A0A096NLR8_PAPAN Loading...

Tumor necrosis factor receptor superfamily member 17

Receptor for TNFSF13B/BLyS/BAFF and TNFSF13/APRIL. Promotes B-cell survival and plays a role in the regulation of humoral immunity. Activates NF-kappa-B and JNK.

AlphaFold DB , UniProt , Accession A0A096NLR8, Species PAPAN (Papio anubis, Olive baboon), Gene TNFRSF17, Length 183 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
1M32.8Very low62.7Low241 Ų241144.9 Ų144.9100%1.18774%0.735SS**  0107.20-68.9-156.8-80.500107.8Q3M1-Q3 PolarHBondContact O-N 3.42Å
2L37.7Very low65Low176 Ų176138.5 Ų138.592%0.92170%0.7SS**  trans-72.2106173.2-79.5148.1000106.7M4L2-M4 PolarHBondContact O-N 3.21Å
3Q46.6Very low66.8Low176 Ų176129.5 Ų129.582%0.82265%0.653SS**  trans-57.1112.7169.5-81.2177.7-4.400106.8M1 A5M1-Q3 PolarHBondContact O-N 3.42Å; Q3-A5 VanDerWaalsContact C-N 3.33Å; Q3-A5 PolarHBondContact O-N 3.16Å
4M42.3Very low68.4Low182 Ų182125.4 Ų125.490%0.89763%0.628SS**  trans-61.2104.2166.4-63.2-165174.700105.6L2 R6L2-M4 PolarHBondContact O-N 3.21Å; M4-R6 PolarHBondContact O-N 3.36Å
5A56.7Low69.8Low85 Ų85118.2 Ų118.270%0.70259%0.593SS**  trans-55108.4170.700000105.8Q3 Q7Q3-A5 VanDerWaalsContact C-N 3.33Å; Q3-A5 PolarHBondContact O-N 3.16Å; A5-Q7 PolarHBondContact O-N 3.47Å
6R62.4Low70.9Confident178 Ų178116.2 Ų116.267%0.67259%0.594SS**  trans-52.1114.7175.2-116.9-177.2175.6-176.9-2.1106M4 C8 F14M4-R6 PolarHBondContact O-N 3.36Å; R6-C8 PolarHBondContact O-N 2.98Å; R6-F14 HydrophobicContact CB-CD2 4.38Å; R6-F14 HydrophobicContact CB-CE2 4.3Å
7Q74.4Confident72Confident197 Ų197118.6 Ų118.692%0.92161%0.607SS**  trans-71103.8177.6-110.9164.7-29.800106.9A5A5-Q7 PolarHBondContact O-N 3.47Å
8C84.1Confident72.9Confident32 Ų32117.9 Ų117.922%0.21660%0.604CS.*PPolyproline II helixtrans-67.5158.5172.3-62.90000110.2R6 E12 C21R6-C8 PolarHBondContact O-N 2.98Å; C8-E12 HydrophobicContact CB-CB 3.9Å; C8-C21 WeakPolarHBondContact CA-SG 3.41Å; C8-C21 HydrophobicContact CB-CB 3.79Å; C8-C21 WeakPolarHBondContact CB-SG 2.7Å; C8-C21 VanDerWaalsContact SG-CA 3.58Å; C8-C21 WeakPolarHBondContact SG-CB 2.83Å; C8-C21 CovalentContact SG-SG 2.04Å; C8-C21 PolarHBondContact SG-SG 3.38Å
9S85.1Confident73.7Confident70 Ų70118.3 Ų118.349%0.4960%0.603SS.*PPolyproline II helixtrans-72.1173.4-178.877.20000111.8N11 E12S9-N11 PolarHBondContact O-N 3.21Å; S9-E12 WeakPolarHBondContact CB-OE2 3.47Å; S9-E12 PolarHBondContact N-OE2 3.09Å; S9-E12 PolarHBondContact O-N 3.04Å; S9-E12 VanDerWaalsContact O-N 3.15Å; S9-E12 PolarHBondContact OG-OE1 3.19Å; S9-E12 PolarHBondContact OG-OE2 3.24Å
10Q82.5Confident74.6Confident177 Ų177115.7 Ų115.783%0.82759%0.59SS**THydrogen-bonded Turntrans-65.2131.8-177.9-164.7166.910.400110.7E12Q10-E12 VanDerWaalsContact C-N 3.34Å
11N85.2Confident75.3Confident80 Ų80111.6 Ų111.643%0.42857%0.572SS.*THydrogen-bonded Turntrans72.219.5-172.8-43.8-48.6000115.4S9 C24 Y39S9-N11 PolarHBondContact O-N 3.21Å; N11-C24 VanDerWaalsContact O-CB 3.25Å; N11-C24 WeakPolarHBondContact O-CB 3.23Å; N11-C24 PolarHBondContact O-N 2.73Å; N11-C24 PolarHBondContact O-SG 2.83Å; N11-Y39 HydrophobicContact CB-CD2 3.73Å; N11-Y39 HydrophobicContact CB-CE2 4.01Å; N11-Y39 HydrophobicContact CB-CG 4.22Å; N11-Y39 WeakPolarHBondContact OD1-CD2 3.27Å
12E89.8Confident78.1Confident68 Ų68102.8 Ų102.832%0.31853%0.527SS..EExtended strand (participates in β ladder)trans-116.9158.1167.8-64.5176.9158.700110.9C8 S9 Q10 K22C8-E12 HydrophobicContact CB-CB 3.9Å; S9-E12 WeakPolarHBondContact CB-OE2 3.47Å; S9-E12 PolarHBondContact N-OE2 3.09Å; S9-E12 PolarHBondContact O-N 3.04Å; S9-E12 VanDerWaalsContact O-N 3.15Å; S9-E12 PolarHBondContact OG-OE1 3.19Å; S9-E12 PolarHBondContact OG-OE2 3.24Å; Q10-E12 VanDerWaalsContact C-N 3.34Å; E12-K22 CarbonylContact C-O 3.53Å; E12-K22 VanDerWaalsContact CA-O 3.25Å; E12-K22 WeakPolarHBondContact CA-O 2.89Å; E12-K22 WeakPolarHBondContact CB-O 3.23Å
13Y88.4Confident80.7Confident22 Ų2297.2 Ų97.29%0.08650%0.501CS..EExtended strand (participates in β ladder)trans-127.4149.8170.874.7-76.5000109.8D15 K22 R27 P33Y13-D15 HydrophobicContact CE2-CB 4.11Å; Y13-K22 HydrophobicContact CD1-CB 4.3Å; Y13-K22 WeakPolarHBondContact CD1-O 3.43Å; Y13-K22 HydrophobicContact CE1-CB 3.67Å; Y13-K22 PolarHBondContact N-O 3.41Å; Y13-K22 PolarHBondContact O-N 3.48Å; Y13-R27 HydrophobicContact CE1-CG 3.68Å; Y13-R27 HydrophobicContact CE2-CG 4.5Å; Y13-R27 PolarHBondContact OH-NE 3.29Å; Y13-P33 HydrophobicContact CD2-CG 3.97Å; Y13-P33 HydrophobicContact CE2-CG 4.45Å; Y13-P33 HydrophobicContact CG-CG 4.07Å
14F89.9Confident82.8Confident71 Ų7188.8 Ų88.831%0.31146%0.462SS..EExtended strand (participates in β ladder)trans-80.1123174.7-174.4-103.9000109.6R6 H19R6-F14 HydrophobicContact CB-CD2 4.38Å; R6-F14 HydrophobicContact CB-CE2 4.3Å; F14-H19 HydrophobicContact CZ-CB 4.41Å
15D89.8Confident85Confident18 Ų1886.2 Ų86.210%0.09645%0.448CS..EExtended strand (participates in β ladder)trans-93.9108.7173-167.1-51.1000109.2Y13 L17 L18 H19 D20 K22 R27Y13-D15 HydrophobicContact CE2-CB 4.11Å; D15-L17 PolarHBondContact O-N 2.9Å; D15-L17 WeakPolarHBondContact OD1-CA 3.26Å; D15-L17 VanDerWaalsContact OD1-CB 3.27Å; D15-L17 WeakPolarHBondContact OD1-CB 3.12Å; D15-L17 PolarHBondContact OD1-N 3.4Å; D15-L18 HydrophobicContact CB-CB 4.31Å; D15-L18 PolarHBondContact O-N 3.41Å; D15-L18 PolarHBondContact OD1-N 3.1Å; D15-H19 VanDerWaalsContact O-CA 3.32Å; D15-H19 WeakPolarHBondContact O-CA 2.88Å; D15-H19 PolarHBondContact O-N 3.42Å; D15-D20 PolarHBondContact N-O 2.83Å; D15-D20 PolarHBondContact O-N 3.13Å; D15-K22 HydrophobicContact CB-CG 4.16Å; D15-R27 IonicContact OD2-NH2 3.64Å
16S87.4Confident86.5Confident86 Ų8687.8 Ų87.860%0.60144%0.444SS*.THydrogen-bonded Turntrans-66.9-21.2-178.6-56.10000113.8
17L88.9Confident87.8Confident157 Ų15784 Ų8482%0.82243%0.43SS*.THydrogen-bonded Turntrans-77.6-40.6177.6-177.265.7000110.6D15D15-L17 PolarHBondContact O-N 2.9Å; D15-L17 WeakPolarHBondContact OD1-CA 3.26Å; D15-L17 VanDerWaalsContact OD1-CB 3.27Å; D15-L17 WeakPolarHBondContact OD1-CB 3.12Å; D15-L17 PolarHBondContact OD1-N 3.4Å
18L88.3Confident88.4Confident106 Ų10676 Ų7656%0.55539%0.394SS*.THydrogen-bonded Turntrans-91.2-7.5179.6-65.1169.7000113.2D15 D20D15-L18 HydrophobicContact CB-CB 4.31Å; D15-L18 PolarHBondContact O-N 3.41Å; D15-L18 PolarHBondContact OD1-N 3.1Å; L18-D20 HydrophobicContact CB-CB 4.37Å; L18-D20 PolarHBondContact O-N 3.4Å
