A0A087WZ82_HUMAN Loading...

FXYD domain-containing ion transport regulator

May be involved in forming the receptor site for cardiac glycoside binding or may modulate the transport function of the sodium ATPase.

AlphaFold DB , UniProt , Accession A0A087WZ82, Species HUMAN (Homo sapiens, Human), Gene FXYD6-FXYD2, Length 144 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1M44.9Very low56.4Low209 Ų209111.4 Ų111.4100%1.0360%0.596SS**  0-24.20-56.1-150.8-78.700111.1V4 L5M1-V4 PolarHBondContact O-N 3.2Å; M1-L5 PolarHBondContact O-N 3.36Å
2E44.8Very low56.5Low164 Ų164109.2 Ų109.277%0.76658%0.583SS**Hα-helixtrans-66.8-38.3-179.7-48.6-148.8109.400114V4 L5 V6E2-V4 VanDerWaalsContact C-N 3.29Å; E2-V4 PolarHBondContact O-N 3.13Å; E2-L5 CarbonylContact O-C 3.58Å; E2-L5 WeakPolarHBondContact O-CB 3.45Å; E2-L5 PolarHBondContact O-N 3.35Å; E2-L5 VanDerWaalsContact O-N 3.15Å; E2-V6 VanDerWaalsContact O-CG2 3.28Å; E2-V6 WeakPolarHBondContact O-CG2 3.29Å; E2-V6 PolarHBondContact O-N 3.04Å
3L51.6Low57.3Low152 Ų152105.4 Ų105.480%0.79658%0.577SS**Hα-helixtrans-64-31.1176-68174.5000113.9F7L3-F7 VanDerWaalsContact O-CB 3.24Å; L3-F7 WeakPolarHBondContact O-CB 3.46Å; L3-F7 PolarHBondContact O-N 3.1Å
4V54.2Low57.6Low92 Ų92103.4 Ų103.456%0.55857%0.572SS**Hα-helixtrans-72.9-39.8175.9176.40000109.6M1 E2 L8M1-V4 PolarHBondContact O-N 3.2Å; E2-V4 VanDerWaalsContact C-N 3.29Å; E2-V4 PolarHBondContact O-N 3.13Å; V4-L8 HydrophobicContact CG1-CD1 3.84Å; V4-L8 VanDerWaalsContact O-CB 3.26Å; V4-L8 WeakPolarHBondContact O-CB 3.25Å; V4-L8 WeakPolarHBondContact O-CD1 3.48Å; V4-L8 WeakPolarHBondContact O-CG 3.31Å; V4-L8 PolarHBondContact O-N 3.11Å
5L55Low57.8Low119 Ų119103.1 Ų103.162%0.62357%0.566SS**Hα-helixtrans-67.5-39.8176.5-147.5110.6000111.8M1 E2 C9M1-L5 PolarHBondContact O-N 3.36Å; E2-L5 CarbonylContact O-C 3.58Å; E2-L5 WeakPolarHBondContact O-CB 3.45Å; E2-L5 PolarHBondContact O-N 3.35Å; E2-L5 VanDerWaalsContact O-N 3.15Å; L5-C9 VanDerWaalsContact O-CB 3.28Å; L5-C9 WeakPolarHBondContact O-CB 3.32Å; L5-C9 PolarHBondContact O-N 3.14Å
6V61Low58.2Low86 Ų86101.8 Ų101.852%0.52156%0.561SS.*Hα-helixtrans-66.8-47.5174.6173.10000110.2E2 L8 C9 S10E2-V6 VanDerWaalsContact O-CG2 3.28Å; E2-V6 WeakPolarHBondContact O-CG2 3.29Å; E2-V6 PolarHBondContact O-N 3.04Å; V6-L8 VanDerWaalsContact C-N 3.33Å; V6-L8 PolarHBondContact O-N 3.32Å; V6-C9 PolarHBondContact O-N 3.14Å; V6-S10 WeakPolarHBondContact O-CB 3.31Å; V6-S10 PolarHBondContact O-N 3.28Å; V6-S10 PolarHBondContact O-OG 3.05Å
7F62Low58.3Low105 Ų105103.5 Ų103.546%0.46157%0.569SS.*Hα-helixtrans-61.8-41.2177.1-165.8-95.5000112L3 S10 L11L3-F7 VanDerWaalsContact O-CB 3.24Å; L3-F7 WeakPolarHBondContact O-CB 3.46Å; L3-F7 PolarHBondContact O-N 3.1Å; F7-S10 PolarHBondContact O-N 3.21Å; F7-L11 HydrophobicContact CD1-CD1 3.98Å; F7-L11 HydrophobicContact CD1-CD2 4.42Å; F7-L11 HydrophobicContact CD2-CD1 4.48Å; F7-L11 HydrophobicContact CE1-CD1 3.71Å; F7-L11 HydrophobicContact CE1-CD2 3.93Å; F7-L11 HydrophobicContact CE2-CD1 4.24Å; F7-L11 HydrophobicContact CG-CD1 4.36Å; F7-L11 HydrophobicContact CZ-CD1 3.85Å; F7-L11 WeakPolarHBondContact O-CB 3.03Å; F7-L11 WeakPolarHBondContact O-CD1 3.32Å; F7-L11 PolarHBondContact O-N 3.07Å
8L58.8Low58.2Low91 Ų91101.1 Ų101.148%0.47656%0.564SS.*Hα-helixtrans-61.7-50171.7-87.3154.7000111.3V4 V6 S10 L11 L12V4-L8 HydrophobicContact CG1-CD1 3.84Å; V4-L8 VanDerWaalsContact O-CB 3.26Å; V4-L8 WeakPolarHBondContact O-CB 3.25Å; V4-L8 WeakPolarHBondContact O-CD1 3.48Å; V4-L8 WeakPolarHBondContact O-CG 3.31Å; V4-L8 PolarHBondContact O-N 3.11Å; V6-L8 VanDerWaalsContact C-N 3.33Å; V6-L8 PolarHBondContact O-N 3.32Å; L8-S10 VanDerWaalsContact C-N 3.33Å; L8-S10 PolarHBondContact O-N 3.43Å; L8-L11 PolarHBondContact O-N 3.03Å; L8-L12 HydrophobicContact CB-CD1 4.12Å; L8-L12 HydrophobicContact CD2-CD1 3.73Å; L8-L12 VanDerWaalsContact O-CB 3.25Å; L8-L12 WeakPolarHBondContact O-CB 3.39Å; L8-L12 VanDerWaalsContact O-CD1 3.26Å; L8-L12 WeakPolarHBondContact O-CD1 3.39Å; L8-L12 PolarHBondContact O-N 3.34Å
9C60.7Low58Low76 Ų76100.1 Ų100.151%0.51457%0.565SS.*Hα-helixtrans-60.9-39.1177.2-89.60000112.5L5 V6 L11 A13L5-C9 VanDerWaalsContact O-CB 3.28Å; L5-C9 WeakPolarHBondContact O-CB 3.32Å; L5-C9 PolarHBondContact O-N 3.14Å; V6-C9 PolarHBondContact O-N 3.14Å; C9-L11 VanDerWaalsContact C-N 3.31Å; C9-L11 PolarHBondContact O-N 2.96Å; C9-A13 WeakPolarHBondContact O-CB 3.39Å; C9-A13 PolarHBondContact O-N 3.17Å
10S68.5Low57.8Low71 Ų7198.6 Ų98.650%0.49757%0.566SS.*Hα-helixtrans-69.6-27177.4-570000113V6 F7 L8 P14V6-S10 WeakPolarHBondContact O-CB 3.31Å; V6-S10 PolarHBondContact O-N 3.28Å; V6-S10 PolarHBondContact O-OG 3.05Å; F7-S10 PolarHBondContact O-N 3.21Å; L8-S10 VanDerWaalsContact C-N 3.33Å; L8-S10 PolarHBondContact O-N 3.43Å; S10-P14 WeakPolarHBondContact O-CD 3.32Å; S10-P14 WeakPolarHBondContact O-CG 3.33Å
11L58.9Low57.4Low60 Ų6097.5 Ų97.531%0.31457%0.569SS.*Hα-helixtrans-86.4-37.1173.9-97.971.1000112.6F7 L8 C9 V47F7-L11 HydrophobicContact CD1-CD1 3.98Å; F7-L11 HydrophobicContact CD1-CD2 4.42Å; F7-L11 HydrophobicContact CD2-CD1 4.48Å; F7-L11 HydrophobicContact CE1-CD1 3.71Å; F7-L11 HydrophobicContact CE1-CD2 3.93Å; F7-L11 HydrophobicContact CE2-CD1 4.24Å; F7-L11 HydrophobicContact CG-CD1 4.36Å; F7-L11 HydrophobicContact CZ-CD1 3.85Å; F7-L11 WeakPolarHBondContact O-CB 3.03Å; F7-L11 WeakPolarHBondContact O-CD1 3.32Å; F7-L11 PolarHBondContact O-N 3.07Å; L8-L11 PolarHBondContact O-N 3.03Å; C9-L11 VanDerWaalsContact C-N 3.31Å; C9-L11 PolarHBondContact O-N 2.96Å; L11-V47 HydrophobicContact CD2-CB 4.35Å; L11-V47 HydrophobicContact CD2-CG1 3.98Å; L11-V47 HydrophobicContact CD2-CG2 3.59Å; L11-V47 HydrophobicContact CG-CG2 4.48Å
12L57.8Low57.8Low85 Ų8592.2 Ų92.245%0.44554%0.542SS..Hα-helixtrans-75.6-34.5179-91.1124.7000111.9L8 M15 V16L8-L12 HydrophobicContact CB-CD1 4.12Å; L8-L12 HydrophobicContact CD2-CD1 3.73Å; L8-L12 VanDerWaalsContact O-CB 3.25Å; L8-L12 WeakPolarHBondContact O-CB 3.39Å; L8-L12 VanDerWaalsContact O-CD1 3.26Å; L8-L12 WeakPolarHBondContact O-CD1 3.39Å; L8-L12 PolarHBondContact O-N 3.34Å; L12-M15 PolarHBondContact O-N 3.4Å; L12-V16 WeakPolarHBondContact O-CB 3.34Å; L12-V16 WeakPolarHBondContact O-CG2 3.27Å; L12-V16 PolarHBondContact O-N 3.2Å
