.100000116.1
80L50.8Low57.1Low160 Ų160134 Ų13484%0.83873%0.73SS**G310 helixtrans-92.8-4179-73170.6000114
81R56.5Low56.4Low237 Ų237136.8 Ų136.889%0.89475%0.746SS**SBendtrans-101.70.6179.5-78.6-173.2168.9-175.8-3114.6
82S53Low55.7Low103 Ų103140.9 Ų140.972%0.7277%0.774SS**  trans-117.361.4179.1-162.40000111.7
83A53.6Low54.8Low94 Ų94140.6 Ų140.678%0.77777%0.774SS**  trans-114.653.514500000107.3P85A83-P85 WeakPolarHBondContact O-CD 3.29Å
84A54.6Low54.1Low77 Ų77138.9 Ų138.964%0.63678%0.777SS**  trans-70116.7152.600000104.6D86A84-D86 PolarHBondContact O-N 3.13Å; A84-D86 VanDerWaalsContact O-N 3.08Å
85P47.1Very low53.4Low121 Ų121139.2 Ų139.279%0.78679%0.79SS**  trans-62.8115.7170.426-28.6000106.1A83 S87A83-P85 WeakPolarHBondContact O-CD 3.29Å; P85-S87 PolarHBondContact O-N 3.32Å
86D52.6Low53.1Low141 Ų141141.5 Ų141.575%0.75480%0.796SS**  trans-65.1105.8169-160.811.4000106.3A84 Q88A84-D86 PolarHBondContact O-N 3.13Å; A84-D86 VanDerWaalsContact O-N 3.08Å; D86-Q88 PolarHBondContact O-N 3.39Å
87S54Low52.7Low113 Ų113138.7 Ų138.779%0.7980%0.799SS**  trans-83.493171.360.50000107.6P85P85-S87 PolarHBondContact O-N 3.32Å
88Q47.4Very low52.3Low246 Ų246139.8 Ų139.8100%1.1580%0.802SS**  trans-134.60159.8-72-158.2-29.100110.1D86D86-Q88 PolarHBondContact O-N 3.39Å

Retrieved 88 of 88 residues in 34.8 ms (Link to these results)