19H87.6Confident88.4Confident125 Ų12580 Ų8058%0.57942%0.423SS*.THydrogen-bonded Turntrans49.636.8-172.4-74.2-76.9000113.5F14 D15F14-H19 HydrophobicContact CZ-CB 4.41Å; D15-H19 VanDerWaalsContact O-CA 3.32Å; D15-H19 WeakPolarHBondContact O-CA 2.88Å; D15-H19 PolarHBondContact O-N 3.42Å
20D91.6Very high88.4Confident66 Ų6680.5 Ų80.535%0.35343%0.426SS..EExtended strand (participates in β ladder)trans-142.8157.9-170.8-168.825.7000112.3D15 L18 K22D15-D20 PolarHBondContact N-O 2.83Å; D15-D20 PolarHBondContact O-N 3.13Å; L18-D20 HydrophobicContact CB-CB 4.37Å; L18-D20 PolarHBondContact O-N 3.4Å; D20-K22 IonicContact OD2-NZ 2.76Å; D20-K22 PolarHBondContact OD2-NZ 3.29Å
21C90.4Very high88.4Confident30 Ų3078.4 Ų78.420%0.20343%0.426CS..EExtended strand (participates in β ladder)trans-83.4127.1176.4-65.70000110.2C8C8-C21 WeakPolarHBondContact CA-SG 3.41Å; C8-C21 HydrophobicContact CB-CB 3.79Å; C8-C21 WeakPolarHBondContact CB-SG 2.7Å; C8-C21 VanDerWaalsContact SG-CA 3.58Å; C8-C21 WeakPolarHBondContact SG-CB 2.83Å; C8-C21 CovalentContact SG-SG 2.04Å; C8-C21 PolarHBondContact SG-SG 3.38Å
22K91.1Very high88.4Confident56 Ų5676.6 Ų76.624%0.24342%0.419CS..EExtended strand (participates in β ladder)trans-120.7147179-64.4-56.3-178.8-149.50111.5E12 Y13 D15 D20E12-K22 CarbonylContact C-O 3.53Å; E12-K22 VanDerWaalsContact CA-O 3.25Å; E12-K22 WeakPolarHBondContact CA-O 2.89Å; E12-K22 WeakPolarHBondContact CB-O 3.23Å; Y13-K22 HydrophobicContact CD1-CB 4.3Å; Y13-K22 WeakPolarHBondContact CD1-O 3.43Å; Y13-K22 HydrophobicContact CE1-CB 3.67Å; Y13-K22 PolarHBondContact N-O 3.41Å; Y13-K22 PolarHBondContact O-N 3.48Å; D15-K22 HydrophobicContact CB-CG 4.16Å; D20-K22 IonicContact OD2-NZ 2.76Å; D20-K22 PolarHBondContact OD2-NZ 3.29Å
23P91.9Very high88.3Confident59 Ų5975.4 Ų75.438%0.38342%0.417SS..EExtended strand (participates in β ladder)trans-70.1139.9-179.726.3-32.6000111.7Q25 L26P23-Q25 PolarHBondContact O-N 2.67Å; P23-L26 HydrophobicContact CG-CD1 3.8Å; P23-L26 HydrophobicContact CG-CG 4.04Å; P23-L26 PolarHBondContact O-N 3.09Å
24C90.5Very high88.1Confident0 Ų081.8 Ų81.80%045%0.451CS..G310 helixtrans-60.6-28.1-179.8-75.50000113.6N11 L26 R27 C28 C36 Y39N11-C24 VanDerWaalsContact O-CB 3.25Å; N11-C24 WeakPolarHBondContact O-CB 3.23Å; N11-C24 PolarHBondContact O-N 2.73Å; N11-C24 PolarHBondContact O-SG 2.83Å; C24-L26 PolarHBondContact O-N 3.44Å; C24-L26 VanDerWaalsContact O-N 3.13Å; C24-R27 PolarHBondContact O-N 3.46Å; C24-C28 PolarHBondContact O-N 2.82Å; C24-C28 PolarHBondContact O-SG 3.48Å; C24-C28 VanDerWaalsContact O-SG 3.33Å; C24-C36 WeakPolarHBondContact CA-SG 3.33Å; C24-C36 HydrophobicContact CB-CB 3.5Å; C24-C36 WeakPolarHBondContact CB-SG 3.35Å; C24-C36 WeakPolarHBondContact SG-CA 3.37Å; C24-C36 WeakPolarHBondContact SG-CB 3.37Å; C24-C36 CovalentContact SG-SG 2.03Å; C24-C36 PolarHBondContact SG-SG 3.45Å; C24-Y39 HydrophobicContact CB-CD1 3.79Å; C24-Y39 HydrophobicContact CB-CE1 4.36Å; C24-Y39 HydrophobicContact CB-CG 4.31Å
25Q88.6Confident87.9Confident128 Ų12883.5 Ų83.560%0.59847%0.468SS*.G310 helixtrans-54.4-33.6-179.4-170.3174.51.800112.9P23 R27 C28 Y39P23-Q25 PolarHBondContact O-N 2.67Å; Q25-R27 PolarHBondContact O-N 3.1Å; Q25-C28 PolarHBondContact O-N 3.35Å; Q25-Y39 HydrophobicContact CB-CE1 4.08Å
26L88.9Confident87.9Confident118 Ų11882.7 Ų82.762%0.61846%0.464SS*.G310 helixtrans-66.8-23179.6-62.2174.2000113.4P23 C24P23-L26 HydrophobicContact CG-CD1 3.8Å; P23-L26 HydrophobicContact CG-CG 4.04Å; P23-L26 PolarHBondContact O-N 3.09Å; C24-L26 PolarHBondContact O-N 3.44Å; C24-L26 VanDerWaalsContact O-N 3.13Å
27R88.4Confident88Confident99 Ų9983.2 Ų83.237%0.37446%0.457SS..G310 helixtrans-102.4-6-177.9-66.3-69.1-170.8163.30.3113.1Y13 D15 C24 Q25 S29 S30 P32Y13-R27 HydrophobicContact CE1-CG 3.68Å; Y13-R27 HydrophobicContact CE2-CG 4.5Å; Y13-R27 PolarHBondContact OH-NE 3.29Å; D15-R27 IonicContact OD2-NH2 3.64Å; C24-R27 PolarHBondContact O-N 3.46Å; Q25-R27 PolarHBondContact O-N 3.1Å; R27-S29 PolarHBondContact O-N 3.34Å; R27-S30 CarbonylContact O-C 3.43Å; R27-S30 PolarHBondContact O-N 3.35Å; R27-P32 HydrophobicContact CB-CB 4.48Å
28C88.8Confident87.9Confident27 Ų2786.2 Ų86.218%0.18246%0.457CS..THydrogen-bonded Turntrans-68-20.8-178.1-62.50000113.9C24 Q25 S30 C40C24-C28 PolarHBondContact O-N 2.82Å; C24-C28 PolarHBondContact O-SG 3.48Å; C24-C28 VanDerWaalsContact O-SG 3.33Å; Q25-C28 PolarHBondContact O-N 3.35Å; C28-S30 VanDerWaalsContact C-N 3.33Å; C28-C40 WeakPolarHBondContact CA-SG 3.42Å; C28-C40 HydrophobicContact CB-CB 3.66Å; C28-C40 WeakPolarHBondContact CB-SG 3.35Å; C28-C40 WeakPolarHBondContact SG-CA 3.4Å; C28-C40 WeakPolarHBondContact SG-CB 3.24Å; C28-C40 CovalentContact SG-SG 2.04Å; C28-C40 PolarHBondContact SG-SG 2.95Å
29S84.1Confident88Confident118 Ų11884.5 Ų84.583%0.82544%0.444SS*.THydrogen-bonded Turntrans-83.9-7.5173.2-54.30000113.5R27R27-S29 PolarHBondContact O-N 3.34Å
30S83.8Confident88Confident79 Ų7978.9 Ų78.955%0.55242%0.418SS*.SBendtrans-123.7-168.8178.3-57.80000109.6R27 C28 P32R27-S30 CarbonylContact O-C 3.43Å; R27-S30 PolarHBondContact O-N 3.35Å; C28-S30 VanDerWaalsContact C-N 3.33Å; S30-P32 WeakPolarHBondContact O-CD 3.27Å
31T83.4Confident87.8Confident134 Ų13480.1 Ų80.182%0.82243%0.425SS*.  trans-69.8107.5171.5-47.30000109.5
32P85.8Confident87.5Confident42 Ų4280.9 Ų80.927%0.27343%0.434SS..  trans-79.4151.7-172.832.6-31.9000111R27 S30 C36R27-P32 HydrophobicContact CB-CB 4.48Å; S30-P32 WeakPolarHBondContact O-CD 3.27Å; P32-C36 HydrophobicContact CB-CB 4.23Å
33P85.7Confident86.9Confident42 Ų4280.8 Ų80.827%0.27344%0.44SS..  trans-57.8152.6166.8-20.431000111.4Y13 T35 C36 Q37Y13-P33 HydrophobicContact CD2-CG 3.97Å; Y13-P33 HydrophobicContact CE2-CG 4.45Å; Y13-P33 HydrophobicContact CG-CG 4.07Å; P33-T35 PolarHBondContact O-N 2.79Å; P33-T35 VanDerWaalsContact O-N 3.15Å; P33-C36 WeakPolarHBondContact O-CA 3.44Å; P33-C36 WeakPolarHBondContact O-CB 3.35Å; P33-C36 PolarHBondContact O-N 3.38Å; P33-Q37 PolarHBondContact O-N 2.71Å
34L85.9Confident86Confident156 Ų15684 Ų8482%0.81745%0.451SS*.Hα-helixtrans-57.2-34.9-176-138125.9000112.9C36 Q37L34-C36 VanDerWaalsContact C-N 3.29Å; L34-C36 PolarHBondContact O-N 3.38Å; L34-Q37 PolarHBondContact O-N 2.86Å