13A66.6Low57.9Low60 Ų6093.4 Ų93.450%0.49654%0.544SS..Hα-helixtrans-63.3-46.1-177.900000113.2C9 L17C9-A13 WeakPolarHBondContact O-CB 3.39Å; C9-A13 PolarHBondContact O-N 3.17Å; A13-L17 WeakPolarHBondContact O-CB 3.44Å; A13-L17 PolarHBondContact O-N 3.43Å
14P61.6Low58Low78 Ų7895.2 Ų95.251%0.50655%0.548SS..Hα-helixtrans-66.9-35.5173.7-1830.9000112.5S10 A18S10-P14 WeakPolarHBondContact O-CD 3.32Å; S10-P14 WeakPolarHBondContact O-CG 3.33Å; P14-A18 WeakPolarHBondContact O-CB 3.36Å; P14-A18 PolarHBondContact O-N 3.24Å
15M60.3Low57.8Low98 Ų9897.9 Ų97.948%0.48355%0.552SS.*Hα-helixtrans-66.6-44178.2-175-170.2-10100111.6L12 S19 V43L12-M15 PolarHBondContact O-N 3.4Å; M15-S19 VanDerWaalsContact O-CB 3.26Å; M15-S19 WeakPolarHBondContact O-CB 3.31Å; M15-S19 PolarHBondContact O-N 2.95Å; M15-S19 PolarHBondContact O-OG 3.06Å; M15-V43 HydrophobicContact CE-CG1 4.44Å
16V64.2Low57.9Low82 Ų82101.3 Ų101.350%0.49757%0.565SS.*Hα-helixtrans-68.7-43.5177.5172.50000110.3L12 S19 A20L12-V16 WeakPolarHBondContact O-CB 3.34Å; L12-V16 WeakPolarHBondContact O-CG2 3.27Å; L12-V16 PolarHBondContact O-N 3.2Å; V16-S19 WeakPolarHBondContact CA-OG 3.33Å; V16-S19 PolarHBondContact O-N 3.39Å; V16-S19 PolarHBondContact O-OG 3.37Å; V16-A20 VanDerWaalsContact O-CB 3.27Å; V16-A20 WeakPolarHBondContact O-CB 3.39Å; V16-A20 PolarHBondContact O-N 3.04Å
17L60Low57.5Low132 Ų132103.7 Ų103.769%0.69157%0.572SS**Hα-helixtrans-67-39.1179.2-167.564.2000112.1A13 A20 A21A13-L17 WeakPolarHBondContact O-CB 3.44Å; A13-L17 PolarHBondContact O-N 3.43Å; L17-A20 PolarHBondContact O-N 2.9Å; L17-A21 WeakPolarHBondContact O-CB 3.21Å; L17-A21 PolarHBondContact O-N 2.78Å; L17-A21 VanDerWaalsContact O-N 3.15Å
18A56.1Low57.3Low59 Ų59103.3 Ų103.349%0.48858%0.575SS.*Hα-helixtrans-68.4-38.1172.700000112.1P14 A20 A21P14-A18 WeakPolarHBondContact O-CB 3.36Å; P14-A18 PolarHBondContact O-N 3.24Å; A18-A20 VanDerWaalsContact C-N 3.31Å; A18-A20 PolarHBondContact O-N 3.05Å; A18-A21 PolarHBondContact O-N 2.89Å
19S55.9Low57.8Low82 Ų82104.1 Ų104.157%0.57359%0.586SS**Hα-helixtrans-71.4-26.1176.676.20000113.4M15 V16M15-S19 VanDerWaalsContact O-CB 3.26Å; M15-S19 WeakPolarHBondContact O-CB 3.31Å; M15-S19 PolarHBondContact O-N 2.95Å; M15-S19 PolarHBondContact O-OG 3.06Å; V16-S19 WeakPolarHBondContact CA-OG 3.33Å; V16-S19 PolarHBondContact O-N 3.39Å; V16-S19 PolarHBondContact O-OG 3.37Å
20A52.5Low57.7Low71 Ų71109.5 Ų109.559%0.58760%0.601SS**Hα-helixtrans-81.2-27177.600000112.3V16 L17 A18V16-A20 VanDerWaalsContact O-CB 3.27Å; V16-A20 WeakPolarHBondContact O-CB 3.39Å; V16-A20 PolarHBondContact O-N 3.04Å; L17-A20 PolarHBondContact O-N 2.9Å; A18-A20 VanDerWaalsContact C-N 3.31Å; A18-A20 PolarHBondContact O-N 3.05Å
21A50.6Low57.5Low75 Ų75112.9 Ų112.962%0.6261%0.609SS**Hα-helixtrans-82.3-20.2-177.500000114.4L17 A18L17-A21 WeakPolarHBondContact O-CB 3.21Å; L17-A21 PolarHBondContact O-N 2.78Å; L17-A21 VanDerWaalsContact O-N 3.15Å; A18-A21 PolarHBondContact O-N 2.89Å
22E53.3Low57.8Low99 Ų99118.4 Ų118.446%0.46363%0.627SS.*THydrogen-bonded Turntrans-100.412.1-176.2-59.7-66.4156.300113.7K25E22-K25 IonicContact OE2-NZ 3.92Å
23K47.2Very low58.2Low189 Ų189117.6 Ų117.682%0.82262%0.623SS**SBendtrans-97.327.5-176.2-146-164.9-179.8-176.50114.8
24E52.6Low58.6Low189 Ų189120.8 Ų120.888%0.88362%0.623SS**  trans-144.356.4172.6-103.3-168165.200110.6
25K50.1Low59.1Low148 Ų148123.5 Ų123.564%0.64363%0.629SS**SBendtrans-132.3118.4159.3-67.3-178.3-170.9152.90108.3E22 M27E22-K25 IonicContact OE2-NZ 3.92Å; K25-M27 WeakPolarHBondContact O-CE 3.22Å; K25-M27 PolarHBondContact O-N 3.12Å
26E56.6Low59.6Low191 Ų191122.1 Ų122.189%0.89363%0.626SS**  trans-34.2107.5169.9-169175.1167.300110.5D28E26-D28 VanDerWaalsContact C-N 3.26Å; E26-D28 PolarHBondContact O-N 2.84Å
27M53.3Low60.2Low136 Ų136123.8 Ų123.867%0.6763%0.632SS**  trans-74.186.4176.8-71.1-76.6119.100107.5K25 P29K25-M27 WeakPolarHBondContact O-CE 3.22Å; K25-M27 PolarHBondContact O-N 3.12Å; M27-P29 WeakPolarHBondContact O-CD 3.28Å
28D58Low61Low97 Ų97126.4 Ų126.452%0.51963%0.632SS.*  trans-54.8122.6168.4-166.3-22.6000107.9E26 F30 H31E26-D28 VanDerWaalsContact C-N 3.26Å; E26-D28 PolarHBondContact O-N 2.84Å; D28-F30 PolarHBondContact O-N 2.96Å; D28-H31 HydrophobicContact CB-CB 4.49Å; D28-H31 PolarHBondContact O-N 3.33Å
29P69.6Low62Low109 Ų109127.9 Ų127.971%0.70863%0.631SS**THydrogen-bonded Turntrans-54-14.4-174.9-28.435000115.2M27M27-P29 WeakPolarHBondContact O-CD 3.28Å
30F58.7Low63Low188 Ų188126 Ų12683%0.82562%0.624SS**THydrogen-bonded Turntrans-104.11.9-178.6-64.1-79000115D28D28-F30 PolarHBondContact O-N 2.96Å
31H63.3Low64Low142 Ų142124.6 Ų124.666%0.65762%0.617SS**  trans-121.798.7-178.5-152.572.6000112.8D28D28-H31 HydrophobicContact CB-CB 4.49Å; D28-H31 PolarHBondContact O-N 3.33Å
32Y64.8Low65.2Low177 Ų177126.8 Ų126.869%0.69462%0.617SS**  trans-84.3123.7173.3-90.1-86.6000111.4Y34Y32-Y34 WeakPolarHBondContact O-CD2 3.22Å; Y32-Y34 PolarHBondContact O-N 3.42Å
33D67.6Low66.4Low68 Ų68125.2 Ų125.236%0.36461%0.614SS.*  trans-84.376.9-175.3-163.18.1000112.5Q35 T36 L37D33-Q35 PolarHBondContact O-N 2.78Å; D33-Q35 WeakPolarHBondContact OD1-CB 3.44Å; D33-T36 PolarHBondContact O-N 3.48Å; D33-T36 PolarHBondContact OD2-OG1 3.41Å; D33-L37 PolarHBondContact O-N 2.92Å
34Y75.4Confident67.7Low127 Ų127122.1 Ų122.150%0.49860%0.601SS.*Hα-helixtrans-67.1-18.6177.8-64.8-79.5000113.4Y32 R38Y32-Y34 WeakPolarHBondContact O-CD2 3.22Å; Y32-Y34 PolarHBondContact O-N 3.42Å; Y34-R38 VanDerWaalsContact O-CB 3.3Å; Y34-R38 WeakPolarHBondContact O-CB 3.35Å; Y34-R38 WeakPolarHBondContact O-CG 3.5Å; Y34-R38 PolarHBondContact O-N 3.47Å
35Q70.3Confident68.7Low135 Ų135115.6 Ų115.663%0.63158%0.58SS**Hα-helixtrans-61.1-55.3175.3-101.4-96.9-4.400109.5D33 L37 R38 I39D33-Q35 PolarHBondContact O-N 2.78Å; D33-Q35 WeakPolarHBondContact OD1-CB 3.44Å; Q35-L37 VanDerWaalsContact C-N 3.33Å; Q35-L37 PolarHBondContact O-N 3.22Å; Q35-R38 PolarHBondContact O-N 2.93Å; Q35-I39 WeakPolarHBondContact O-CB 3.37Å; Q35-I39 VanDerWaalsContact O-CD1 3.32Å; Q35-I39 WeakPolarHBondContact O-CD1 3.25Å; Q35-I39 VanDerWaalsContact O-CG1 3.26Å; Q35-I39 WeakPolarHBondContact O-CG1 3.36Å; Q35-I39 PolarHBondContact O-N 3.49Å
