A0A087XFD5_POEFO Loading...

Oligodendrocyte transcription factor 3

AlphaFold DB , UniProt , Accession A0A087XFD5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 263 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M45.9Very low50Low236 Ų236141.6 Ų141.6100%1.16384%0.841SS**  099.30-82.8151.272.400105.5
2N43.4Very low49.9Very low148 Ų148139.6 Ų139.679%0.79184%0.839SS**  trans-117.7158.8-173.1-41.7-8.7000106.1
3S48.4Very low50Low112 Ų112137.2 Ų137.278%0.78383%0.833SS**  trans92.5131.7-178-49.50000113.3
4D44.3Very low50.6Low144 Ų144133.9 Ų133.977%0.7782%0.815SS**  cis-152.1133.912.8-103.5-49.4000109.1
5S52.2Low50.5Low124 Ų124133.3 Ų133.387%0.86781%0.806SS**  trans-113.3102163.9-71.90000107.7
6S61.2Low50.7Low111 Ų111132.8 Ų132.878%0.77679%0.794SS**  trans-90.8123.5171.3-71.90000109.9
7P55Low50.5Low117 Ų117132.4 Ų132.476%0.7679%0.787SS**  trans-78.913217330.8-29.9000110.3S9P7-S9 PolarHBondContact O-N 3.41Å
8S47.2Very low50.4Low114 Ų114128.8 Ų128.880%0.79778%0.782SS**  trans-45.5117.6170.8-178.70000111.7R10S8-R10 PolarHBondContact O-N 3.36Å
9S50.8Low50.5Low119 Ų119128.7 Ų128.783%0.83277%0.774SS**  trans-6597.7171.5-52.30000109.3P7 A11P7-S9 PolarHBondContact O-N 3.41Å; S9-A11 PolarHBondContact O-N 3.5Å
10R52.3Low51.1Low232 Ų232128.4 Ų128.488%0.87576%0.762SS**  trans-56.9122.2164.2-80.6176.2149.1-177.2-6.6108.3S8 S12S8-R10 PolarHBondContact O-N 3.36Å; R10-S12 PolarHBondContact O-N 3.41Å; R10-S12 VanDerWaalsContact O-N 3.1Å
11A49.4Very low51.6Low101 Ų101125.9 Ų125.984%0.83574%0.744SS**  trans-55114169.500000109.1S9 S13S9-A11 PolarHBondContact O-N 3.5Å; A11-S13 PolarHBondContact O-N 3.23Å; A11-S13 VanDerWaalsContact O-N 3.1Å
12S49.4Very low52.8Low117 Ų117118.9 Ų118.982%0.81872%0.717SS**  trans-58.7114.4171.2-64.80000108.8R10R10-S12 PolarHBondContact O-N 3.41Å; R10-S12 VanDerWaalsContact O-N 3.1Å
13S51.2Low53.9Low109 Ų109117.7 Ų117.776%0.76270%0.701SS**PPolyproline II helixtrans-58.5125.4167.9-168.70000108A11 D15A11-S13 PolarHBondContact O-N 3.23Å; A11-S13 VanDerWaalsContact O-N 3.1Å; S13-D15 PolarHBondContact O-N 3.24Å
14P57.8Low54.8Low90 Ų90122.2 Ų122.258%0.58470%0.701SS**PPolyproline II helixtrans-63.6123174.423.2-28.6000108.5M16P14-M16 HydrophobicContact CB-CE 4.12Å; P14-M16 HydrophobicContact CG-CE 3.86Å; P14-M16 WeakPolarHBondContact O-CE 3.41Å; P14-M16 PolarHBondContact O-N 3.27Å