35T85.7Confident85.1Confident108 Ų10888.3 Ų88.366%0.66348%0.478SS*.Hα-helixtrans-65-30.1175.451.40000113.2P33P33-T35 PolarHBondContact O-N 2.79Å; P33-T35 VanDerWaalsContact O-N 3.15Å
36C89.8Confident84.2Confident0 Ų087.4 Ų87.40%048%0.477CS..Hα-helixtrans-91.9-13.3-177.7-66.90000113.7C24 P32 P33 L34 R38 Y39 C40C24-C36 WeakPolarHBondContact CA-SG 3.33Å; C24-C36 HydrophobicContact CB-CB 3.5Å; C24-C36 WeakPolarHBondContact CB-SG 3.35Å; C24-C36 WeakPolarHBondContact SG-CA 3.37Å; C24-C36 WeakPolarHBondContact SG-CB 3.37Å; C24-C36 CovalentContact SG-SG 2.03Å; C24-C36 PolarHBondContact SG-SG 3.45Å; P32-C36 HydrophobicContact CB-CB 4.23Å; P33-C36 WeakPolarHBondContact O-CA 3.44Å; P33-C36 WeakPolarHBondContact O-CB 3.35Å; P33-C36 PolarHBondContact O-N 3.38Å; L34-C36 VanDerWaalsContact C-N 3.29Å; L34-C36 PolarHBondContact O-N 3.38Å; C36-R38 PolarHBondContact O-N 2.85Å; C36-Y39 WeakPolarHBondContact O-CB 3.42Å; C36-Y39 PolarHBondContact O-N 3.44Å; C36-Y39 VanDerWaalsContact O-N 3.13Å; C36-C40 PolarHBondContact O-N 3.32Å; C36-C40 PolarHBondContact O-SG 2.9Å; C36-C40 VanDerWaalsContact O-SG 3.38Å
37Q88.8Confident83.3Confident97 Ų9785.1 Ų85.145%0.45347%0.471SS..Hα-helixtrans-58.8-44.1-173.1-172.8175.9-0.800112.7P33 L34 Y39 C40 N41P33-Q37 PolarHBondContact O-N 2.71Å; L34-Q37 PolarHBondContact O-N 2.86Å; Q37-Y39 VanDerWaalsContact C-N 3.33Å; Q37-Y39 PolarHBondContact O-N 3.41Å; Q37-C40 PolarHBondContact O-N 3.14Å; Q37-N41 WeakPolarHBondContact O-CB 3.21Å; Q37-N41 PolarHBondContact O-N 2.98Å; Q37-N41 PolarHBondContact O-ND2 3.43Å
38R87.5Confident82.4Confident221 Ų22184.2 Ų84.283%0.83448%0.476SS*.Hα-helixtrans-60.9-42.6177.8-178.5-176.8-106.8157.4-5.8111.7C36 A42C36-R38 PolarHBondContact O-N 2.85Å; R38-A42 WeakPolarHBondContact O-CB 3.29Å; R38-A42 PolarHBondContact O-N 3.2Å; R38-A42 VanDerWaalsContact O-N 3.12Å
39Y88.7Confident81.6Confident70 Ų7090.5 Ų90.528%0.27550%0.5SS..Hα-helixtrans-65-48.5178.8176.5-92.6000111.3N11 C24 Q25 C36 Q37 N41 A42 S43N11-Y39 HydrophobicContact CB-CD2 3.73Å; N11-Y39 HydrophobicContact CB-CE2 4.01Å; N11-Y39 HydrophobicContact CB-CG 4.22Å; N11-Y39 WeakPolarHBondContact OD1-CD2 3.27Å; C24-Y39 HydrophobicContact CB-CD1 3.79Å; C24-Y39 HydrophobicContact CB-CE1 4.36Å; C24-Y39 HydrophobicContact CB-CG 4.31Å; Q25-Y39 HydrophobicContact CB-CE1 4.08Å; C36-Y39 WeakPolarHBondContact O-CB 3.42Å; C36-Y39 PolarHBondContact O-N 3.44Å; C36-Y39 VanDerWaalsContact O-N 3.13Å; Q37-Y39 VanDerWaalsContact C-N 3.33Å; Q37-Y39 PolarHBondContact O-N 3.41Å; Y39-N41 PolarHBondContact O-N 3.38Å; Y39-A42 PolarHBondContact O-N 2.86Å; Y39-S43 PolarHBondContact O-N 2.82Å
40C88.6Confident80.8Confident7 Ų786.4 Ų86.45%0.04748%0.476CS..Hα-helixtrans-63.9-40.4-179.4-63.70000112.6C28 C36 Q37 S43 M44C28-C40 WeakPolarHBondContact CA-SG 3.42Å; C28-C40 HydrophobicContact CB-CB 3.66Å; C28-C40 WeakPolarHBondContact CB-SG 3.35Å; C28-C40 WeakPolarHBondContact SG-CA 3.4Å; C28-C40 WeakPolarHBondContact SG-CB 3.24Å; C28-C40 CovalentContact SG-SG 2.04Å; C28-C40 PolarHBondContact SG-SG 2.95Å; C36-C40 PolarHBondContact O-N 3.32Å; C36-C40 PolarHBondContact O-SG 2.9Å; C36-C40 VanDerWaalsContact O-SG 3.38Å; Q37-C40 PolarHBondContact O-N 3.14Å; C40-S43 PolarHBondContact O-N 2.93Å; C40-M44 PolarHBondContact O-N 2.95Å
41N87.3Confident80.5Confident92 Ų9288 Ų8849%0.49248%0.476SS..Hα-helixtrans-63.6-42.9176.1-71.2-10.8000111.7Q37 Y39 S43 M44 T45Q37-N41 WeakPolarHBondContact O-CB 3.21Å; Q37-N41 PolarHBondContact O-N 2.98Å; Q37-N41 PolarHBondContact O-ND2 3.43Å; Y39-N41 PolarHBondContact O-N 3.38Å; N41-S43 VanDerWaalsContact C-N 3.33Å; N41-S43 PolarHBondContact O-N 3.28Å; N41-M44 PolarHBondContact O-N 3.3Å; N41-T45 WeakPolarHBondContact O-CG2 3.3Å; N41-T45 PolarHBondContact O-N 3.41Å; N41-T45 VanDerWaalsContact O-N 3.16Å; N41-T45 PolarHBondContact O-OG1 3.45Å
42A84.8Confident80.3Confident46 Ų4686.1 Ų86.138%0.3846%0.462SS..Hα-helixtrans-65.3-36175.700000112.3R38 Y39 T45 N46R38-A42 WeakPolarHBondContact O-CB 3.29Å; R38-A42 PolarHBondContact O-N 3.2Å; R38-A42 VanDerWaalsContact O-N 3.12Å; Y39-A42 PolarHBondContact O-N 2.86Å; A42-T45 PolarHBondContact O-OG1 2.97Å; A42-N46 PolarHBondContact O-N 3.27Å; A42-N46 PolarHBondContact O-ND2 3.42Å
43S78.8Confident80.2Confident53 Ų5386.8 Ų86.837%0.37147%0.471SS..Hα-helixtrans-64.3-43.7176.2-171.50000111.9Y39 C40 N41 S47Y39-S43 PolarHBondContact O-N 2.82Å; C40-S43 PolarHBondContact O-N 2.93Å; N41-S43 VanDerWaalsContact C-N 3.33Å; N41-S43 PolarHBondContact O-N 3.28Å; S43-S47 PolarHBondContact O-N 3.49Å; S43-S47 VanDerWaalsContact O-N 3.11Å
44M72.6Confident80.1Confident127 Ų12789.8 Ų89.863%0.62648%0.483SS*.Hα-helixtrans-66.8-40.6179-81.3-150.8167.700112.7C40 N41 N46 S47 V48C40-M44 PolarHBondContact O-N 2.95Å; N41-M44 PolarHBondContact O-N 3.3Å; M44-N46 VanDerWaalsContact C-N 3.33Å; M44-N46 PolarHBondContact O-N 2.9Å; M44-S47 PolarHBondContact O-N 3.28Å; M44-V48 WeakPolarHBondContact O-CG2 3.38Å; M44-V48 PolarHBondContact O-N 2.98Å
45T71.4Confident80.3Confident91 Ų9187 Ų8756%0.55847%0.469SS*.Hα-helixtrans-65.3-37.6179.755.10000112.2N41 A42 K49N41-T45 WeakPolarHBondContact O-CG2 3.3Å; N41-T45 PolarHBondContact O-N 3.41Å; N41-T45 VanDerWaalsContact O-N 3.16Å; N41-T45 PolarHBondContact O-OG1 3.45Å; A42-T45 PolarHBondContact O-OG1 2.97Å; T45-K49 VanDerWaalsContact O-CB 3.28Å; T45-K49 WeakPolarHBondContact O-CB 3.49Å; T45-K49 PolarHBondContact O-N 2.94Å
46N69.3Low80.5Confident109 Ų10991.6 Ų91.658%0.58347%0.474SS*.Hα-helixtrans-66-41.1173.8-72.4-44.4000112.1A42 M44 K49 G50A42-N46 PolarHBondContact O-N 3.27Å; A42-N46 PolarHBondContact O-ND2 3.42Å; M44-N46 VanDerWaalsContact C-N 3.33Å; M44-N46 PolarHBondContact O-N 2.9Å; N46-K49 PolarHBondContact O-N 3.42Å; N46-G50 PolarHBondContact O-N 2.93Å
47S69.3Low80.6Confident69 Ų6995.9 Ų95.948%0.48350%0.5SS..Hα-helixtrans-63.3-46.4177.6-169.20000112.2S43 M44 K49 G50 M51S43-S47 PolarHBondContact O-N 3.49Å; S43-S47 VanDerWaalsContact O-N 3.11Å; M44-S47 PolarHBondContact O-N 3.28Å; S47-K49 VanDerWaalsContact C-N 3.33Å; S47-K49 PolarHBondContact O-N 3.46Å; S47-G50 PolarHBondContact O-N 2.7Å; S47-M51 PolarHBondContact O-N 2.68Å
48V71.2Confident80.7Confident80 Ų8094.8 Ų94.849%0.48550%0.503SS..Hα-helixtrans-65.1-39.7178.5174.50000110.8M44 G50 M51 N52M44-V48 WeakPolarHBondContact O-CG2 3.38Å; M44-V48 PolarHBondContact O-N 2.98Å; V48-G50 PolarHBondContact O-N 2.92Å; V48-M51 PolarHBondContact O-N 3.35Å; V48-N52 WeakPolarHBondContact O-CB 3.29Å; V48-N52 PolarHBondContact O-N 3.36Å; V48-N52 PolarHBondContact O-ND2 2.97Å