36T70.9Confident70.2Confident69 Ų69113.1 Ų113.142%0.42358%0.577SS.*Hα-helixtrans-61.9-40.8178.3-58.10000111.7D33 R38 I39 G40D33-T36 PolarHBondContact O-N 3.48Å; D33-T36 PolarHBondContact OD2-OG1 3.41Å; T36-R38 PolarHBondContact O-N 3.44Å; T36-I39 PolarHBondContact O-N 2.93Å; T36-G40 PolarHBondContact O-N 3.44Å
37L77.8Confident71.2Confident117 Ų117106 Ų10661%0.61355%0.546SS*.Hα-helixtrans-64.3-40.9177.5-170.865.2000112.6D33 Q35 G41D33-L37 PolarHBondContact O-N 2.92Å; Q35-L37 VanDerWaalsContact C-N 3.33Å; Q35-L37 PolarHBondContact O-N 3.22Å; L37-G41 PolarHBondContact O-N 2.93Å
38R76.8Confident72.2Confident186 Ų186103.7 Ų103.770%0.70254%0.536SS*.Hα-helixtrans-67-45.3176.5-76.9172.7-179.3-168.21.9111.5Y34 Q35 T36 G40 G41 L42Y34-R38 VanDerWaalsContact O-CB 3.3Å; Y34-R38 WeakPolarHBondContact O-CB 3.35Å; Y34-R38 WeakPolarHBondContact O-CG 3.5Å; Y34-R38 PolarHBondContact O-N 3.47Å; Q35-R38 PolarHBondContact O-N 2.93Å; T36-R38 PolarHBondContact O-N 3.44Å; R38-G40 VanDerWaalsContact C-N 3.34Å; R38-G41 PolarHBondContact O-N 3.44Å; R38-L42 WeakPolarHBondContact O-CB 3.5Å; R38-L42 VanDerWaalsContact O-CG 3.32Å; R38-L42 WeakPolarHBondContact O-CG 3.38Å; R38-L42 PolarHBondContact O-N 3.35Å
39I76.7Confident73.3Confident91 Ų91106 Ų10647%0.46754%0.542SS..Hα-helixtrans-62.1-45.5177.9-68.4157.9000109.8Q35 T36 G41 L42 V43Q35-I39 WeakPolarHBondContact O-CB 3.37Å; Q35-I39 VanDerWaalsContact O-CD1 3.32Å; Q35-I39 WeakPolarHBondContact O-CD1 3.25Å; Q35-I39 VanDerWaalsContact O-CG1 3.26Å; Q35-I39 WeakPolarHBondContact O-CG1 3.36Å; Q35-I39 PolarHBondContact O-N 3.49Å; T36-I39 PolarHBondContact O-N 2.93Å; I39-G41 PolarHBondContact O-N 3.43Å; I39-L42 PolarHBondContact O-N 2.94Å; I39-V43 HydrophobicContact CG2-CG2 4.47Å; I39-V43 WeakPolarHBondContact O-CB 3.37Å; I39-V43 VanDerWaalsContact O-CG2 3.25Å; I39-V43 WeakPolarHBondContact O-CG2 3.46Å; I39-V43 PolarHBondContact O-N 3Å
40G76.1Confident73.6Confident42 Ų42102.7 Ų102.743%0.43352%0.521SS..Hα-helixtrans-59.9-44.2175.300000112.8T36 R38 F44T36-G40 PolarHBondContact O-N 3.44Å; R38-G40 VanDerWaalsContact C-N 3.34Å; G40-F44 VanDerWaalsContact O-CB 3.26Å; G40-F44 WeakPolarHBondContact O-CB 3.49Å; G40-F44 PolarHBondContact O-N 3.47Å
41G75.4Confident74.3Confident41 Ų4196.9 Ų96.942%0.42350%0.501SS..Hα-helixtrans-64-42.3176.900000113.5L37 R38 I39 F44 A45L37-G41 PolarHBondContact O-N 2.93Å; R38-G41 PolarHBondContact O-N 3.44Å; I39-G41 PolarHBondContact O-N 3.43Å; G41-F44 PolarHBondContact O-N 3.36Å; G41-A45 WeakPolarHBondContact O-CB 3.23Å; G41-A45 PolarHBondContact O-N 3.35Å
42L74.6Confident75Confident121 Ų12191.5 Ų91.563%0.63448%0.484SS*.Hα-helixtrans-66.5-44.4177.5-71.9173.6000111.8R38 I39 A45 V46R38-L42 WeakPolarHBondContact O-CB 3.5Å; R38-L42 VanDerWaalsContact O-CG 3.32Å; R38-L42 WeakPolarHBondContact O-CG 3.38Å; R38-L42 PolarHBondContact O-N 3.35Å; I39-L42 PolarHBondContact O-N 2.94Å; L42-A45 PolarHBondContact O-N 3.11Å; L42-V46 WeakPolarHBondContact O-CG2 3.34Å; L42-V46 PolarHBondContact O-N 3.07Å
43V78.7Confident75.6Confident66 Ų6686.2 Ų86.240%0.447%0.467SS..Hα-helixtrans-60.5-48.7175.5171.80000109.8M15 I39 A45 V46 V47M15-V43 HydrophobicContact CE-CG1 4.44Å; I39-V43 HydrophobicContact CG2-CG2 4.47Å; I39-V43 WeakPolarHBondContact O-CB 3.37Å; I39-V43 VanDerWaalsContact O-CG2 3.25Å; I39-V43 WeakPolarHBondContact O-CG2 3.46Å; I39-V43 PolarHBondContact O-N 3Å; V43-A45 VanDerWaalsContact C-N 3.33Å; V43-A45 PolarHBondContact O-N 3.17Å; V43-V46 PolarHBondContact O-N 3.1Å; V43-V47 HydrophobicContact CG1-CG2 4.38Å; V43-V47 VanDerWaalsContact O-CG2 3.28Å; V43-V47 WeakPolarHBondContact O-CG2 3.18Å; V43-V47 PolarHBondContact O-N 2.99Å
44F73.5Confident75.6Confident124 Ų12487.8 Ų87.854%0.54448%0.475SS..Hα-helixtrans-59-43178.1-174.1-108.8000112.4G40 G41 V47 L48G40-F44 VanDerWaalsContact O-CB 3.26Å; G40-F44 WeakPolarHBondContact O-CB 3.49Å; G40-F44 PolarHBondContact O-N 3.47Å; G41-F44 PolarHBondContact O-N 3.36Å; F44-V47 PolarHBondContact O-N 3.27Å; F44-L48 HydrophobicContact CD1-CD1 3.81Å; F44-L48 HydrophobicContact CD1-CG 4.35Å; F44-L48 HydrophobicContact CE1-CD1 3.24Å; F44-L48 HydrophobicContact CE1-CG 4.05Å; F44-L48 HydrophobicContact CE2-CD1 4.24Å; F44-L48 HydrophobicContact CE2-CD2 4.43Å; F44-L48 HydrophobicContact CE2-CG 4.26Å; F44-L48 HydrophobicContact CZ-CD1 3.5Å; F44-L48 HydrophobicContact CZ-CD2 4.27Å; F44-L48 HydrophobicContact CZ-CG 4Å; F44-L48 WeakPolarHBondContact O-CG 3.37Å; F44-L48 PolarHBondContact O-N 2.96Å
45A74.5Confident75.1Confident53 Ų5385.5 Ų85.544%0.43847%0.471SS..Hα-helixtrans-61.4-45.6176.200000112.5G41 L42 V43 V47 L48 F49G41-A45 WeakPolarHBondContact O-CB 3.23Å; G41-A45 PolarHBondContact O-N 3.35Å; L42-A45 PolarHBondContact O-N 3.11Å; V43-A45 VanDerWaalsContact C-N 3.33Å; V43-A45 PolarHBondContact O-N 3.17Å; A45-V47 VanDerWaalsContact C-N 3.34Å; A45-V47 PolarHBondContact O-N 3.37Å; A45-L48 PolarHBondContact O-N 2.91Å; A45-F49 WeakPolarHBondContact O-CB 3.19Å; A45-F49 PolarHBondContact O-N 2.94Å
46V81.7Confident75Confident96 Ų9683.2 Ų83.258%0.58246%0.462SS*.Hα-helixtrans-63.6-40.1177.4172.30000111.4L42 V43 F49 S50L42-V46 WeakPolarHBondContact O-CG2 3.34Å; L42-V46 PolarHBondContact O-N 3.07Å; V43-V46 PolarHBondContact O-N 3.1Å; V46-F49 PolarHBondContact O-N 3.28Å; V46-S50 VanDerWaalsContact O-CB 3.29Å; V46-S50 WeakPolarHBondContact O-CB 3.09Å; V46-S50 PolarHBondContact O-N 2.86Å; V46-S50 PolarHBondContact O-OG 3.34Å
47V77.5Confident74.4Confident41 Ų4184.4 Ų84.425%0.24847%0.466CS..Hα-helixtrans-65.4-48.5177.5175.20000110.9L11 V43 F44 A45 F49 S50 V51L11-V47 HydrophobicContact CD2-CB 4.35Å; L11-V47 HydrophobicContact CD2-CG1 3.98Å; L11-V47 HydrophobicContact CD2-CG2 3.59Å; L11-V47 HydrophobicContact CG-CG2 4.48Å; V43-V47 HydrophobicContact CG1-CG2 4.38Å; V43-V47 VanDerWaalsContact O-CG2 3.28Å; V43-V47 WeakPolarHBondContact O-CG2 3.18Å; V43-V47 PolarHBondContact O-N 2.99Å; F44-V47 PolarHBondContact O-N 3.27Å; A45-V47 VanDerWaalsContact C-N 3.34Å; A45-V47 PolarHBondContact O-N 3.37Å; V47-F49 VanDerWaalsContact C-N 3.34Å; V47-F49 PolarHBondContact O-N 2.9Å; V47-S50 PolarHBondContact O-N 3.27Å; V47-S50 PolarHBondContact O-OG 3Å; V47-V51 HydrophobicContact CG1-CG2 4.44Å; V47-V51 WeakPolarHBondContact O-CB 3.45Å; V47-V51 VanDerWaalsContact O-CG2 3.26Å; V47-V51 WeakPolarHBondContact O-CG2 3.35Å; V47-V51 PolarHBondContact O-N 2.79Å