15D48.5Very low56Low125 Ų125119.4 Ų119.467%0.66869%0.685SS**PPolyproline II helixtrans-48.1117.9169.2-177.934.5000110S13 D17S13-D15 PolarHBondContact O-N 3.24Å; D15-D17 VanDerWaalsContact C-N 3.28Å
16M53.7Low57Low125 Ų125113.7 Ų113.762%0.61665%0.645SS**  trans-84.8-2.6-176.7-73.7-70.2114.400112.5P14 G18 M19P14-M16 HydrophobicContact CB-CE 4.12Å; P14-M16 HydrophobicContact CG-CE 3.86Å; P14-M16 WeakPolarHBondContact O-CE 3.41Å; P14-M16 PolarHBondContact O-N 3.27Å; M16-G18 PolarHBondContact O-N 3.23Å; M16-G18 VanDerWaalsContact O-N 3.14Å; M16-M19 PolarHBondContact O-N 2.97Å
17D48.6Very low57.5Low126 Ų126112.1 Ų112.167%0.67462%0.622SS**THydrogen-bonded Turntrans-69.8-11.8-172.1-76.9-27.7000114.1D15D15-D17 VanDerWaalsContact C-N 3.28Å
18G48.9Very low58.5Low68 Ų68113.3 Ų113.370%0.70162%0.618SS**THydrogen-bonded Turntrans-92.7-9.6178.700000116.4M16 F20M16-G18 PolarHBondContact O-N 3.23Å; M16-G18 VanDerWaalsContact O-N 3.14Å; G18-F20 PolarHBondContact O-N 3.36Å
19M51.4Low59.6Low128 Ų128110.9 Ų110.963%0.63160%0.595SS**  trans-97.824.3-172.6-73.9-60-53.800114M16 L21M16-M19 PolarHBondContact O-N 2.97Å; M19-L21 PolarHBondContact O-N 3.1Å
20F62.4Low60.6Low122 Ų122106.5 Ų106.554%0.53556%0.562SS.*  trans-71.997.7168.9-87.6-88.8000109.6G18 E60G18-F20 PolarHBondContact O-N 3.36Å; F20-E60 WeakPolarHBondContact CE1-OE1 3.2Å; F20-E60 VanDerWaalsContact CZ-OE1 3.32Å; F20-E60 WeakPolarHBondContact CZ-OE1 3.32Å
21L62.2Low61.6Low75 Ų75100.4 Ų100.439%0.39354%0.543SS..  trans-45.8131.8160.6-72.5171000108.1M19 R23 L25 V26M19-L21 PolarHBondContact O-N 3.1Å; L21-R23 PolarHBondContact O-N 3.06Å; L21-R23 VanDerWaalsContact O-N 3.1Å; L21-L25 HydrophobicContact CD2-CD2 3.94Å; L21-V26 HydrophobicContact CB-CG2 3.96Å
22P70.8Confident62.7Low89 Ų8998 Ų9858%0.57852%0.524SS*.  trans-51.2126-176.1-27.432.9000109.7R24 L25 V26P22-R24 CarbonylContact O-C 3.51Å; P22-R24 PolarHBondContact O-N 3.43Å; P22-L25 WeakPolarHBondContact O-CB 3.3Å; P22-L25 PolarHBondContact O-N 3.35Å; P22-V26 PolarHBondContact O-N 2.83Å
23R65.6Low63.6Low124 Ų12494.3 Ų94.347%0.46849%0.493SS..Hα-helixtrans-45-25.8-179.3-86.9179.9151.7-160.4-7.8113.2L21 R27 E57L21-R23 PolarHBondContact O-N 3.06Å; L21-R23 VanDerWaalsContact O-N 3.1Å; R23-R27 WeakPolarHBondContact O-CB 3.31Å; R23-R27 PolarHBondContact O-N 2.88Å; R23-R27 VanDerWaalsContact O-N 3.16Å; R23-E57 IonicContact CZ-OE1 3.81Å; R23-E57 IonicContact CZ-OE2 2.71Å; R23-E57 IonicContact NH1-OE1 3.74Å; R23-E57 PolarHBondContact NH1-OE1 3.45Å; R23-E57 IonicContact NH1-OE2 3.83Å; R23-E57 IonicContact NH2-OE1 2.87Å; R23-E57 PolarHBondContact NH2-OE1 3.43Å; R23-E57 IonicContact NH2-OE2 3.46Å; R23-E57 PolarHBondContact NH2-OE2 2.95Å