49K70.2Confident81Confident159 Ų15989.9 Ų89.969%0.69149%0.492SS*.Hα-helixtrans-63.7-40.3176.5-171170.8-176.21760112.2T45 N46 S47 A53T45-K49 VanDerWaalsContact O-CB 3.28Å; T45-K49 WeakPolarHBondContact O-CB 3.49Å; T45-K49 PolarHBondContact O-N 2.94Å; N46-K49 PolarHBondContact O-N 3.42Å; S47-K49 VanDerWaalsContact C-N 3.33Å; S47-K49 PolarHBondContact O-N 3.46Å; K49-A53 PolarHBondContact O-N 3.49Å
50G69.1Low81.2Confident32 Ų3288.2 Ų88.233%0.3350%0.496SS..Hα-helixtrans-64.6-47.2175.800000112.7N46 S47 V48 N52 A53 I54N46-G50 PolarHBondContact O-N 2.93Å; S47-G50 PolarHBondContact O-N 2.7Å; V48-G50 PolarHBondContact O-N 2.92Å; G50-N52 PolarHBondContact O-N 3.35Å; G50-A53 PolarHBondContact O-N 2.99Å; G50-I54 WeakPolarHBondContact O-CD1 3.25Å; G50-I54 VanDerWaalsContact O-CG1 3.25Å; G50-I54 WeakPolarHBondContact O-CG1 3.42Å; G50-I54 PolarHBondContact O-N 3.11Å
51M77.4Confident81.5Confident112 Ų11293.2 Ų93.255%0.55252%0.522SS*.Hα-helixtrans-62.7-41.7178.4-77.416762.100112.5S47 V48 A53 I54 L55S47-M51 PolarHBondContact O-N 2.68Å; V48-M51 PolarHBondContact O-N 3.35Å; M51-A53 PolarHBondContact O-N 2.93Å; M51-I54 PolarHBondContact O-N 3.33Å; M51-L55 WeakPolarHBondContact O-CB 3.42Å; M51-L55 WeakPolarHBondContact O-CD1 3.27Å; M51-L55 WeakPolarHBondContact O-CG 3.46Å; M51-L55 PolarHBondContact O-N 3.15Å
52N78.3Confident81.9Confident96 Ų9692.2 Ų92.251%0.51352%0.522SS..Hα-helixtrans-64.1-39.9178.5-69.6-21.8000112.3V48 G50 W56V48-N52 WeakPolarHBondContact O-CB 3.29Å; V48-N52 PolarHBondContact O-N 3.36Å; V48-N52 PolarHBondContact O-ND2 2.97Å; G50-N52 PolarHBondContact O-N 3.35Å; N52-W56 WeakPolarHBondContact O-CB 3.36Å; N52-W56 PolarHBondContact O-N 3.48Å; N52-W56 VanDerWaalsContact O-N 3.08Å
53A82.9Confident82.5Confident56 Ų5696 Ų9646%0.46354%0.535SS..Hα-helixtrans-65-45.9175.600000111.4K49 G50 M51 W56 T57K49-A53 PolarHBondContact O-N 3.49Å; G50-A53 PolarHBondContact O-N 2.99Å; M51-A53 PolarHBondContact O-N 2.93Å; A53-W56 PolarHBondContact O-N 3.34Å; A53-T57 WeakPolarHBondContact O-CG2 3.33Å; A53-T57 PolarHBondContact O-N 3.02Å; A53-T57 PolarHBondContact O-OG1 3.33Å
54I85.6Confident83.3Confident104 Ų10498.7 Ų98.753%0.53354%0.544SS..Hα-helixtrans-63.2-47.6179.1-65.2162.4000110.7G50 M51 W56 T57 C58G50-I54 WeakPolarHBondContact O-CD1 3.25Å; G50-I54 VanDerWaalsContact O-CG1 3.25Å; G50-I54 WeakPolarHBondContact O-CG1 3.42Å; G50-I54 PolarHBondContact O-N 3.11Å; M51-I54 PolarHBondContact O-N 3.33Å; I54-W56 VanDerWaalsContact C-N 3.32Å; I54-W56 PolarHBondContact O-N 3.06Å; I54-T57 WeakPolarHBondContact CA-OG1 3.33Å; I54-T57 PolarHBondContact O-N 3.47Å; I54-T57 VanDerWaalsContact O-N 3.15Å; I54-T57 PolarHBondContact O-OG1 3.2Å; I54-C58 PolarHBondContact O-N 2.87Å; I54-C58 PolarHBondContact O-SG 3.03Å
55L88.4Confident84.5Confident98 Ų9897 Ų9751%0.51354%0.537SS..Hα-helixtrans-56.8-44.9177.2-81.3158.9000111.9M51 T57 C58 L59M51-L55 WeakPolarHBondContact O-CB 3.42Å; M51-L55 WeakPolarHBondContact O-CD1 3.27Å; M51-L55 WeakPolarHBondContact O-CG 3.46Å; M51-L55 PolarHBondContact O-N 3.15Å; L55-T57 VanDerWaalsContact C-N 3.35Å; L55-T57 PolarHBondContact O-N 3.47Å; L55-C58 PolarHBondContact O-N 3.45Å; L55-L59 WeakPolarHBondContact O-CB 3.4Å; L55-L59 WeakPolarHBondContact O-CG 3.36Å; L55-L59 PolarHBondContact O-N 3.48Å
56W89.9Confident85.7Confident205 Ų20596 Ų9678%0.77753%0.534SS*.Hα-helixtrans-63.2-41.1177.9-166.4-90.4000112.1N52 A53 I54 G60N52-W56 WeakPolarHBondContact O-CB 3.36Å; N52-W56 PolarHBondContact O-N 3.48Å; N52-W56 VanDerWaalsContact O-N 3.08Å; A53-W56 PolarHBondContact O-N 3.34Å; I54-W56 VanDerWaalsContact C-N 3.32Å; I54-W56 PolarHBondContact O-N 3.06Å; W56-G60 PolarHBondContact O-N 3.37Å
57T92.3Very high87Confident90 Ų9096 Ų9655%0.55253%0.533SS*.Hα-helixtrans-65.3-42.5176.157.40000112.5A53 I54 L55 G60 L61A53-T57 WeakPolarHBondContact O-CG2 3.33Å; A53-T57 PolarHBondContact O-N 3.02Å; A53-T57 PolarHBondContact O-OG1 3.33Å; I54-T57 WeakPolarHBondContact CA-OG1 3.33Å; I54-T57 PolarHBondContact O-N 3.47Å; I54-T57 VanDerWaalsContact O-N 3.15Å; I54-T57 PolarHBondContact O-OG1 3.2Å; L55-T57 VanDerWaalsContact C-N 3.35Å; L55-T57 PolarHBondContact O-N 3.47Å; T57-G60 PolarHBondContact O-N 3.08Å; T57-L61 WeakPolarHBondContact O-CB 3.06Å; T57-L61 PolarHBondContact O-N 2.76Å
58C92.2Very high88.3Confident74 Ų7495.5 Ų95.550%0.553%0.533SS..Hα-helixtrans-65.7-43.2177.8-69.70000112I54 L55 L61 S62I54-C58 PolarHBondContact O-N 2.87Å; I54-C58 PolarHBondContact O-SG 3.03Å; L55-C58 PolarHBondContact O-N 3.45Å; C58-L61 PolarHBondContact O-N 3.03Å; C58-S62 VanDerWaalsContact O-CB 3.29Å; C58-S62 WeakPolarHBondContact O-CB 3.37Å; C58-S62 PolarHBondContact O-N 3.46Å
59L93.1Very high89.5Confident117 Ų11795.5 Ų95.561%0.61353%0.533SS*.Hα-helixtrans-62.3-46.4177-78.9163.7000111.6L55 S62 L63L55-L59 WeakPolarHBondContact O-CB 3.4Å; L55-L59 WeakPolarHBondContact O-CG 3.36Å; L55-L59 PolarHBondContact O-N 3.48Å; L59-S62 PolarHBondContact O-N 3.37Å; L59-L63 WeakPolarHBondContact O-CB 3.43Å; L59-L63 PolarHBondContact O-N 3.21Å
60G93.1Very high90.7Very high35 Ų3594.7 Ų94.736%0.36153%0.53SS..Hα-helixtrans-60.5-48.717700000111.9W56 T57 S62 L63 I64W56-G60 PolarHBondContact O-N 3.37Å; T57-G60 PolarHBondContact O-N 3.08Å; G60-S62 PolarHBondContact O-N 3.28Å; G60-L63 PolarHBondContact O-N 2.9Å; G60-I64 VanDerWaalsContact O-CG1 3.27Å; G60-I64 WeakPolarHBondContact O-CG1 3.4Å; G60-I64 PolarHBondContact O-N 2.63Å; G60-I64 VanDerWaalsContact O-N 3.11Å
61L95.3Very high92Very high112 Ų11296.4 Ų96.459%0.58653%0.534SS*.Hα-helixtrans-62.8-44.4-179.8-170.572.1000111.8T57 C58 L63 I64 I65T57-L61 WeakPolarHBondContact O-CB 3.06Å; T57-L61 PolarHBondContact O-N 2.76Å; C58-L61 PolarHBondContact O-N 3.03Å; L61-L63 VanDerWaalsContact C-N 3.32Å; L61-L63 PolarHBondContact O-N 3.13Å; L61-I64 PolarHBondContact O-N 3.35Å; L61-I65 HydrophobicContact CD1-CD1 4.36Å; L61-I65 HydrophobicContact CD2-CD1 4.29Å; L61-I65 HydrophobicContact CG-CD1 3.82Å; L61-I65 HydrophobicContact CG-CG1 4.46Å; L61-I65 VanDerWaalsContact O-CG1 3.3Å; L61-I65 WeakPolarHBondContact O-CG1 3.34Å; L61-I65 PolarHBondContact O-N 3.19Å