48L74.5Confident73.1Confident87 Ų8781.6 Ų81.646%0.45546%0.456SS..Hα-helixtrans-63.7-39.5177.8-71.4-174.5000112.5F44 A45 G52F44-L48 HydrophobicContact CD1-CD1 3.81Å; F44-L48 HydrophobicContact CD1-CG 4.35Å; F44-L48 HydrophobicContact CE1-CD1 3.24Å; F44-L48 HydrophobicContact CE1-CG 4.05Å; F44-L48 HydrophobicContact CE2-CD1 4.24Å; F44-L48 HydrophobicContact CE2-CD2 4.43Å; F44-L48 HydrophobicContact CE2-CG 4.26Å; F44-L48 HydrophobicContact CZ-CD1 3.5Å; F44-L48 HydrophobicContact CZ-CD2 4.27Å; F44-L48 HydrophobicContact CZ-CG 4Å; F44-L48 WeakPolarHBondContact O-CG 3.37Å; F44-L48 PolarHBondContact O-N 2.96Å; A45-L48 PolarHBondContact O-N 2.91Å; L48-G52 PolarHBondContact O-N 3.28Å
49F82Confident71.9Confident147 Ų14777.1 Ų77.165%0.64544%0.439SS*.Hα-helixtrans-67.3-44.8178.8-170.1-110.1000111.9A45 V46 V47 G52 I53A45-F49 WeakPolarHBondContact O-CB 3.19Å; A45-F49 PolarHBondContact O-N 2.94Å; V46-F49 PolarHBondContact O-N 3.28Å; V47-F49 VanDerWaalsContact C-N 3.34Å; V47-F49 PolarHBondContact O-N 2.9Å; F49-G52 PolarHBondContact O-N 2.82Å; F49-I53 HydrophobicContact CD1-CD1 3.57Å; F49-I53 HydrophobicContact CD2-CD1 4.48Å; F49-I53 HydrophobicContact CE1-CD1 3.18Å; F49-I53 HydrophobicContact CE1-CG1 4.35Å; F49-I53 HydrophobicContact CE2-CD1 4.16Å; F49-I53 HydrophobicContact CG-CD1 4.22Å; F49-I53 HydrophobicContact CZ-CD1 3.53Å; F49-I53 HydrophobicContact CZ-CG1 4.42Å; F49-I53 WeakPolarHBondContact O-CB 3.26Å; F49-I53 WeakPolarHBondContact O-CG1 3.42Å; F49-I53 PolarHBondContact O-N 3.27Å
50S74Confident70.7Confident38 Ų3880.8 Ų80.827%0.26645%0.447SS..Hα-helixtrans-64.7-44.4176.860.50000111.5V46 V47 G52 I53 L54V46-S50 VanDerWaalsContact O-CB 3.29Å; V46-S50 WeakPolarHBondContact O-CB 3.09Å; V46-S50 PolarHBondContact O-N 2.86Å; V46-S50 PolarHBondContact O-OG 3.34Å; V47-S50 PolarHBondContact O-N 3.27Å; V47-S50 PolarHBondContact O-OG 3Å; S50-G52 PolarHBondContact O-N 3.18Å; S50-I53 PolarHBondContact O-N 2.75Å; S50-L54 WeakPolarHBondContact O-CB 3.29Å; S50-L54 PolarHBondContact O-N 2.85Å
51V74.3Confident69.1Low66 Ų6682.9 Ų82.940%0.445%0.454SS..Hα-helixtrans-62.1-42.6174.1173.40000111.1V47 L54 L55V47-V51 HydrophobicContact CG1-CG2 4.44Å; V47-V51 WeakPolarHBondContact O-CB 3.45Å; V47-V51 VanDerWaalsContact O-CG2 3.26Å; V47-V51 WeakPolarHBondContact O-CG2 3.35Å; V47-V51 PolarHBondContact O-N 2.79Å; V51-L54 PolarHBondContact O-N 3.4Å; V51-L55 HydrophobicContact CG1-CD1 3.91Å; V51-L55 HydrophobicContact CG1-CG 4.28Å; V51-L55 WeakPolarHBondContact O-CB 3.41Å; V51-L55 WeakPolarHBondContact O-CG 3.17Å; V51-L55 PolarHBondContact O-N 2.79Å
52G78.3Confident67.5Low30 Ų3090.2 Ų90.231%0.30947%0.474SS..Hα-helixtrans-59.6-49176.100000112.7L48 F49 S50 L55 I56L48-G52 PolarHBondContact O-N 3.28Å; F49-G52 PolarHBondContact O-N 2.82Å; S50-G52 PolarHBondContact O-N 3.18Å; G52-L55 PolarHBondContact O-N 3.31Å; G52-I56 WeakPolarHBondContact O-CD1 3.34Å; G52-I56 VanDerWaalsContact O-CG1 3.25Å; G52-I56 WeakPolarHBondContact O-CG1 3.49Å; G52-I56 PolarHBondContact O-N 3.05Å
53I76.4Confident66Low66 Ų6687.8 Ų87.834%0.33847%0.466SS..Hα-helixtrans-64.1-46.8175.8-68.9173.1000110.7F49 S50 L55 I56 L57F49-I53 HydrophobicContact CD1-CD1 3.57Å; F49-I53 HydrophobicContact CD2-CD1 4.48Å; F49-I53 HydrophobicContact CE1-CD1 3.18Å; F49-I53 HydrophobicContact CE1-CG1 4.35Å; F49-I53 HydrophobicContact CE2-CD1 4.16Å; F49-I53 HydrophobicContact CG-CD1 4.22Å; F49-I53 HydrophobicContact CZ-CD1 3.53Å; F49-I53 HydrophobicContact CZ-CG1 4.42Å; F49-I53 WeakPolarHBondContact O-CB 3.26Å; F49-I53 WeakPolarHBondContact O-CG1 3.42Å; F49-I53 PolarHBondContact O-N 3.27Å; S50-I53 PolarHBondContact O-N 2.75Å; I53-L55 VanDerWaalsContact C-N 3.26Å; I53-L55 PolarHBondContact O-N 3.44Å; I53-I56 CarbonylContact O-C 3.6Å; I53-I56 WeakPolarHBondContact O-CB 3.32Å; I53-I56 PolarHBondContact O-N 3.07Å; I53-L57 HydrophobicContact CG2-CD1 3.62Å; I53-L57 HydrophobicContact CG2-CG 3.96Å; I53-L57 WeakPolarHBondContact O-CB 3.1Å; I53-L57 WeakPolarHBondContact O-CG 3.18Å; I53-L57 PolarHBondContact O-N 3.32Å
54L67.8Low64.4Low100 Ų10089.1 Ų89.152%0.52448%0.479SS..Hα-helixtrans-62-35.7-178.7-155101.8000111.3S50 V51 S58S50-L54 WeakPolarHBondContact O-CB 3.29Å; S50-L54 PolarHBondContact O-N 2.85Å; V51-L54 PolarHBondContact O-N 3.4Å; L54-S58 WeakPolarHBondContact O-CB 3.1Å; L54-S58 PolarHBondContact O-N 3.45Å; L54-S58 PolarHBondContact O-OG 2.88Å
55L65.2Low63Low79 Ų7992.5 Ų92.541%0.41449%0.493SS..Hα-helixtrans-70.2-35.7173.5-72.9176.2000112.7V51 G52 I53 R59V51-L55 HydrophobicContact CG1-CD1 3.91Å; V51-L55 HydrophobicContact CG1-CG 4.28Å; V51-L55 WeakPolarHBondContact O-CB 3.41Å; V51-L55 WeakPolarHBondContact O-CG 3.17Å; V51-L55 PolarHBondContact O-N 2.79Å; G52-L55 PolarHBondContact O-N 3.31Å; I53-L55 VanDerWaalsContact C-N 3.26Å; I53-L55 PolarHBondContact O-N 3.44Å; L55-R59 WeakPolarHBondContact O-CB 3.3Å; L55-R59 WeakPolarHBondContact O-CD 3.32Å; L55-R59 WeakPolarHBondContact O-CG 3.19Å; L55-R59 PolarHBondContact O-N 3.01Å
56I67.6Low61.4Low88 Ų8897.4 Ų97.445%0.45151%0.512SS..Hα-helixtrans-67.9-48.5173.8-67.2162.7000110.2G52 I53 R59 R60G52-I56 WeakPolarHBondContact O-CD1 3.34Å; G52-I56 VanDerWaalsContact O-CG1 3.25Å; G52-I56 WeakPolarHBondContact O-CG1 3.49Å; G52-I56 PolarHBondContact O-N 3.05Å; I53-I56 CarbonylContact O-C 3.6Å; I53-I56 WeakPolarHBondContact O-CB 3.32Å; I53-I56 PolarHBondContact O-N 3.07Å; I56-R59 PolarHBondContact O-N 3.01Å; I56-R60 WeakPolarHBondContact O-CG 3.25Å; I56-R60 PolarHBondContact O-N 3.31Å
57L58.6Low59.7Low94 Ų94100.3 Ų100.349%0.49252%0.52SS..Hα-helixtrans-66.3-43.6179.5-67.4179.8000111.7I53 R59 R60 C61I53-L57 HydrophobicContact CG2-CD1 3.62Å; I53-L57 HydrophobicContact CG2-CG 3.96Å; I53-L57 WeakPolarHBondContact O-CB 3.1Å; I53-L57 WeakPolarHBondContact O-CG 3.18Å; I53-L57 PolarHBondContact O-N 3.32Å; L57-R59 PolarHBondContact O-N 3.18Å; L57-R60 CarbonylContact O-C 3.6Å; L57-R60 PolarHBondContact O-N 3.32Å; L57-C61 WeakPolarHBondContact O-CB 3.47Å; L57-C61 PolarHBondContact O-N 3.06Å; L57-C61 PolarHBondContact O-SG 3.31Å
58S50.6Low57.8Low58 Ų58107.7 Ų107.741%0.40655%0.548SS..Hα-helixtrans-60-31.4176.8-64.70000112.4L54 K62L54-S58 WeakPolarHBondContact O-CB 3.1Å; L54-S58 PolarHBondContact O-N 3.45Å; L54-S58 PolarHBondContact O-OG 2.88Å; S58-K62 WeakPolarHBondContact O-CB 3.28Å; S58-K62 PolarHBondContact O-N 3.45Å