24R67.4Low64.4Low207 Ų20796.2 Ų96.278%0.78148%0.484SS*.Hα-helixtrans-67.4-45.6172.7-65.7-172.7-177.2-172.92.5114P22 R27 H28P22-R24 CarbonylContact O-C 3.51Å; P22-R24 PolarHBondContact O-N 3.43Å; R24-R27 PolarHBondContact O-N 2.96Å; R24-H28 PolarHBondContact O-N 3.29Å
25L71.1Confident64.8Low84 Ų84102.1 Ų102.144%0.4450%0.495SS..Hα-helixtrans-64-44.3178.8-16982000110.4L21 P22 R27 H28 L29L21-L25 HydrophobicContact CD2-CD2 3.94Å; P22-L25 WeakPolarHBondContact O-CB 3.3Å; P22-L25 PolarHBondContact O-N 3.35Å; L25-R27 VanDerWaalsContact C-N 3.33Å; L25-R27 PolarHBondContact O-N 3.49Å; L25-H28 WeakPolarHBondContact O-CB 3.36Å; L25-H28 PolarHBondContact O-N 3.32Å; L25-H28 VanDerWaalsContact O-N 3.14Å; L25-L29 HydrophobicContact CD2-CD1 4.46Å; L25-L29 HydrophobicContact CG-CD1 4.32Å; L25-L29 WeakPolarHBondContact O-CG 3.49Å; L25-L29 PolarHBondContact O-N 3.1Å
26V71.7Confident65.6Low4 Ų499.4 Ų99.42%0.02449%0.489CS..Hα-helixtrans-57-47.7175.5-1760000111L21 P22 H28 L29 L30 V58 M63 L66L21-V26 HydrophobicContact CB-CG2 3.96Å; P22-V26 PolarHBondContact O-N 2.83Å; V26-H28 VanDerWaalsContact C-N 3.32Å; V26-H28 PolarHBondContact O-N 2.74Å; V26-L29 PolarHBondContact O-N 2.93Å; V26-L30 HydrophobicContact CG1-CD1 4.07Å; V26-L30 WeakPolarHBondContact O-CG 3.4Å; V26-L30 PolarHBondContact O-N 2.98Å; V26-V58 HydrophobicContact CG1-CG1 4.15Å; V26-V58 HydrophobicContact CG1-CG2 4.12Å; V26-M63 HydrophobicContact CB-CE 3.78Å; V26-M63 HydrophobicContact CG1-CE 3.33Å; V26-M63 HydrophobicContact CG2-CE 3.06Å; V26-L66 HydrophobicContact CG1-CD2 3.75Å
27R72.6Confident66Low78 Ų7897.2 Ų97.229%0.29449%0.491SS..Hα-helixtrans-62.6-40.2177.8-171.7176.9-69.4146.8-0.2111.6R23 R24 L25 L30 H31 V56R23-R27 WeakPolarHBondContact O-CB 3.31Å; R23-R27 PolarHBondContact O-N 2.88Å; R23-R27 VanDerWaalsContact O-N 3.16Å; R24-R27 PolarHBondContact O-N 2.96Å; L25-R27 VanDerWaalsContact C-N 3.33Å; L25-R27 PolarHBondContact O-N 3.49Å; R27-L30 PolarHBondContact O-N 3.21Å; R27-H31 PolarHBondContact O-CD2 2.98Å; R27-H31 PolarHBondContact O-N 2.84Å; R27-V56 PolarHBondContact NH2-O 2.96Å