62S95.3Very high92.9Very high71 Ų7195.8 Ų95.850%0.49753%0.532SS..Hα-helixtrans-60.8-41.3178.6-172.20000112C58 L59 G60 S66C58-S62 VanDerWaalsContact O-CB 3.29Å; C58-S62 WeakPolarHBondContact O-CB 3.37Å; C58-S62 PolarHBondContact O-N 3.46Å; L59-S62 PolarHBondContact O-N 3.37Å; G60-S62 PolarHBondContact O-N 3.28Å; S62-S66 WeakPolarHBondContact O-CB 3.43Å; S62-S66 PolarHBondContact O-N 2.88Å; S62-S66 PolarHBondContact O-OG 2.86Å
63L96.4Very high93.6Very high125 Ų12594.9 Ų94.965%0.65453%0.53SS*.Hα-helixtrans-65-44178.7-173.670.1000111.5L59 G60 L61 S66 L67L59-L63 WeakPolarHBondContact O-CB 3.43Å; L59-L63 PolarHBondContact O-N 3.21Å; G60-L63 PolarHBondContact O-N 2.9Å; L61-L63 VanDerWaalsContact C-N 3.32Å; L61-L63 PolarHBondContact O-N 3.13Å; L63-S66 PolarHBondContact O-N 3.24Å; L63-L67 WeakPolarHBondContact O-CB 3.44Å; L63-L67 PolarHBondContact O-N 3.48Å
64I96.4Very high94.1Very high110 Ų11098 Ų9856%0.56453%0.534SS*.Hα-helixtrans-65.8-45.8179.8-63.8-66.6000111G60 L61 S66 L67 A68G60-I64 VanDerWaalsContact O-CG1 3.27Å; G60-I64 WeakPolarHBondContact O-CG1 3.4Å; G60-I64 PolarHBondContact O-N 2.63Å; G60-I64 VanDerWaalsContact O-N 3.11Å; L61-I64 PolarHBondContact O-N 3.35Å; I64-S66 VanDerWaalsContact C-N 3.32Å; I64-S66 PolarHBondContact O-N 3.31Å; I64-L67 PolarHBondContact O-N 3.48Å; I64-A68 WeakPolarHBondContact O-CB 3.27Å; I64-A68 PolarHBondContact O-N 3.41Å
65I97.1Very high94.4Very high92 Ų9297 Ų9747%0.47253%0.529SS..Hα-helixtrans-60-44.9176.2-68.1169.7000110.3L61 L67 A68 V69L61-I65 HydrophobicContact CD1-CD1 4.36Å; L61-I65 HydrophobicContact CD2-CD1 4.29Å; L61-I65 HydrophobicContact CG-CD1 3.82Å; L61-I65 HydrophobicContact CG-CG1 4.46Å; L61-I65 VanDerWaalsContact O-CG1 3.3Å; L61-I65 WeakPolarHBondContact O-CG1 3.34Å; L61-I65 PolarHBondContact O-N 3.19Å; I65-L67 VanDerWaalsContact C-N 3.33Å; I65-L67 PolarHBondContact O-N 3.47Å; I65-A68 PolarHBondContact O-N 3.11Å; I65-V69 HydrophobicContact CG2-CG2 4.38Å; I65-V69 WeakPolarHBondContact O-CG2 3.32Å; I65-V69 PolarHBondContact O-N 2.97Å
66S96.8Very high94.3Very high69 Ų6997.4 Ų97.448%0.48353%0.531SS..Hα-helixtrans-60-43.7178.4-58.80000111.7S62 L63 I64 F70S62-S66 WeakPolarHBondContact O-CB 3.43Å; S62-S66 PolarHBondContact O-N 2.88Å; S62-S66 PolarHBondContact O-OG 2.86Å; L63-S66 PolarHBondContact O-N 3.24Å; I64-S66 VanDerWaalsContact C-N 3.32Å; I64-S66 PolarHBondContact O-N 3.31Å; S66-F70 WeakPolarHBondContact O-CB 3.28Å; S66-F70 PolarHBondContact O-N 2.97Å
67L96.8Very high94.3Very high109 Ų10996.4 Ų96.457%0.57153%0.527SS*.Hα-helixtrans-66-42.3177.5-172.567.4000111.8L63 I64 I65 F70 V71L63-L67 WeakPolarHBondContact O-CB 3.44Å; L63-L67 PolarHBondContact O-N 3.48Å; I64-L67 PolarHBondContact O-N 3.48Å; I65-L67 VanDerWaalsContact C-N 3.33Å; I65-L67 PolarHBondContact O-N 3.47Å; L67-F70 PolarHBondContact O-N 3.43Å; L67-V71 WeakPolarHBondContact O-CG2 3.22Å; L67-V71 PolarHBondContact O-N 3.22Å
68A96.8Very high93.9Very high59 Ų5997.7 Ų97.749%0.48853%0.525SS..Hα-helixtrans-61.9-45.3177.600000111.7I64 I65 F70 V71 L72I64-A68 WeakPolarHBondContact O-CB 3.27Å; I64-A68 PolarHBondContact O-N 3.41Å; I65-A68 PolarHBondContact O-N 3.11Å; A68-F70 VanDerWaalsContact C-N 3.34Å; A68-F70 PolarHBondContact O-N 3.19Å; A68-V71 PolarHBondContact O-N 3.04Å; A68-L72 VanDerWaalsContact O-CB 3.29Å; A68-L72 WeakPolarHBondContact O-CB 3.48Å; A68-L72 PolarHBondContact O-N 2.97Å
69V96.6Very high93.1Very high81 Ų81100.7 Ų100.749%0.49153%0.534SS..Hα-helixtrans-63.3-40.6175.6172.70000111I65 L72 T73I65-V69 HydrophobicContact CG2-CG2 4.38Å; I65-V69 WeakPolarHBondContact O-CG2 3.32Å; I65-V69 PolarHBondContact O-N 2.97Å; V69-L72 PolarHBondContact O-N 3.24Å; V69-T73 WeakPolarHBondContact O-CB 3.25Å; V69-T73 PolarHBondContact O-N 3.33Å; V69-T73 PolarHBondContact O-OG1 2.89Å
70F95.9Very high91.8Very high142 Ų14298.4 Ų98.462%0.62353%0.527SS*.Hα-helixtrans-62.5-47.1177-178.3-98.4000112S66 L67 A68 T73 F74S66-F70 WeakPolarHBondContact O-CB 3.28Å; S66-F70 PolarHBondContact O-N 2.97Å; L67-F70 PolarHBondContact O-N 3.43Å; A68-F70 VanDerWaalsContact C-N 3.34Å; A68-F70 PolarHBondContact O-N 3.19Å; F70-T73 PolarHBondContact O-N 2.81Å; F70-F74 WeakPolarHBondContact O-CB 3.05Å; F70-F74 PolarHBondContact O-N 3.03Å
71V95.8Very high90.3Very high67 Ų67100.9 Ų100.941%0.40654%0.539SS..Hα-helixtrans-64-44.9176.8173.80000110.7L67 A68 T73 F74 L75L67-V71 WeakPolarHBondContact O-CG2 3.22Å; L67-V71 PolarHBondContact O-N 3.22Å; A68-V71 PolarHBondContact O-N 3.04Å; V71-T73 VanDerWaalsContact C-N 3.34Å; V71-T73 PolarHBondContact O-N 2.88Å; V71-F74 PolarHBondContact O-N 2.97Å; V71-L75 HydrophobicContact CG1-CD1 3.93Å; V71-L75 HydrophobicContact CG1-CG 4.2Å; V71-L75 WeakPolarHBondContact O-CB 3.02Å; V71-L75 VanDerWaalsContact O-CG 3.27Å; V71-L75 WeakPolarHBondContact O-CG 3.45Å; V71-L75 PolarHBondContact O-N 3.21Å
72L95Very high88.8Confident100 Ų100102.7 Ų102.752%0.52455%0.545SS..Hα-helixtrans-58.8-46.5176.7-178.562.9000111.1A68 V69 F74 L75 L76A68-L72 VanDerWaalsContact O-CB 3.29Å; A68-L72 WeakPolarHBondContact O-CB 3.48Å; A68-L72 PolarHBondContact O-N 2.97Å; V69-L72 PolarHBondContact O-N 3.24Å; L72-F74 VanDerWaalsContact C-N 3.33Å; L72-F74 PolarHBondContact O-N 3.34Å; L72-L75 PolarHBondContact O-N 2.9Å; L72-L76 HydrophobicContact CD1-CD1 4.35Å; L72-L76 HydrophobicContact CD1-CG 4.35Å; L72-L76 HydrophobicContact CG-CD1 4.06Å; L72-L76 HydrophobicContact CG-CG 4.47Å; L72-L76 WeakPolarHBondContact O-CB 3.02Å; L72-L76 VanDerWaalsContact O-CG 3.23Å; L72-L76 WeakPolarHBondContact O-CG 3.25Å; L72-L76 PolarHBondContact O-N 3.28Å
73T93.4Very high86.8Confident76 Ų76103 Ų10347%0.46654%0.544SS..Hα-helixtrans-63.4-40.4177.2-52.30000111.4V69 F70 V71 L76 R77V69-T73 WeakPolarHBondContact O-CB 3.25Å; V69-T73 PolarHBondContact O-N 3.33Å; V69-T73 PolarHBondContact O-OG1 2.89Å; F70-T73 PolarHBondContact O-N 2.81Å; V71-T73 VanDerWaalsContact C-N 3.34Å; V71-T73 PolarHBondContact O-N 2.88Å; T73-L76 PolarHBondContact O-N 3.41Å; T73-R77 WeakPolarHBondContact O-CB 3.32Å; T73-R77 PolarHBondContact O-N 3.2Å
74F93.3Very high84.5Confident122 Ų122104.2 Ų104.254%0.53555%0.551SS.*Hα-helixtrans-64.9-43.3176.4-179.8-96.7000111.9F70 V71 L72 R77 K78F70-F74 WeakPolarHBondContact O-CB 3.05Å; F70-F74 PolarHBondContact O-N 3.03Å; V71-F74 PolarHBondContact O-N 2.97Å; L72-F74 VanDerWaalsContact C-N 3.33Å; L72-F74 PolarHBondContact O-N 3.34Å; F74-R77 PolarHBondContact O-N 3.33Å; F74-K78 HydrophobicContact CE1-CD 4.5Å; F74-K78 VanDerWaalsContact O-CB 3.24Å; F74-K78 WeakPolarHBondContact O-CB 3.49Å; F74-K78 PolarHBondContact O-N 3.38Å