59R52.4Low56.3Low91 Ų91109.1 Ų109.134%0.34356%0.563SS.*Hα-helixtrans-78.2-32.8174.3-69.8173.1-173.3-148.58.5112.6L55 I56 L57 L123L55-R59 WeakPolarHBondContact O-CB 3.3Å; L55-R59 WeakPolarHBondContact O-CD 3.32Å; L55-R59 WeakPolarHBondContact O-CG 3.19Å; L55-R59 PolarHBondContact O-N 3.01Å; I56-R59 PolarHBondContact O-N 3.01Å; L57-R59 PolarHBondContact O-N 3.18Å; R59-L123 PolarHBondContact NH1-O 3.4Å; R59-L123 VanDerWaalsContact NH1-O 3.11Å
60R50.1Low54.4Low168 Ų168113.7 Ų113.763%0.63458%0.576SS**Hα-helixtrans-71.6-36.7171.7-68.5-67.9-160.1175.67.9112.1I56 L57 C63I56-R60 WeakPolarHBondContact O-CG 3.25Å; I56-R60 PolarHBondContact O-N 3.31Å; L57-R60 CarbonylContact O-C 3.6Å; L57-R60 PolarHBondContact O-N 3.32Å; R60-C63 PolarHBondContact O-N 2.8Å
61C42.8Very low52.7Low87 Ų87119.4 Ų119.459%0.58860%0.603SS**Hα-helixtrans-79.4-30.7-178.9-620000112.9L57 C63 S64L57-C61 WeakPolarHBondContact O-CB 3.47Å; L57-C61 PolarHBondContact O-N 3.06Å; L57-C61 PolarHBondContact O-SG 3.31Å; C61-C63 PolarHBondContact O-N 2.95Å; C61-S64 PolarHBondContact O-N 2.87Å
62K42.3Very low50.8Low195 Ų195127.8 Ų127.885%0.84863%0.628SS**THydrogen-bonded Turntrans-69.2-13.5170.3-97.2-172.8161.4900114.1S58S58-K62 WeakPolarHBondContact O-CB 3.28Å; S58-K62 PolarHBondContact O-N 3.45Å
63C42.9Very low48.5Very low69 Ų69130.6 Ų130.647%0.46665%0.648SS.*THydrogen-bonded Turntrans-97.66.6174.3-67.70000113.8R60 C61 Q67R60-C63 PolarHBondContact O-N 2.8Å; C61-C63 PolarHBondContact O-N 2.95Å; C63-Q67 PolarHBondContact O-NE2 3.38Å; C63-Q67 VanDerWaalsContact O-NE2 3.12Å
64S45.9Very low46.9Very low94 Ų94133.7 Ų133.766%0.65767%0.672SS**SBendtrans-106.2-0.5-168.9-171.60000116C61C61-S64 PolarHBondContact O-N 2.87Å
65F44Very low45.6Very low195 Ų195136.8 Ų136.886%0.85568%0.684SS**SBendtrans-102.79-176.5-156.4-102.6000115.3
66N41.3Very low44.7Very low157 Ų157137.1 Ų137.184%0.8469%0.693SS**SBendtrans-155.133.8175.7-109.6-46.3000114.8
67Q46.2Very low43.4Very low157 Ų157144.1 Ų144.173%0.73471%0.714SS**  trans-104.893.9168.4-68.5-16875.300109.2C63C63-Q67 PolarHBondContact O-NE2 3.38Å; C63-Q67 VanDerWaalsContact O-NE2 3.12Å
68K37.2Very low42.7Very low195 Ų195147.9 Ų147.985%0.84873%0.729SS**  trans-48.1131159.5-160.4167.5-172.3-1730107.4R70K68-R70 PolarHBondContact O-N 2.97Å
69P42.4Very low41.8Very low118 Ų118152.9 Ų152.977%0.76675%0.751SS**  trans-67.3113.5-172.226.8-32.1000108.1
70R41.3Very low40.9Very low242 Ų242157.1 Ų157.191%0.91377%0.772SS**  trans-116.599.3164.9-140.1-179.1176.6178.4-1.3108.2K68 R72K68-R70 PolarHBondContact O-N 2.97Å; R70-R72 PolarHBondContact O-N 2.83Å
71N39.2Very low39.8Very low158 Ų158154.8 Ų154.885%0.84578%0.779SS**  trans-13.6111.3159.7-57.3-23.6000113.2
72R33.7Very low39.3Very low243 Ų243156.1 Ų156.192%0.91779%0.79SS**  trans-153.6112.9150-120.8179.3-158145.14.3108.8R70R70-R72 PolarHBondContact O-N 2.83Å
73A30.7Very low38.9Very low89 Ų89154.5 Ų154.574%0.73679%0.785SS**  trans-50.3144.2167.800000110.5E75A73-E75 PolarHBondContact O-N 2.98Å
74P42.8Very low38.5Very low130 Ų130159.6 Ų159.684%0.84480%0.802SS**  trans-78.9104.5174.631.1-28000108.3S76P74-S76 PolarHBondContact O-N 2.91Å
75E40.9Very low38.2Very low165 Ų165160.9 Ų160.977%0.77181%0.806SS**  trans-65.8122.5163.9-170.2-150.9133.600108.3A73 R77A73-E75 PolarHBondContact O-N 2.98Å; E75-R77 PolarHBondContact O-N 3.37Å
76S45Very low38Very low87 Ų87160.4 Ų160.461%0.60881%0.806SS**  trans-31.9117.6168.245.20000114P74P74-S76 PolarHBondContact O-N 2.91Å
77R42.3Very low38Very low234 Ų234156.4 Ų156.488%0.88380%0.802SS**  trans-11779.6151.1-70.8-168.9179.1-178-1108.7E75 L79E75-R77 PolarHBondContact O-N 3.37Å; R77-L79 PolarHBondContact O-N 3.33Å; R77-L79 VanDerWaalsContact O-N 3.13Å
78E42.3Very low37.8Very low173 Ų173152.3 Ų152.381%0.80880%0.802SS**  trans-43.6107.4149.2-70.1-90.8105.700108.3
79L32.1Very low38.2Very low164 Ų164148.1 Ų148.186%0.85980%0.797SS**  trans-110.686.9162.6-160.496.8000106.9R77R77-L79 PolarHBondContact O-N 3.33Å; R77-L79 VanDerWaalsContact O-N 3.13Å
80K34.1Very low38.9Very low180 Ų180148.2 Ų148.278%0.78380%0.798SS**  trans-76.2116.4168-160.1176.9-170.8175.20107.5
81C27.4Very low39.2Very low118 Ų118146.4 Ų146.480%0.79780%0.796SS**  trans-141.9100.3153.5-94.80000107.1H83C81-H83 PolarHBondContact O-N 3.46Å
82S32.4Very low40.3Very low116 Ų116142.3 Ų142.381%0.81179%0.791SS**  trans-61.6119159.4-81.30000107.7
83H33.8Very low41.4Very low161 Ų161138.6 Ų138.675%0.74579%0.79SS**  trans-94.6102.3160.1-172.3-89.3000106.3C81 V85C81-H83 PolarHBondContact O-N 3.46Å; H83-V85 PolarHBondContact O-N 3.5Å; H83-V85 VanDerWaalsContact O-N 3.11Å
84Q33.8Very low42.9Very low176 Ų176139.6 Ų139.682%0.82279%0.786SS**  trans-61.1113.9162.7-87.8179.2-28.800106.8E86Q84-E86 PolarHBondContact O-N 2.89Å
85V38.7Very low43.5Very low121 Ų121139.5 Ų139.573%0.73378%0.779SS**  trans-77.6100.2167.1-177.80000105.3H83 G87H83-V85 PolarHBondContact O-N 3.5Å; H83-V85 VanDerWaalsContact O-N 3.11Å; V85-G87 PolarHBondContact O-N 3.43Å; V85-G87 VanDerWaalsContact O-N 3.1Å
86E40.4Very low44.8Very low184 Ų184137.7 Ų137.786%0.8678%0.781SS**  trans-61.8111.2162.3-82.1-129126.500107.4Q84 G88Q84-E86 PolarHBondContact O-N 2.89Å; E86-G88 PolarHBondContact O-N 2.93Å
87G41.4Very low45.7Very low73 Ų73143.5 Ų143.575%0.75380%0.796SS**  trans-63.4104.5171.700000108.6V85 S89V85-G87 PolarHBondContact O-N 3.43Å; V85-G87 VanDerWaalsContact O-N 3.1Å; G87-S89 PolarHBondContact O-N 3.43Å; G87-S89 VanDerWaalsContact O-N 3.14Å
88G41.4Very low46.8Very low71 Ų71140.5 Ų140.573%0.73279%0.786SS**PPolyproline II helixtrans-58117173.800000109.9E86 P90E86-G88 PolarHBondContact O-N 2.93Å; G88-P90 WeakPolarHBondContact O-CD 3.26Å
89S46.4Very low47.9Very low107 Ų107139.7 Ų139.775%0.74878%0.776SS**PPolyproline II helixtrans-59.9121.3171.9-173.80000109G87 K91G87-S89 PolarHBondContact O-N 3.43Å; G87-S89 VanDerWaalsContact O-N 3.14Å; S89-K91 PolarHBondContact O-N 2.89Å; S89-K91 VanDerWaalsContact O-N 3.14Å
90P57.5Low49.8Very low120 Ų120135 Ų13578%0.77975%0.752SS**PPolyproline II helixtrans-64.1119.4174.423-28.2000108.4G88 G92G88-P90 WeakPolarHBondContact O-CD 3.26Å; P90-G92 PolarHBondContact O-N 2.89Å
91K47.3Very low51.9Low205 Ų205133.5 Ų133.589%0.89174%0.743SS**  trans-70.6101.1167.6-76.3-178.2175.4175.20106.4S89 D93S89-K91 PolarHBondContact O-N 2.89Å; S89-K91 VanDerWaalsContact O-N 3.14Å; K91-D93 PolarHBondContact O-N 3.23Å