28H75.1Confident66.7Low143 Ų14393.9 Ų93.966%0.66248%0.481SS*.Hα-helixtrans-61.7-45173.6-89-141.8000112R24 L25 V26 H31 A32R24-H28 PolarHBondContact O-N 3.29Å; L25-H28 WeakPolarHBondContact O-CB 3.36Å; L25-H28 PolarHBondContact O-N 3.32Å; L25-H28 VanDerWaalsContact O-N 3.14Å; V26-H28 VanDerWaalsContact C-N 3.32Å; V26-H28 PolarHBondContact O-N 2.74Å; H28-H31 PolarHBondContact O-N 2.93Å; H28-A32 WeakPolarHBondContact O-CB 3.49Å; H28-A32 PolarHBondContact O-N 3.07Å
29L72Confident66.8Low62 Ų6295.6 Ų95.633%0.32548%0.48SS..Hα-helixtrans-63.7-42.6177.6-67.7170.5000111.5L25 V26 H31 A32 E33 L66 I70L25-L29 HydrophobicContact CD2-CD1 4.46Å; L25-L29 HydrophobicContact CG-CD1 4.32Å; L25-L29 WeakPolarHBondContact O-CG 3.49Å; L25-L29 PolarHBondContact O-N 3.1Å; V26-L29 PolarHBondContact O-N 2.93Å; L29-H31 PolarHBondContact O-N 3.25Å; L29-A32 PolarHBondContact O-N 3.21Å; L29-E33 WeakPolarHBondContact O-CB 3.32Å; L29-E33 WeakPolarHBondContact O-CG 3.45Å; L29-E33 PolarHBondContact O-N 2.99Å; L29-L66 HydrophobicContact CB-CD1 4.48Å; L29-L66 HydrophobicContact CB-CD2 4.25Å; L29-I70 HydrophobicContact CD1-CD1 3.97Å
30L70.1Confident66.9Low28 Ų2899 Ų9915%0.14749%0.491CS..Hα-helixtrans-64.5-36.3174.8-70.6169.7000113.1V26 R27 R34 V58 L66V26-L30 HydrophobicContact CG1-CD1 4.07Å; V26-L30 WeakPolarHBondContact O-CG 3.4Å; V26-L30 PolarHBondContact O-N 2.98Å; R27-L30 PolarHBondContact O-N 3.21Å; L30-R34 WeakPolarHBondContact O-CB 3.49Å; L30-R34 WeakPolarHBondContact O-CG 3.48Å; L30-R34 PolarHBondContact O-N 3.17Å; L30-V58 HydrophobicContact CD1-CG1 4.5Å; L30-V58 HydrophobicContact CD1-CG2 3.9Å; L30-L66 HydrophobicContact CD2-CB 4.39Å; L30-L66 HydrophobicContact CD2-CD1 3.86Å; L30-L66 HydrophobicContact CD2-CD2 4.08Å; L30-L66 HydrophobicContact CD2-CG 4.33Å; L30-L66 HydrophobicContact CG-CD1 4.4Å; L30-L66 HydrophobicContact CG-CD2 3.99Å
31H74Confident66.1Low103 Ų10399.9 Ų99.948%0.47750%0.501SS..Hα-helixtrans-69.5-37.9172.9-83.2-66.9000112R27 H28 L29 R34 R35R27-H31 PolarHBondContact O-CD2 2.98Å; R27-H31 PolarHBondContact O-N 2.84Å; H28-H31 PolarHBondContact O-N 2.93Å; L29-H31 PolarHBondContact O-N 3.25Å; H31-R34 PolarHBondContact O-N 3.02Å; H31-R35 WeakPolarHBondContact O-CG 3.47Å; H31-R35 PolarHBondContact O-N 3.17Å
32A72.1Confident65.7Low51 Ų51104.7 Ų104.742%0.42152%0.522SS..Hα-helixtrans-65.3-41.7174.700000111.6H28 L29 R35 A36H28-A32 WeakPolarHBondContact O-CB 3.49Å; H28-A32 PolarHBondContact O-N 3.07Å; L29-A32 PolarHBondContact O-N 3.21Å; A32-R35 PolarHBondContact O-N 3.46Å; A32-A36 WeakPolarHBondContact O-CB 3.29Å; A32-A36 PolarHBondContact O-N 2.93Å