75L92.1Very high82.4Confident84 Ų84108 Ų10844%0.4456%0.564SS.*Hα-helixtrans-64.6-45.1175.8-70.2175.7000111.3V71 L72 R77 K78 M79V71-L75 HydrophobicContact CG1-CD1 3.93Å; V71-L75 HydrophobicContact CG1-CG 4.2Å; V71-L75 WeakPolarHBondContact O-CB 3.02Å; V71-L75 VanDerWaalsContact O-CG 3.27Å; V71-L75 WeakPolarHBondContact O-CG 3.45Å; V71-L75 PolarHBondContact O-N 3.21Å; L72-L75 PolarHBondContact O-N 2.9Å; L75-R77 VanDerWaalsContact C-N 3.34Å; L75-R77 PolarHBondContact O-N 2.04Å; L75-K78 PolarHBondContact O-N 2.94Å; L75-M79 VanDerWaalsContact O-CB 3.27Å; L75-M79 WeakPolarHBondContact O-CB 3.49Å; L75-M79 WeakPolarHBondContact O-CG 3.41Å; L75-M79 PolarHBondContact O-N 3.05Å
76L87.4Confident80.4Confident106 Ų106109.6 Ų109.656%0.55557%0.573SS**Hα-helixtrans-61.2-42.3174.9-72173.5000111.2L72 T73 M79 S80L72-L76 HydrophobicContact CD1-CD1 4.35Å; L72-L76 HydrophobicContact CD1-CG 4.35Å; L72-L76 HydrophobicContact CG-CD1 4.06Å; L72-L76 HydrophobicContact CG-CG 4.47Å; L72-L76 WeakPolarHBondContact O-CB 3.02Å; L72-L76 VanDerWaalsContact O-CG 3.23Å; L72-L76 WeakPolarHBondContact O-CG 3.25Å; L72-L76 PolarHBondContact O-N 3.28Å; T73-L76 PolarHBondContact O-N 3.41Å; L76-M79 CarbonylContact O-C 3.42Å; L76-M79 PolarHBondContact O-N 2.04Å; L76-S80 VanDerWaalsContact O-CB 3.23Å; L76-S80 WeakPolarHBondContact O-CB 3.42Å; L76-S80 PolarHBondContact O-N 2.85Å; L76-S80 PolarHBondContact O-OG 2.03Å
77R88.1Confident78.2Confident184 Ų184114.7 Ų114.769%0.69459%0.589SS**Hα-helixtrans-69.9-36.7178.3-163.9175.7-173.8176.22.5112.3T73 F74 L75 S80 S81T73-R77 WeakPolarHBondContact O-CB 3.32Å; T73-R77 PolarHBondContact O-N 3.2Å; F74-R77 PolarHBondContact O-N 3.33Å; L75-R77 VanDerWaalsContact C-N 3.34Å; L75-R77 PolarHBondContact O-N 2.04Å; R77-S80 WeakPolarHBondContact CA-OG 3.07Å; R77-S80 PolarHBondContact O-N 3.02Å; R77-S80 PolarHBondContact O-OG 3.41Å; R77-S80 VanDerWaalsContact O-OG 3.09Å; R77-S81 WeakPolarHBondContact O-CB 3.05Å; R77-S81 PolarHBondContact O-N 3.33Å; R77-S81 VanDerWaalsContact O-N 3.1Å; R77-S81 PolarHBondContact O-OG 3.13Å
78K84.6Confident75.9Confident116 Ų116119.3 Ų119.350%0.50461%0.605SS.*Hα-helixtrans-65-47172.9-176.8178.4175.5-179.70110.3F74 L75 S80 S81 E82F74-K78 HydrophobicContact CE1-CD 4.5Å; F74-K78 VanDerWaalsContact O-CB 3.24Å; F74-K78 WeakPolarHBondContact O-CB 3.49Å; F74-K78 PolarHBondContact O-N 3.38Å; L75-K78 PolarHBondContact O-N 2.94Å; K78-S80 VanDerWaalsContact C-N 3.33Å; K78-S80 PolarHBondContact O-N 3.15Å; K78-S81 PolarHBondContact O-N 2.96Å; K78-E82 PolarHBondContact O-N 3.44Å
79M75.6Confident73.7Confident138 Ų138124.4 Ų124.468%0.6862%0.616SS**Hα-helixtrans-75.5-11.2176.1-73.6-170.5170.100114.2L75 L76 P83L75-M79 VanDerWaalsContact O-CB 3.27Å; L75-M79 WeakPolarHBondContact O-CB 3.49Å; L75-M79 WeakPolarHBondContact O-CG 3.41Å; L75-M79 PolarHBondContact O-N 3.05Å; L76-M79 CarbonylContact O-C 3.42Å; L76-M79 PolarHBondContact O-N 2.04Å; M79-P83 WeakPolarHBondContact O-CD 3.49Å; M79-P83 WeakPolarHBondContact O-CG 3.35Å
80S66.7Low71.3Confident68 Ų68127.5 Ų127.548%0.47663%0.63SS.*Hα-helixtrans-92.7-20.8171.271.70000111.4L76 R77 K78L76-S80 VanDerWaalsContact O-CB 3.23Å; L76-S80 WeakPolarHBondContact O-CB 3.42Å; L76-S80 PolarHBondContact O-N 2.85Å; L76-S80 PolarHBondContact O-OG 2.03Å; R77-S80 WeakPolarHBondContact CA-OG 3.07Å; R77-S80 PolarHBondContact O-N 3.02Å; R77-S80 PolarHBondContact O-OG 3.41Å; R77-S80 VanDerWaalsContact O-OG 3.09Å; K78-S80 VanDerWaalsContact C-N 3.33Å; K78-S80 PolarHBondContact O-N 3.15Å
81S61.1Low69Low87 Ų87128 Ų12861%0.60864%0.644SS**Hα-helixtrans-81.7-22.3176.9-56.30000112.5R77 K78R77-S81 WeakPolarHBondContact O-CB 3.05Å; R77-S81 PolarHBondContact O-N 3.33Å; R77-S81 VanDerWaalsContact O-N 3.1Å; R77-S81 PolarHBondContact O-OG 3.13Å; K78-S81 PolarHBondContact O-N 2.96Å
82E62.7Low66.4Low151 Ų151128.4 Ų128.471%0.70666%0.663SS**THydrogen-bonded Turntrans-97.9-25.4-174-138143.7101.300116.2K78K78-E82 PolarHBondContact O-N 3.44Å
83P53.5Low63.8Low76 Ų76130.1 Ų130.149%0.49468%0.683SS.*THydrogen-bonded Turntrans-102.9-7.8178.135.8-30.7000114.5M79 K85 D86M79-P83 WeakPolarHBondContact O-CD 3.49Å; M79-P83 WeakPolarHBondContact O-CG 3.35Å; P83-K85 PolarHBondContact O-N 2.97Å; P83-D86 PolarHBondContact O-N 3.41Å
84L49.2Very low61.6Low151 Ų151129.5 Ų129.579%0.79169%0.692SS**THydrogen-bonded Turntrans-77.634.5173.2-157105.1000112.9
85K51.8Low58.9Low191 Ų191129 Ų12983%0.8370%0.695SS**THydrogen-bonded Turntrans-131.7-5.2170.5-82.3-170.9174.7-178.10114.3P83P83-K85 PolarHBondContact O-N 2.97Å
86D54.1Low56.2Low125 Ų125130 Ų13067%0.66870%0.7SS**SBendtrans-121.98-178.2-123.3-9.6000115.5P83P83-D86 PolarHBondContact O-N 3.41Å
87E51.3Low53.5Low176 Ų176127.8 Ų127.882%0.82270%0.702SS**SBendtrans-114.545.9173.7-156.7161.6115.500112.3
88F49.8Very low50.9Low206 Ų206127.4 Ų127.490%0.90471%0.71SS**SBendtrans-139.234.5161.8-90.3-72.2000111.7
89K50.1Low48.6Very low165 Ų165126 Ų12672%0.71772%0.72SS**SBendtrans-121.5-8.8176.2-76-171.7175.7177.80116.1
90N46Very low46.7Very low146 Ų146126.6 Ų126.678%0.78173%0.726SS**SBendtrans-132.947.5-169.7-57.7-43.5000113.6
91T46.7Very low45.3Very low152 Ų152130.1 Ų130.193%0.93374%0.738SS**SBendtrans-155.5107.6156.7-550000108.6
92G42.7Very low44Very low77 Ų77133.1 Ų133.179%0.79475%0.747SS**  trans116.340.8168.700000117
93S39.8Very low42.7Very low135 Ų135133 Ų13394%0.94475%0.751SS**  trans-124.551.3156.1-178.50000109.8
94G47.2Very low41.7Very low64 Ų64137.4 Ų137.466%0.6677%0.765SS**  trans-122.8130.7154.300000105.7
95L36.6Very low40.8Very low112 Ų112139.7 Ų139.759%0.58677%0.768SS**SBendtrans103.7103.9159.2-145.6154000116.6I112 V113L95-I112 HydrophobicContact CD1-CG2 3.89Å; L95-I112 HydrophobicContact CD2-CG2 4.4Å; L95-I112 VanDerWaalsContact CD2-O 3.26Å; L95-I112 WeakPolarHBondContact CD2-O 3.38Å; L95-V113 HydrophobicContact CD2-CB 4.31Å; L95-V113 WeakPolarHBondContact CD2-O 3.47Å
96L34.3Very low40.1Very low105 Ų105134.4 Ų134.455%0.5577%0.768SS.*  trans66.7137.1161.2-85170.9000120.3I112 V113 L114L96-I112 WeakPolarHBondContact CD1-O 3.44Å; L96-I112 WeakPolarHBondContact CG-O 3.12Å; L96-V113 WeakPolarHBondContact CD1-O 3.47Å; L96-L114 HydrophobicContact CB-CD1 4.32Å