92G61.4Low54Low71 Ų71133.1 Ų133.173%0.73273%0.729SS**  trans-69121.1174.900000110.2P90P90-G92 PolarHBondContact O-N 2.89Å
93D58.3Low56.1Low166 Ų166131.7 Ų131.789%0.88872%0.715SS**  trans-164.163.8133.5-148.32.3000108.3K91K91-D93 PolarHBondContact O-N 3.23Å
94V61.2Low58.3Low110 Ų110127.8 Ų127.867%0.66770%0.703SS**SBendtrans-130.1125.2178.1-105.60000108.3
95D56.1Low60.4Low128 Ų128125.7 Ų125.768%0.68469%0.687SS**  trans-50.4126.1179.4-74.2-47.3000110.4F97 Y98D95-F97 PolarHBondContact O-N 2.98Å; D95-Y98 PolarHBondContact O-N 3.48Å
96P67.1Low61.9Low126 Ų126123.4 Ų123.482%0.81867%0.671SS**THydrogen-bonded Turntrans-57.6-12-174.6-27.934.6000115.7
97F65.4Low63.8Low209 Ų209116.4 Ų116.492%0.91765%0.648SS**THydrogen-bonded Turntrans-96.5-6.4-179.8-62.8-75.2000114D95D95-F97 PolarHBondContact O-N 2.98Å
98Y64.6Low65.5Low171 Ų171114.9 Ų114.967%0.67163%0.632SS**  trans-110.3106180-169.3-98.4000111D95D95-Y98 PolarHBondContact O-N 3.48Å
99Y66.1Low67.1Low156 Ų156117.1 Ų117.161%0.61263%0.627SS**  trans-91.1114.8177.2-158.9-91.8000110.1Y101 V104Y99-Y101 HydrophobicContact CD1-CD1 4.07Å; Y99-Y101 AromaticContact CD1-CD2 3.89Å; Y99-Y101 HydrophobicContact CD1-CD2 3.89Å; Y99-Y101 AromaticContact CD1-CE1 3.84Å; Y99-Y101 HydrophobicContact CD1-CE1 3.84Å; Y99-Y101 AromaticContact CD1-CE2 3.65Å; Y99-Y101 HydrophobicContact CD1-CE2 3.65Å; Y99-Y101 HydrophobicContact CD1-CG 4.09Å; Y99-Y101 AromaticContact CD1-CZ 3.62Å; Y99-Y101 HydrophobicContact CE1-CD1 4.34Å; Y99-Y101 HydrophobicContact CE1-CE1 4.09Å; Y99-Y101 HydrophobicContact CG-CE2 4.16Å; Y99-Y101 VanDerWaalsContact O-CD2 3.23Å; Y99-Y101 WeakPolarHBondContact O-CD2 3.48Å; Y99-Y101 PolarHBondContact O-N 2.8Å; Y99-V104 HydrophobicContact CE1-CG2 4.04Å
100D71.3Confident68.5Low65 Ų65117.2 Ų117.235%0.34862%0.618SS.*  trans-77.884.1-178-169.8-21.6000111.1E102 T103D100-E102 PolarHBondContact O-N 3.35Å; D100-E102 WeakPolarHBondContact OD1-CB 3.32Å; D100-E102 PolarHBondContact OD1-N 2.85Å; D100-E102 VanDerWaalsContact OD1-N 3.07Å; D100-T103 HydrophobicContact CB-CG2 4.35Å; D100-T103 PolarHBondContact O-N 3.48Å; D100-T103 PolarHBondContact O-OG1 3.32Å; D100-T103 PolarHBondContact OD1-N 2.94Å; D100-T103 VanDerWaalsContact OD1-N 3.1Å; D100-T103 VanDerWaalsContact OD2-CG2 3.31Å; D100-T103 WeakPolarHBondContact OD2-CG2 3.26Å
101Y77.4Confident69.7Low150 Ų150118.9 Ų118.959%0.58861%0.613SS**Hα-helixtrans-66-20.2176-76.5-80.8000113.6Y99 V104 R105Y99-Y101 HydrophobicContact CD1-CD1 4.07Å; Y99-Y101 AromaticContact CD1-CD2 3.89Å; Y99-Y101 HydrophobicContact CD1-CD2 3.89Å; Y99-Y101 AromaticContact CD1-CE1 3.84Å; Y99-Y101 HydrophobicContact CD1-CE1 3.84Å; Y99-Y101 AromaticContact CD1-CE2 3.65Å; Y99-Y101 HydrophobicContact CD1-CE2 3.65Å; Y99-Y101 HydrophobicContact CD1-CG 4.09Å; Y99-Y101 AromaticContact CD1-CZ 3.62Å; Y99-Y101 HydrophobicContact CE1-CD1 4.34Å; Y99-Y101 HydrophobicContact CE1-CE1 4.09Å; Y99-Y101 HydrophobicContact CG-CE2 4.16Å; Y99-Y101 VanDerWaalsContact O-CD2 3.23Å; Y99-Y101 WeakPolarHBondContact O-CD2 3.48Å; Y99-Y101 PolarHBondContact O-N 2.8Å; Y101-V104 PolarHBondContact O-N 2.68Å; Y101-R105 WeakPolarHBondContact O-CB 3.41Å; Y101-R105 PolarHBondContact O-N 3.44Å
102E71.3Confident70.8Confident110 Ų110111.8 Ų111.851%0.51459%0.593SS.*Hα-helixtrans-66.5-45177.7-78.5-63.7137.600109.7D100 V104 R105 N106D100-E102 PolarHBondContact O-N 3.35Å; D100-E102 WeakPolarHBondContact OD1-CB 3.32Å; D100-E102 PolarHBondContact OD1-N 2.85Å; D100-E102 VanDerWaalsContact OD1-N 3.07Å; E102-V104 VanDerWaalsContact C-N 3.35Å; E102-V104 PolarHBondContact O-N 3.39Å; E102-R105 PolarHBondContact O-N 2.93Å; E102-N106 WeakPolarHBondContact O-CB 3.45Å; E102-N106 PolarHBondContact O-N 2.93Å; E102-N106 PolarHBondContact O-ND2 2.93Å; E102-N106 PolarHBondContact OE2-ND2 3.46Å
103T77.8Confident71.5Confident85 Ų85110 Ų11052%0.52157%0.574SS.*Hα-helixtrans-61.7-42.4176.762.40000112.6D100 G107D100-T103 HydrophobicContact CB-CG2 4.35Å; D100-T103 PolarHBondContact O-N 3.48Å; D100-T103 PolarHBondContact O-OG1 3.32Å; D100-T103 PolarHBondContact OD1-N 2.94Å; D100-T103 VanDerWaalsContact OD1-N 3.1Å; D100-T103 VanDerWaalsContact OD2-CG2 3.31Å; D100-T103 WeakPolarHBondContact OD2-CG2 3.26Å; T103-G107 PolarHBondContact O-N 2.89Å
104V79.4Confident72.4Confident79 Ų79107 Ų10748%0.47956%0.557SS.*Hα-helixtrans-67.9-40.4179.1179.20000111.1Y99 Y101 E102 G108Y99-V104 HydrophobicContact CE1-CG2 4.04Å; Y101-V104 PolarHBondContact O-N 2.68Å; E102-V104 VanDerWaalsContact C-N 3.35Å; E102-V104 PolarHBondContact O-N 3.39Å; V104-G108 PolarHBondContact O-N 2.83Å
105R78.3Confident72.9Confident133 Ų133104.3 Ų104.350%0.50255%0.547SS..Hα-helixtrans-68.1-47.6178.8-176169.3-63.1-164.62.4111.8Y101 E102 G107 G108 L109Y101-R105 WeakPolarHBondContact O-CB 3.41Å; Y101-R105 PolarHBondContact O-N 3.44Å; E102-R105 PolarHBondContact O-N 2.93Å; R105-G107 VanDerWaalsContact C-N 3.34Å; R105-G108 PolarHBondContact O-N 2.95Å; R105-L109 WeakPolarHBondContact O-CG 3.33Å; R105-L109 PolarHBondContact O-N 3.23Å
106N69.9Low74Confident73 Ų73104.1 Ų104.139%0.3954%0.54SS..Hα-helixtrans-65.5-40.5178.3-66.5-31.4000110.6E102 G108 L109 I110E102-N106 WeakPolarHBondContact O-CB 3.45Å; E102-N106 PolarHBondContact O-N 2.93Å; E102-N106 PolarHBondContact O-ND2 2.93Å; E102-N106 PolarHBondContact OE2-ND2 3.46Å; N106-G108 PolarHBondContact O-N 3.42Å; N106-L109 PolarHBondContact O-N 3.48Å; N106-I110 WeakPolarHBondContact O-CD1 3.25Å; N106-I110 WeakPolarHBondContact O-CG1 3.24Å; N106-I110 PolarHBondContact O-N 3.35Å
107G80.6Confident74.3Confident37 Ų37102.8 Ų102.838%0.38153%0.525SS..Hα-helixtrans-59.3-43.8171.900000112.8T103 R105 I110 F111T103-G107 PolarHBondContact O-N 2.89Å; R105-G107 VanDerWaalsContact C-N 3.34Å; G107-I110 PolarHBondContact O-N 3.31Å; G107-F111 WeakPolarHBondContact O-CB 3.4Å; G107-F111 PolarHBondContact O-N 2.93Å
108G76.9Confident74.8Confident40 Ų4096.9 Ų96.941%0.41251%0.506SS..Hα-helixtrans-62.9-42.4176.500000113.4V104 R105 N106 F111 A112V104-G108 PolarHBondContact O-N 2.83Å; R105-G108 PolarHBondContact O-N 2.95Å; N106-G108 PolarHBondContact O-N 3.42Å; G108-F111 PolarHBondContact O-N 2.93Å; G108-A112 WeakPolarHBondContact O-CB 3.26Å; G108-A112 PolarHBondContact O-N 2.98Å