33E68.3Low64.7Low39 Ų39111.6 Ų111.618%0.18254%0.536CS..Hα-helixtrans-62.8-45.3173.5-75-64157.500111.9L29 R35 A36 A37 L66 R73L29-E33 WeakPolarHBondContact O-CB 3.32Å; L29-E33 WeakPolarHBondContact O-CG 3.45Å; L29-E33 PolarHBondContact O-N 2.99Å; E33-R35 VanDerWaalsContact C-N 3.27Å; E33-R35 PolarHBondContact O-N 3.33Å; E33-A36 PolarHBondContact O-N 3.5Å; E33-A36 VanDerWaalsContact O-N 3.07Å; E33-A37 WeakPolarHBondContact O-CB 3.5Å; E33-A37 PolarHBondContact O-N 2.81Å; E33-L66 HydrophobicContact CG-CD1 4.1Å; E33-R73 IonicContact OE1-CZ 2.81Å; E33-R73 IonicContact OE1-NE 3.33Å; E33-R73 PolarHBondContact OE1-NE 3.2Å; E33-R73 IonicContact OE1-NH1 2.92Å; E33-R73 IonicContact OE1-NH2 3.6Å; E33-R73 PolarHBondContact OE1-NH2 3.4Å; E33-R73 IonicContact OE2-CZ 3.78Å; E33-R73 IonicContact OE2-NH2 3.79Å; E33-R73 PolarHBondContact OE2-NH2 3.11Å
34R67.8Low63.6Low150 Ų150117.5 Ų117.557%0.56656%0.558SS**Hα-helixtrans-62-33.4175.7-83.1-176.8-101.6-120.5-0.4113L30 H31 A38L30-R34 WeakPolarHBondContact O-CB 3.49Å; L30-R34 WeakPolarHBondContact O-CG 3.48Å; L30-R34 PolarHBondContact O-N 3.17Å; H31-R34 PolarHBondContact O-N 3.02Å; R34-A38 PolarHBondContact O-N 3.33Å
35R67.5Low62.8Low214 Ų214119.9 Ų119.981%0.80857%0.567SS**Hα-helixtrans-71.5-35.7172.2-76.5-179.7172.4-165.3-2112.4H31 A32 E33H31-R35 WeakPolarHBondContact O-CG 3.47Å; H31-R35 PolarHBondContact O-N 3.17Å; A32-R35 PolarHBondContact O-N 3.46Å; E33-R35 VanDerWaalsContact C-N 3.27Å; E33-R35 PolarHBondContact O-N 3.33Å
36A65.6Low61.7Low67 Ų67119.9 Ų119.955%0.55458%0.58SS**Hα-helixtrans-73.6-31.8177.800000113A32 E33A32-A36 WeakPolarHBondContact O-CB 3.29Å; A32-A36 PolarHBondContact O-N 2.93Å; E33-A36 PolarHBondContact O-N 3.5Å; E33-A36 VanDerWaalsContact O-N 3.07Å
37A61.8Low60.5Low79 Ų79125.2 Ų125.265%0.65361%0.614SS**SBendtrans-88.5-6.9178.200000113.9E33 P39E33-A37 WeakPolarHBondContact O-CB 3.5Å; E33-A37 PolarHBondContact O-N 2.81Å; A37-P39 WeakPolarHBondContact O-CD 3.5Å
38A63.2Low59.4Low56 Ų56126.6 Ų126.646%0.46364%0.643SS.*SBendtrans-66.312117700000109.4R34 K40R34-A38 PolarHBondContact O-N 3.33Å; A38-K40 PolarHBondContact O-N 2.9Å
39P50Low58Low105 Ų105130.8 Ų130.868%0.68265%0.653SS**  trans-61.5136.9175.224.9-30.6000108.8A37 D41A37-P39 WeakPolarHBondContact O-CD 3.5Å; P39-D41 PolarHBondContact O-N 2.78Å
40K54.6Low56.5Low199 Ų199132.7 Ų132.787%0.86567%0.671SS**  trans-74.160176.1-67.3-175.7178.8179.40110.5A38 H42A38-K40 PolarHBondContact O-N 2.9Å; K40-H42 PolarHBondContact O-N 2.93Å