97G31.6Very low39.2Very low58 Ų58139.7 Ų139.760%0.59878%0.779SS**  cis-175.1120.87.100000108.4A99G97-A99 PolarHBondContact O-N 2.92Å; G97-A99 VanDerWaalsContact O-N 3.16Å
98M34.4Very low38.4Very low176 Ų176137.6 Ų137.687%0.86778%0.778SS**  trans-76.394.7179.2-175.9152.3169.600109.2I101M98-I101 HydrophobicContact CE-CD1 4.5Å
99A35Very low37.5Very low86 Ų86131.3 Ų131.371%0.71177%0.772SS**  trans-92.7100.5167.300000109G97G97-A99 PolarHBondContact O-N 2.92Å; G97-A99 VanDerWaalsContact O-N 3.16Å
100N36.3Very low36.8Very low151 Ų151131.1 Ų131.181%0.80778%0.778SS**  trans160.579.7146.6-85.3-47.3000110.1
101I36.5Very low36.4Very low143 Ų143131.7 Ų131.773%0.73378%0.776SS**  trans-142.6101.5147-59.2-174.3000106.7M98 L103M98-I101 HydrophobicContact CE-CD1 4.5Å; I101-L103 PolarHBondContact O-N 3.27Å
102D35Very low36Very low149 Ų149128.4 Ų128.480%0.79775%0.752SS**  trans-69.1108.2158.8173.733.2000108.2
103L33.9Very low35.7Very low150 Ų150129.7 Ų129.779%0.78574%0.744SS**  trans-167.499.2147.3-153.367000110.9I101I101-L103 PolarHBondContact O-N 3.27Å
104E33.7Very low35.4Very low168 Ų168129 Ų12979%0.78573%0.73SS**  trans27.2127.8142.7-75.3-72.4127.400120.5
105K30.7Very low35.2Very low199 Ų199132 Ų13287%0.86574%0.737SS**  trans100.674.8148.8-149.4168.5-173.8172.60118.6
106G36.5Very low35.3Very low80 Ų80138.3 Ų138.383%0.82575%0.753SS**  58.689.2128.700000119
107R35.5Very low35.4Very low235 Ų235136.9 Ų136.989%0.88776%0.764SS**  trans-157.8116.2162.1-157.6166.8-179.9157.6-1.4113.1
108T33.2Very low35.6Very low133 Ų133142.1 Ų142.182%0.81678%0.777SS**  trans45.5112.9141.3-36.80000120.8
109G31.2Very low35.3Very low74 Ų74140.7 Ų140.776%0.76377%0.769SS**  trans96.4103.6132.800000119
110D35.7Very low35.4Very low161 Ų161145.2 Ų145.286%0.86177%0.769SS**  trans4.7141.9138.7-103.1-14.1000118.2
111E37.8Very low35.5Very low157 Ų157144.7 Ų144.773%0.73477%0.771SS**  cis-178.7171.932-173.2-160.4151.500108.9
112I37.8Very low36.1Very low84 Ų84144 Ų14443%0.43177%0.773SS.*  trans99.2103.5146.1-50.4-179.5000121.5L95 L96L95-I112 HydrophobicContact CD1-CG2 3.89Å; L95-I112 HydrophobicContact CD2-CG2 4.4Å; L95-I112 VanDerWaalsContact CD2-O 3.26Å; L95-I112 WeakPolarHBondContact CD2-O 3.38Å; L96-I112 WeakPolarHBondContact CD1-O 3.44Å; L96-I112 WeakPolarHBondContact CG-O 3.12Å
113V36.3Very low36.5Very low103 Ų103145.8 Ų145.862%0.62478%0.777SS**  75119.3122.7-172.90000126.6L95 L96L95-V113 HydrophobicContact CD2-CB 4.31Å; L95-V113 WeakPolarHBondContact CD2-O 3.47Å; L96-V113 WeakPolarHBondContact CD1-O 3.47Å
114L34.9Very low36.6Very low122 Ų122146.9 Ų146.964%0.63978%0.778SS**  trans-126.4158.2151.6-104.8153.4000107.7L96L96-L114 HydrophobicContact CB-CD1 4.32Å
115P42.8Very low36.8Very low126 Ų126145.1 Ų145.182%0.81878%0.782SS**  cis-15017949.636.9-12.8000118.2
116R38.4Very low37.1Very low244 Ų244141.8 Ų141.892%0.92178%0.779SS**  trans-102.1139.8173.4-176.6-171.5-158.5-1756.6109.6
117G35.2Very low37Very low75 Ų75144.3 Ų144.377%0.77378%0.783SS**  trans169.5120.8164.600000114.7
118L35.9Very low37.4Very low169 Ų169141.9 Ų141.989%0.88578%0.781SS**  trans-51141.9170.1-91.1112.8000113.4
119E29.9Very low37.7Very low146 Ų146142 Ų14268%0.68278%0.777SS**  166.7147121-94.1178.3110.800111.7
120Y36.4Very low38.2Very low181 Ų181144.3 Ų144.371%0.7178%0.78SS**  trans-52.8149178.847.1-89.1000114.4
121T37.7Very low38.3Very low139 Ų139143.3 Ų143.385%0.85377%0.773SS**  trans-151.1114.9144.539.40000110.3
122V50.6Low38.7Very low128 Ų128144.8 Ų144.878%0.77678%0.777SS**  trans-71.4131.2156.9164.30000106.2E124V122-E124 PolarHBondContact O-N 3.43Å
123E41.8Very low38.8Very low188 Ų188148.8 Ų148.888%0.87980%0.799SS**  trans-67.496.6167.8-81.1-176.3141.700108.8C125E123-C125 PolarHBondContact O-N 3.12Å
124E36.9Very low38.8Very low173 Ų173153.2 Ų153.281%0.80881%0.81SS**  trans-75.5105.6162.5-82.4179153.800108.6V122 T126V122-E124 PolarHBondContact O-N 3.43Å; E124-T126 PolarHBondContact O-N 3.16Å
125C36.8Very low39Very low130 Ų130153.6 Ų153.688%0.87882%0.82SS**  trans-67.7112.5164.5-75.40000109.1E123E123-C125 PolarHBondContact O-N 3.12Å
126T38.4Very low38.7Very low130 Ų130157.2 Ų157.280%0.79882%0.823SS**  trans-73.1133.8174.836.80000111.9E124E124-T126 PolarHBondContact O-N 3.16Å
127C34.1Very low39.2Very low133 Ų133152.2 Ų152.290%0.89982%0.819SS**  trans-143.990.6154.4-169.90000108.5
128E44.4Very low39.6Very low183 Ų183154.7 Ų154.786%0.85582%0.815SS**  trans-93.4139.2155.7-68.2176.4134.700105.4
129D38Very low39.7Very low136 Ų136152 Ų15273%0.72781%0.81SS**  cis-166147.827-165.2-5.1000106.7
130C42.3Very low40.6Very low122 Ų122151.4 Ų151.482%0.82481%0.811SS**  trans-179.982.4149.2-93.50000112.2
131I38.5Very low41.6Very low140 Ų140150.7 Ų150.772%0.71881%0.814SS**  53.2111.6129.2-55.2-175.9000119.7
132K46Very low42Very low188 Ų188150 Ų15082%0.81781%0.813SS**  trans26107.4142.3-69179.4178.5-1800117.8
133N39.7Very low42.2Very low168 Ų168152.6 Ų152.690%0.89882%0.815SS**  -152.2141.3128-89.9-31.6000110.2
134K36.6Very low42.8Very low197 Ų197149.4 Ų149.486%0.85781%0.81SS**  trans-56.8147-176.7-67.6-163.3175.3-170.80112K136K134-K136 PolarHBondContact O-N 3.42Å
135P38.8Very low43.5Very low129 Ų129148.7 Ų148.784%0.83881%0.811SS**  trans-72.5114.4175.930.1-30.9000109
136K35.4Very low43.9Very low203 Ų203148.1 Ų148.188%0.88381%0.806SS**  trans-90.3113.1153-88.8-173175.3-178.50106.9K134 D138K134-K136 PolarHBondContact O-N 3.42Å; K136-D138 PolarHBondContact O-N 3.04Å
137V49.9Very low44.7Very low138 Ų138147 Ų14784%0.83681%0.809SS**  trans-26.1113.6149.5169.70000109.9
138D43.6Very low45.8Very low128 Ų128149.5 Ų149.568%0.68481%0.81SS**  160.5101.5111-150.9-1.6000107.2K136K136-D138 PolarHBondContact O-N 3.04Å
139S36.9Very low46.2Very low113 Ų113149.4 Ų149.479%0.7981%0.81SS**  trans-147.760.2168.8-162.30000108.1H141S139-H141 VanDerWaalsContact C-N 3.32Å; S139-H141 PolarHBondContact O-N 3.49Å
140D50.8Low47.2Very low132 Ų132152.1 Ų152.171%0.70682%0.818SS**  trans-60.6101.9153.1-76.9-27.2000106.8
141H57.4Low47.8Very low166 Ų166149.5 Ų149.577%0.76981%0.812SS**  trans179.164.7145.9-78.5-16.9000109.1S139S139-H141 VanDerWaalsContact C-N 3.32Å; S139-H141 PolarHBondContact O-N 3.49Å
142C44.3Very low48.8Very low124 Ų124148 Ų14884%0.83882%0.821SS**  trans-94.1107.6154-76.20000107.2P144C142-P144 WeakPolarHBondContact O-CD 3.38Å