109L74.8Confident75.3Confident118 Ų11890.6 Ų90.662%0.61849%0.493SS*.Hα-helixtrans-65.1-43177.1-73172.1000112.2R105 N106 A112 G113R105-L109 WeakPolarHBondContact O-CG 3.33Å; R105-L109 PolarHBondContact O-N 3.23Å; N106-L109 PolarHBondContact O-N 3.48Å; L109-A112 PolarHBondContact O-N 3.4Å; L109-G113 PolarHBondContact O-N 2.92Å
110I75.6Confident75.5Confident109 Ų10986.4 Ų86.456%0.55948%0.481SS*.Hα-helixtrans-63.7-46.6176.7-66.9163.4000110N106 G107 A112 G113 L114N106-I110 WeakPolarHBondContact O-CD1 3.25Å; N106-I110 WeakPolarHBondContact O-CG1 3.24Å; N106-I110 PolarHBondContact O-N 3.35Å; G107-I110 PolarHBondContact O-N 3.31Å; I110-A112 VanDerWaalsContact C-N 3.35Å; I110-A112 PolarHBondContact O-N 3.36Å; I110-G113 PolarHBondContact O-N 3.46Å; I110-L114 HydrophobicContact CG2-CD1 3.9Å; I110-L114 HydrophobicContact CG2-CG 4.31Å; I110-L114 WeakPolarHBondContact O-CB 3.11Å; I110-L114 VanDerWaalsContact O-CG 3.31Å; I110-L114 WeakPolarHBondContact O-CG 2.93Å; I110-L114 PolarHBondContact O-N 3.03Å
111F82.9Confident75.5Confident156 Ų15688.6 Ų88.668%0.68449%0.492SS*.Hα-helixtrans-60.2-44.8178.4-177.9-98.8000111.9G107 G108 L114 A115G107-F111 WeakPolarHBondContact O-CB 3.4Å; G107-F111 PolarHBondContact O-N 2.93Å; G108-F111 PolarHBondContact O-N 2.93Å; F111-L114 PolarHBondContact O-N 2.95Å; F111-A115 WeakPolarHBondContact O-CB 3.22Å; F111-A115 PolarHBondContact O-N 3.48Å
112A71.3Confident75.1Confident56 Ų5685.5 Ų85.546%0.46349%0.485SS..Hα-helixtrans-61.5-45.4176.500000112G108 L109 I110 A115 F116G108-A112 WeakPolarHBondContact O-CB 3.26Å; G108-A112 PolarHBondContact O-N 2.98Å; L109-A112 PolarHBondContact O-N 3.4Å; I110-A112 VanDerWaalsContact C-N 3.35Å; I110-A112 PolarHBondContact O-N 3.36Å; A112-A115 PolarHBondContact O-N 3.18Å; A112-F116 WeakPolarHBondContact O-CB 3.44Å; A112-F116 PolarHBondContact O-N 2.82Å
113G75.4Confident74.4Confident32 Ų3282.2 Ų82.233%0.3347%0.471SS..Hα-helixtrans-61.5-45.7176.900000112.7L109 I110 F116 I117L109-G113 PolarHBondContact O-N 2.92Å; I110-G113 PolarHBondContact O-N 3.46Å; G113-F116 PolarHBondContact O-N 3.41Å; G113-I117 VanDerWaalsContact O-CG1 3.28Å; G113-I117 WeakPolarHBondContact O-CG1 3.26Å; G113-I117 PolarHBondContact O-N 3.31Å
114L76.4Confident73.5Confident103 Ų10382.5 Ų82.554%0.53947%0.468SS..Hα-helixtrans-64-46.3177.9-70.3176.5000112I110 F111 F116 I117 V118I110-L114 HydrophobicContact CG2-CD1 3.9Å; I110-L114 HydrophobicContact CG2-CG 4.31Å; I110-L114 WeakPolarHBondContact O-CB 3.11Å; I110-L114 VanDerWaalsContact O-CG 3.31Å; I110-L114 WeakPolarHBondContact O-CG 2.93Å; I110-L114 PolarHBondContact O-N 3.03Å; F111-L114 PolarHBondContact O-N 2.95Å; L114-F116 VanDerWaalsContact C-N 3.27Å; L114-F116 PolarHBondContact O-N 2.88Å; L114-I117 PolarHBondContact O-N 3.31Å; L114-V118 WeakPolarHBondContact O-CB 3.09Å; L114-V118 VanDerWaalsContact O-CG2 3.29Å; L114-V118 WeakPolarHBondContact O-CG2 3.35Å; L114-V118 PolarHBondContact O-N 3.34Å
115A72.7Confident72.3Confident54 Ų5481.4 Ų81.445%0.44646%0.464SS..Hα-helixtrans-59.9-39.7177.300000111.6F111 A112 G119F111-A115 WeakPolarHBondContact O-CB 3.22Å; F111-A115 PolarHBondContact O-N 3.48Å; A112-A115 PolarHBondContact O-N 3.18Å; A115-G119 PolarHBondContact O-N 3.47Å
116F79.6Confident71.1Confident125 Ų12581.9 Ų81.955%0.54847%0.466SS..Hα-helixtrans-65.6-46.8176-175.7-104.9000112.4A112 G113 L114 G119 L120A112-F116 WeakPolarHBondContact O-CB 3.44Å; A112-F116 PolarHBondContact O-N 2.82Å; G113-F116 PolarHBondContact O-N 3.41Å; L114-F116 VanDerWaalsContact C-N 3.27Å; L114-F116 PolarHBondContact O-N 2.88Å; F116-G119 PolarHBondContact O-N 3.25Å; F116-L120 HydrophobicContact CD1-CD1 3.82Å; F116-L120 HydrophobicContact CD1-CG 4.3Å; F116-L120 HydrophobicContact CE1-CD1 3.3Å; F116-L120 HydrophobicContact CE1-CG 4Å; F116-L120 HydrophobicContact CZ-CD1 3.75Å; F116-L120 HydrophobicContact CZ-CD2 4.33Å; F116-L120 HydrophobicContact CZ-CG 4.1Å; F116-L120 WeakPolarHBondContact O-CG 3.19Å; F116-L120 PolarHBondContact O-N 2.94Å
117I72.1Confident70Confident98 Ų9886.5 Ų86.550%0.50348%0.478SS..Hα-helixtrans-62.5-44.9177.9-68.3166000110.9G113 L114 G119 L120 L121G113-I117 VanDerWaalsContact O-CG1 3.28Å; G113-I117 WeakPolarHBondContact O-CG1 3.26Å; G113-I117 PolarHBondContact O-N 3.31Å; L114-I117 PolarHBondContact O-N 3.31Å; I117-G119 VanDerWaalsContact C-N 3.33Å; I117-G119 PolarHBondContact O-N 2.82Å; I117-L120 PolarHBondContact O-N 3.47Å; I117-L121 WeakPolarHBondContact O-CB 3.47Å; I117-L121 PolarHBondContact O-N 2.85Å
118V76.7Confident68.3Low84 Ų8492.7 Ų92.751%0.50950%0.495SS..Hα-helixtrans-62-42.7176.5172.40000110.6L114 L121 I122L114-V118 WeakPolarHBondContact O-CB 3.09Å; L114-V118 VanDerWaalsContact O-CG2 3.29Å; L114-V118 WeakPolarHBondContact O-CG2 3.35Å; L114-V118 PolarHBondContact O-N 3.34Å; V118-L121 PolarHBondContact O-N 2.98Å; V118-I122 HydrophobicContact CG1-CD1 3.84Å; V118-I122 VanDerWaalsContact O-CG1 3.25Å; V118-I122 WeakPolarHBondContact O-CG1 3.48Å; V118-I122 PolarHBondContact O-N 2.96Å
119G74.4Confident66.9Low40 Ų40101.4 Ų101.441%0.41252%0.515SS..Hα-helixtrans-59.5-4617400000113A115 F116 I117 L123A115-G119 PolarHBondContact O-N 3.47Å; F116-G119 PolarHBondContact O-N 3.25Å; I117-G119 VanDerWaalsContact C-N 3.33Å; I117-G119 PolarHBondContact O-N 2.82Å; G119-L123 VanDerWaalsContact O-CB 3.27Å; G119-L123 WeakPolarHBondContact O-CB 3.28Å; G119-L123 PolarHBondContact O-N 3.45Å
120L71.1Confident65.4Low68 Ų68101.1 Ų101.136%0.35652%0.522SS..Hα-helixtrans-64.3-42.8175.1-74.9-176.8000112.2F116 I117 L123 L124F116-L120 HydrophobicContact CD1-CD1 3.82Å; F116-L120 HydrophobicContact CD1-CG 4.3Å; F116-L120 HydrophobicContact CE1-CD1 3.3Å; F116-L120 HydrophobicContact CE1-CG 4Å; F116-L120 HydrophobicContact CZ-CD1 3.75Å; F116-L120 HydrophobicContact CZ-CD2 4.33Å; F116-L120 HydrophobicContact CZ-CG 4.1Å; F116-L120 WeakPolarHBondContact O-CG 3.19Å; F116-L120 PolarHBondContact O-N 2.94Å; I117-L120 PolarHBondContact O-N 3.47Å; L120-L123 HydrophobicContact CD2-CD2 4.38Å; L120-L123 CarbonylContact O-C 3.54Å; L120-L123 WeakPolarHBondContact O-CB 3.26Å; L120-L123 PolarHBondContact O-N 2.76Å; L120-L123 VanDerWaalsContact O-N 3.17Å; L120-L124 WeakPolarHBondContact O-CB 3.22Å; L120-L124 VanDerWaalsContact O-CG 3.22Å; L120-L124 WeakPolarHBondContact O-CG 3.46Å; L120-L124 PolarHBondContact O-N 3.21Å