41D44.9Very low55.4Low140 Ų140135.3 Ų135.375%0.74971%0.705SS**  trans-87.796.5169.7-91.5-33000109.7P39 R43P39-D41 PolarHBondContact O-N 2.78Å; D41-R43 PolarHBondContact O-N 2.98Å
42H54.7Low53.8Low177 Ų177140.7 Ų140.782%0.81972%0.721SS**  trans-72.381.3165.4-70-3.7000109.7K40K40-H42 PolarHBondContact O-N 2.93Å
43R48.8Very low52.9Low234 Ų234147.1 Ų147.188%0.88374%0.74SS**  trans155.899.6145.9-89.7177-177.2-119.43109.9D41D41-R43 PolarHBondContact O-N 2.98Å
44R42.4Very low52Low247 Ų247150 Ų15093%0.93276%0.76SS**  trans-172.8112.3131.9-98.9161.4-159.6-81.43108.2A46R44-A46 PolarHBondContact O-N 3.17Å; R44-A46 VanDerWaalsContact O-N 3.1Å
45R50.8Low51.2Low257 Ų257152.5 Ų152.597%0.9777%0.769SS**  trans-65.9101.4174.2-175.7177.3-178.9-152.41.5108.1
46A48.5Very low51Low85 Ų85145.2 Ų145.270%0.70275%0.748SS**  trans-87.1143.2168.600000109.9R44R44-A46 PolarHBondContact O-N 3.17Å; R44-A46 VanDerWaalsContact O-N 3.1Å
47P46.1Very low50.9Low115 Ų115147.8 Ų147.875%0.74775%0.749SS**  trans-75.4138.2-170.830.6-32.8000111.1R49P47-R49 PolarHBondContact O-N 3.3Å
48A49.3Very low51.5Low108 Ų108145 Ų14589%0.89372%0.724SS**  trans-58.3107.917000000110
49R44.8Very low52.6Low231 Ų231145.8 Ų145.887%0.87272%0.723SS**  trans-108.7111.7163.6-77-178.284.5176.85.3109.4P47P47-R49 PolarHBondContact O-N 3.3Å
50S40.3Very low54.4Low101 Ų101146.4 Ų146.471%0.70672%0.717SS**  trans45.9104.6133178.90000116.3R52S50-R52 PolarHBondContact O-N 3.39Å
51G46.8Very low56.1Low84 Ų84142 Ų14287%0.86670%0.699SS**  trans-61.995.6167.700000111.9
52R41.5Very low58.2Low215 Ų215138.9 Ų138.981%0.81168%0.68SS**  trans-85.2113.1143-78-179.7-147.9-172.94.8106.6S50 V54S50-R52 PolarHBondContact O-N 3.39Å; R52-V54 HydrophobicContact CB-CG2 4.13Å; R52-V54 PolarHBondContact O-N 2.86Å
53K52.8Low59.7Low187 Ų187131.1 Ų131.181%0.81365%0.645SS**  trans-66.574162.9-169.5177.5-174.9-1780107.1R55K53-R55 VanDerWaalsContact C-N 3.34Å; K53-R55 PolarHBondContact O-N 3.5Å
54V49.7Very low61.7Low100 Ų100126.3 Ų126.361%0.60663%0.627SS**  trans-59.9106.5166.9178.50000104.1R52 V56R52-V54 HydrophobicContact CB-CG2 4.13Å; R52-V54 PolarHBondContact O-N 2.86Å; V54-V56 HydrophobicContact CB-CG2 4.33Å; V54-V56 HydrophobicContact CG1-CG2 3.81Å; V54-V56 PolarHBondContact O-N 3.27Å
55R51.7Low64.1Low202 Ų202118.4 Ų118.476%0.76260%0.601SS**  trans-63.986163-80.2-179.9150.1167.7-6.1104.8K53 E57K53-R55 VanDerWaalsContact C-N 3.34Å; K53-R55 PolarHBondContact O-N 3.5Å; R55-E57 VanDerWaalsContact C-N 3.26Å; R55-E57 PolarHBondContact O-N 3.45Å