143F55.4Low49.4Very low183 Ų183145.5 Ų145.580%0.80382%0.821SS**  trans-67.6121.5164.5-76.3-85.6000107.9L145F143-L145 PolarHBondContact O-N 3.26Å; F143-L145 VanDerWaalsContact O-N 3.09Å
144P54.4Low50.2Low122 Ų122144.7 Ų144.779%0.79282%0.816SS**  trans-71.6111.1175.227.6-29.5000108.2C142C142-P144 WeakPolarHBondContact O-CD 3.38Å
145L51.4Low51Low157 Ų157142.7 Ų142.782%0.82281%0.813SS**PPolyproline II helixtrans-67.1132.7163.9-67172.6000107.8F143 A147F143-L145 PolarHBondContact O-N 3.26Å; F143-L145 VanDerWaalsContact O-N 3.09Å; L145-A147 PolarHBondContact O-N 3.3Å
146P45.3Very low51.9Low119 Ų119142.3 Ų142.377%0.77381%0.808SS**PPolyproline II helixtrans-67.3121.8-178.226.2-31.8000110M148P146-M148 PolarHBondContact O-N 3.34Å
147A54.9Low53.2Low105 Ų105138.1 Ų138.187%0.86880%0.8SS**PPolyproline II helixtrans-70.7123.316900000109.1L145L145-A147 PolarHBondContact O-N 3.3Å
148M57Low54.1Low187 Ų187137.3 Ų137.392%0.92180%0.795SS**  trans-87.9112.4171.2-77.617649.900109.6P146P146-M148 PolarHBondContact O-N 3.34Å
149E53.7Low54.4Low181 Ų181140.8 Ų140.885%0.84680%0.804SS**SBendtrans-156.4107.2136-160.3171.9133.200108.4
150E59Low55.1Low192 Ų192140.6 Ų140.690%0.89780%0.799SS**SBendtrans53.881.2156.5-55.9-95.7143.200117.7
151G53.9Low55.2Low68 Ų68140.9 Ų140.970%0.70180%0.8SS**  trans166.7124.1162.300000114.3T153G151-T153 PolarHBondContact O-N 2.88Å
152A60.7Low54.5Low109 Ų109139.3 Ų139.390%0.90180%0.797SS**PPolyproline II helixtrans-57121.1-173.900000113.8
153T57.4Low54.4Low135 Ų135142.6 Ų142.683%0.82879%0.794SS**PPolyproline II helixtrans-87.9118.2171.649.70000110.7G151 L155G151-T153 PolarHBondContact O-N 2.88Å; T153-L155 PolarHBondContact O-N 3.02Å
154I58Low53.3Low151 Ų151138.9 Ų138.977%0.77479%0.789SS**PPolyproline II helixtrans-75.7117.5168.1-67.4173.8000108.3V156I154-V156 HydrophobicContact CG2-CG2 4.11Å; I154-V156 PolarHBondContact O-N 3.2Å; I154-V156 VanDerWaalsContact O-N 3.13Å
155L53.5Low52.6Low154 Ų154140.5 Ų140.581%0.80679%0.791SS**  trans-73.299173-163.585.9000109.2T153 T157T153-L155 PolarHBondContact O-N 3.02Å; L155-T157 HydrophobicContact CD2-CG2 3.91Å; L155-T157 HydrophobicContact CG-CG2 4.25Å; L155-T157 PolarHBondContact O-N 2.87Å
156V57.3Low51.9Low122 Ų122137.8 Ų137.874%0.73979%0.785SS**  trans-86.4103.6169.7-176.60000108I154I154-V156 HydrophobicContact CG2-CG2 4.11Å; I154-V156 PolarHBondContact O-N 3.2Å; I154-V156 VanDerWaalsContact O-N 3.13Å
157T62.3Low51.5Low114 Ų114139.9 Ų139.970%0.69979%0.789SS**  trans-89.7119.216751.10000108.5L155 K159L155-T157 HydrophobicContact CD2-CG2 3.91Å; L155-T157 HydrophobicContact CG-CG2 4.25Å; L155-T157 PolarHBondContact O-N 2.87Å; T157-K159 PolarHBondContact O-N 3.15Å
158T68.1Low50.9Low121 Ų121140.5 Ų140.574%0.74278%0.784SS**  trans-76113.4167340000108.3T160T158-T160 PolarHBondContact O-N 3.46Å; T158-T160 VanDerWaalsContact O-N 3.1Å
159K50.2Low49.7Very low202 Ų202136 Ų13688%0.87878%0.776SS**  trans-72.399.4166.6-176.8-179.9177.7176.20108.2T157 N161T157-K159 PolarHBondContact O-N 3.15Å; K159-N161 PolarHBondContact O-N 3.41Å
160T52.9Low48.7Very low109 Ų109131.5 Ų131.567%0.66977%0.771SS**  trans-70.4116.4165.144.60000108.3T158T158-T160 PolarHBondContact O-N 3.46Å; T158-T160 VanDerWaalsContact O-N 3.1Å
161N51.1Low47.5Very low138 Ų138129.9 Ų129.974%0.73877%0.767SS**  trans-84.5105.6162.5-174.914.4000106.2K159 Y163K159-N161 PolarHBondContact O-N 3.41Å; N161-Y163 VanDerWaalsContact C-N 3.33Å; N161-Y163 PolarHBondContact O-N 3.44Å
162D44.2Very low46.5Very low133 Ų133130.9 Ų130.971%0.71176%0.764SS**  trans-64.396.7171.5-73.5-43000108.9
163Y41.8Very low45.2Very low193 Ų193131.8 Ų131.876%0.75776%0.758SS**  trans-112.888.2149.9-132.9-92.5000106.9N161 N165N161-Y163 VanDerWaalsContact C-N 3.33Å; N161-Y163 PolarHBondContact O-N 3.44Å; Y163-N165 PolarHBondContact O-N 3.19Å
164C32.9Very low44.1Very low105 Ų105130.8 Ų130.871%0.70975%0.751SS**  trans-58.7102.2166.4-93.40000108.6S166C164-S166 VanDerWaalsContact C-N 3.31Å; C164-S166 PolarHBondContact O-N 2.92Å; C164-S166 VanDerWaalsContact O-N 3.14Å
165N39.9Very low42.8Very low155 Ų155131 Ų13183%0.82975%0.749SS**  trans-75.491.3156.6-78-32.7000107.9Y163Y163-N165 PolarHBondContact O-N 3.19Å
166S36Very low42.1Very low101 Ų101130.1 Ų130.171%0.70674%0.744SS**  trans-131.794.5152.651.30000108.8C164C164-S166 VanDerWaalsContact C-N 3.31Å; C164-S166 PolarHBondContact O-N 2.92Å; C164-S166 VanDerWaalsContact O-N 3.14Å
167L36.9Very low41Very low163 Ų163132.9 Ų132.985%0.85375%0.749SS**  trans-62146.2146-89.5160.8000107
168P42.6Very low40Very low117 Ų117135.3 Ų135.376%0.7675%0.75SS**  cis-143.2171.242.436.1-15.1000116.7
169A31.1Very low38.5Very low92 Ų92135.2 Ų135.276%0.7675%0.754SS**  trans78.8101156.800000118
170A33.5Very low38.2Very low88 Ų88132 Ų13273%0.72775%0.745SS**  169.4136.391.600000110.4
171L33.1Very low37.5Very low158 Ų158132.7 Ų132.783%0.82775%0.754SS**  trans43.9101.6147.7-93.574.1000118.2
172S34Very low36.8Very low89 Ų89130.4 Ų130.462%0.62276%0.755SS**  85.1123.881.770.60000114.4
173V32.8Very low36.6Very low127 Ų127139.3 Ų139.377%0.7778%0.778SS**  trans74.9128.3150.2-177.50000113
174T34.3Very low36.3Very low114 Ų114136.7 Ų136.770%0.69978%0.779SS**  cis-167.9137.832.99.30000106
175E31.1Very low36.5Very low156 Ų156138.3 Ų138.373%0.72978%0.783SS**  60.3127.899.8-121.2-161.1134.600117.8
176I37Very low36.3Very low136 Ų136137.4 Ų137.470%0.69778%0.78SS**  trans72.2128.9154.8-45.5153.1000114.6
177E34.8Very low36.3Very low180 Ų180139.5 Ų139.584%0.84179%0.785SS**  -167.615163.2-159.9171143.100113.5
178K41.9Very low36.3Very low164 Ų164138.1 Ų138.171%0.71378%0.781SS**  trans-79.3140.9172.7169.9-173-177.9-178.30110.8
179S37Very low35.8Very low119 Ų119139.5 Ų139.583%0.83278%0.782SS**  trans-145.6113.7155.654.30000112.6
180I43.4Very low36.2Very low136 Ų136142.9 Ų142.970%0.69778%0.783SS**  trans-68.7138.8164-64.7160.8000107.7
181S38.6Very low36.4Very low122 Ų122147.1 Ų147.185%0.85379%0.788SS**  trans-139105.5161.7-175.90000110.1
182A36.6Very low36.7Very low91 Ų91146.2 Ų146.275%0.75279%0.785SS**  trans-95.9131.7160.700000108.2
183R38.4Very low36.9Very low320 Ų320151.4 Ų151.4100%1.20880%0.799SS**  trans-156.40145.3-127.9-178.6-164163.15.4109.8

Retrieved 183 of 183 residues in 122 ms (Link to these results)