121L70.9Confident64.1Low110 Ų11098.3 Ų98.358%0.57652%0.52SS*.Hα-helixtrans-62.4-46.6179.5-162.3110000110.3I117 V118 L123 L124 S125I117-L121 WeakPolarHBondContact O-CB 3.47Å; I117-L121 PolarHBondContact O-N 2.85Å; V118-L121 PolarHBondContact O-N 2.98Å; L121-L123 VanDerWaalsContact C-N 3.3Å; L121-L123 PolarHBondContact O-N 2.86Å; L121-L124 PolarHBondContact O-N 3.28Å; L121-S125 VanDerWaalsContact O-CB 3.31Å; L121-S125 WeakPolarHBondContact O-CB 3.44Å; L121-S125 PolarHBondContact O-N 3.15Å; L121-S125 PolarHBondContact O-OG 2.92Å
122I68.4Low62.2Low86 Ų8694 Ų9444%0.44152%0.52SS..Hα-helixtrans-60.8-40.1174.5-66.5167.8000111.1V118 R126V118-I122 HydrophobicContact CG1-CD1 3.84Å; V118-I122 VanDerWaalsContact O-CG1 3.25Å; V118-I122 WeakPolarHBondContact O-CG1 3.48Å; V118-I122 PolarHBondContact O-N 2.96Å; I122-R126 WeakPolarHBondContact O-CG 3.49Å; I122-R126 PolarHBondContact O-N 2.83Å; I122-R126 VanDerWaalsContact O-N 3.17Å
123L57.2Low60.9Low41 Ų4197.9 Ų97.922%0.21553%0.533CS..Hα-helixtrans-65.4-37.9178-171.269.9000112.8R59 G119 L120 L121 R127R59-L123 PolarHBondContact NH1-O 3.4Å; R59-L123 VanDerWaalsContact NH1-O 3.11Å; G119-L123 VanDerWaalsContact O-CB 3.27Å; G119-L123 WeakPolarHBondContact O-CB 3.28Å; G119-L123 PolarHBondContact O-N 3.45Å; L120-L123 HydrophobicContact CD2-CD2 4.38Å; L120-L123 CarbonylContact O-C 3.54Å; L120-L123 WeakPolarHBondContact O-CB 3.26Å; L120-L123 PolarHBondContact O-N 2.76Å; L120-L123 VanDerWaalsContact O-N 3.17Å; L121-L123 VanDerWaalsContact C-N 3.3Å; L121-L123 PolarHBondContact O-N 2.86Å; L123-R127 PolarHBondContact O-N 2.76Å
124L59.4Low59.4Low90 Ų90106.4 Ų106.447%0.47156%0.561SS.*Hα-helixtrans-79.2-43178.7-68.9172000111.2L120 L121 R126 R127 F128L120-L124 WeakPolarHBondContact O-CB 3.22Å; L120-L124 VanDerWaalsContact O-CG 3.22Å; L120-L124 WeakPolarHBondContact O-CG 3.46Å; L120-L124 PolarHBondContact O-N 3.21Å; L121-L124 PolarHBondContact O-N 3.28Å; L124-R126 PolarHBondContact O-N 3.3Å; L124-R127 WeakPolarHBondContact O-CA 3.36Å; L124-R127 WeakPolarHBondContact O-CB 3.28Å; L124-R127 PolarHBondContact O-N 2.8Å; L124-F128 HydrophobicContact CB-CE2 4.39Å; L124-F128 WeakPolarHBondContact O-CD2 3.27Å; L124-F128 PolarHBondContact O-N 3.28Å
125S53.4Low57.8Low56 Ų56110.4 Ų110.439%0.39257%0.574SS.*Hα-helixtrans-58.9-31.3174.9-60.40000112.7L121L121-S125 VanDerWaalsContact O-CB 3.31Å; L121-S125 WeakPolarHBondContact O-CB 3.44Å; L121-S125 PolarHBondContact O-N 3.15Å; L121-S125 PolarHBondContact O-OG 2.92Å
126R52.7Low56.5Low143 Ų143119.5 Ų119.554%0.5460%0.596SS.*Hα-helixtrans-77.9-27.4171.8-71.8-177.6-179.8-170.82.8113.4I122 L124 F128 R129 C130I122-R126 WeakPolarHBondContact O-CG 3.49Å; I122-R126 PolarHBondContact O-N 2.83Å; I122-R126 VanDerWaalsContact O-N 3.17Å; L124-R126 PolarHBondContact O-N 3.3Å; R126-F128 VanDerWaalsContact C-N 3.31Å; R126-R129 PolarHBondContact O-N 2.86Å; R126-C130 PolarHBondContact O-N 2.91Å
127R47.7Very low54.7Low171 Ų171123.4 Ų123.465%0.64561%0.607SS**Hα-helixtrans-68.3-32.3172.4-171.5157.7176.1131.1-5.2111.7L123 L124 G131L123-R127 PolarHBondContact O-N 2.76Å; L124-R127 WeakPolarHBondContact O-CA 3.36Å; L124-R127 WeakPolarHBondContact O-CB 3.28Å; L124-R127 PolarHBondContact O-N 2.8Å; R127-G131 PolarHBondContact O-N 2.81Å
128F45.4Very low53.1Low166 Ų166127.9 Ų127.973%0.72863%0.626SS**Hα-helixtrans-72.4-23.9175.5-70.4-71.6000114.4L124 R126L124-F128 HydrophobicContact CB-CE2 4.39Å; L124-F128 WeakPolarHBondContact O-CD2 3.27Å; L124-F128 PolarHBondContact O-N 3.28Å; R126-F128 VanDerWaalsContact C-N 3.31Å
129R47.3Very low51.8Low223 Ų223129.1 Ų129.184%0.84263%0.629SS**Hα-helixtrans-83.7-29.3174.8-64.2-170.6-153.6-1513.8113.9R126 G131R126-R129 PolarHBondContact O-N 2.86Å; R129-G131 VanDerWaalsContact C-N 3.29Å
130C43.8Very low50.1Low112 Ų112134.6 Ų134.676%0.75765%0.649SS**THydrogen-bonded Turntrans-83.5-2.3174.7-70.80000113.8R126R126-C130 PolarHBondContact O-N 2.91Å
131G47Very low49.7Very low50 Ų50139.4 Ų139.452%0.51567%0.669SS.*THydrogen-bonded Turntrans-115.220.6178.900000114.3R127 R129 N133R127-G131 PolarHBondContact O-N 2.81Å; R129-G131 VanDerWaalsContact C-N 3.29Å; G131-N133 PolarHBondContact O-N 2.81Å
132G44Very low48.4Very low67 Ų67141.3 Ų141.369%0.69168%0.68SS**  trans-67.294.1176.900000111.8K134G132-K134 PolarHBondContact O-N 3.46Å
133N44.3Very low47.9Very low137 Ų137146 Ų14673%0.73370%0.7SS**  trans-24.6117.3170.4-73-35.5000115.2G131 K135G131-N133 PolarHBondContact O-N 2.81Å; N133-K135 PolarHBondContact O-N 3.15Å
134K44Very low48.1Very low211 Ų211152.9 Ų152.992%0.91775%0.748SS**  trans-74.882.6147.5-76.5-173.2-177.9-179.90108G132 R136G132-K134 PolarHBondContact O-N 3.46Å; K134-R136 PolarHBondContact O-N 3.05Å
135K42.1Very low47.6Very low187 Ų187156.1 Ų156.181%0.81376%0.761SS**  trans-70.791.7153.9-83.9-169.7178.7-175.60106.5N133 R137N133-K135 PolarHBondContact O-N 3.15Å; K135-R137 VanDerWaalsContact C-N 3.31Å; K135-R137 PolarHBondContact O-N 2.88Å; K135-R137 VanDerWaalsContact O-N 3.07Å
136R45.5Very low47.3Very low244 Ų244161.3 Ų161.392%0.92178%0.781SS**  trans-72.893.3163.8-168.7-177-167.1-107.12.3106.6K134K134-R136 PolarHBondContact O-N 3.05Å
137R42.1Very low47Very low207 Ų207162.3 Ų162.378%0.78179%0.794SS**  trans-142.396.5158.8-167.2174.7179.5176-1.2109K135K135-R137 VanDerWaalsContact C-N 3.31Å; K135-R137 PolarHBondContact O-N 2.88Å; K135-R137 VanDerWaalsContact O-N 3.07Å
138Q37.6Very low46.9Very low192 Ų192161.8 Ų161.890%0.89780%0.803SS**  -132.5122.6126.9-81.7-160.6-3.800108.3
139I49.8Very low47Very low110 Ų110161.6 Ų161.656%0.56481%0.808SS**  trans-81.3133.9162.5-76.7161.3000105.3
140N38.6Very low47Very low156 Ų156157.5 Ų157.583%0.83481%0.806SS**  -163.4136.5122.8-99-16.6000110.3
141E61.5Low47.2Very low168 Ų168160.7 Ų160.779%0.78581%0.809SS**  trans-72.3179.4172.2-51.1-107118.400109.5
142D45.6Very low47.2Very low151 Ų151169.2 Ų169.281%0.80783%0.832SS**  trans133.374.8159.2-61.3-20.9000108.8
143E57.3Low47.5Very low184 Ų184177.8 Ų177.886%0.8684%0.843SS**  77.1160.883.1-150.6-172.49400113.2
144P61.8Low47.8Very low186 Ų186181.5 Ų181.5100%1.20885%0.853SS**  -990-65.629.5-19.5000114.6

Retrieved 144 of 144 residues in 433.2 ms (Link to these results)