56V62.3Low66.1Low61 Ų61106.4 Ų106.437%0.3756%0.556SS.*  trans-65.1100.1167.3-1780000104.4R27 V54 V58R27-V56 PolarHBondContact NH2-O 2.96Å; V54-V56 HydrophobicContact CB-CG2 4.33Å; V54-V56 HydrophobicContact CG1-CG2 3.81Å; V54-V56 PolarHBondContact O-N 3.27Å; V56-V58 PolarHBondContact O-N 3.18Å; V56-V58 VanDerWaalsContact O-N 3.17Å
57E64.8Low68.3Low120 Ų120108.3 Ų108.356%0.56155%0.545SS*.  trans-58.2102.6158.7-67.9-88127.600104.9R23 R55 T59R23-E57 IonicContact CZ-OE1 3.81Å; R23-E57 IonicContact CZ-OE2 2.71Å; R23-E57 IonicContact NH1-OE1 3.74Å; R23-E57 PolarHBondContact NH1-OE1 3.45Å; R23-E57 IonicContact NH1-OE2 3.83Å; R23-E57 IonicContact NH2-OE1 2.87Å; R23-E57 PolarHBondContact NH2-OE1 3.43Å; R23-E57 IonicContact NH2-OE2 3.46Å; R23-E57 PolarHBondContact NH2-OE2 2.95Å; R55-E57 VanDerWaalsContact C-N 3.26Å; R55-E57 PolarHBondContact O-N 3.45Å; E57-T59 PolarHBondContact O-N 3.37Å
58V72.8Confident70.6Confident21 Ų21106.6 Ų106.613%0.12753%0.529CS..  trans-66.1116.8174.7177.20000106V26 L30 V56 E62 M63V26-V58 HydrophobicContact CG1-CG1 4.15Å; V26-V58 HydrophobicContact CG1-CG2 4.12Å; L30-V58 HydrophobicContact CD1-CG1 4.5Å; L30-V58 HydrophobicContact CD1-CG2 3.9Å; V56-V58 PolarHBondContact O-N 3.18Å; V56-V58 VanDerWaalsContact O-N 3.17Å; V58-E62 WeakPolarHBondContact CA-OE2 3.38Å; V58-E62 HydrophobicContact CG1-CB 3.85Å; V58-M63 HydrophobicContact CG1-CB 4.39Å; V58-M63 HydrophobicContact CG1-CG 4.09Å
59T87.3Confident72.8Confident73 Ų73107.2 Ų107.245%0.44851%0.512SS..  trans-71.1155.6177.464.30000109.7E57 E61 E62 M63E57-T59 PolarHBondContact O-N 3.37Å; T59-E61 PolarHBondContact O-N 2.71Å; T59-E62 WeakPolarHBondContact O-CB 3.41Å; T59-E62 PolarHBondContact O-N 3.23Å; T59-E62 VanDerWaalsContact O-N 3.1Å; T59-E62 VanDerWaalsContact OG1-CG 3.32Å; T59-E62 WeakPolarHBondContact OG1-CG 3.46Å; T59-E62 PolarHBondContact OG1-N 2.87Å; T59-M63 PolarHBondContact O-N 2.89Å
60E88Confident75.2Confident117 Ų11799.1 Ų99.155%0.54749%0.485SS..Hα-helixtrans-55.5-35.7176.6-72.9-56.8124.900112.1F20 M63 Y64F20-E60 WeakPolarHBondContact CE1-OE1 3.2Å; F20-E60 VanDerWaalsContact CZ-OE1 3.32Å; F20-E60 WeakPolarHBondContact CZ-OE1 3.32Å; E60-M63 WeakPolarHBondContact O-CB 3.49Å; E60-M63 PolarHBondContact O-N 2.83Å; E60-Y64 PolarHBondContact O-N 3.31Å
61E90.1Very high78Confident107 Ų10798.3 Ų98.350%0.547%0.473SS..Hα-helixtrans-65.5-44.9175.9-176.654.1-144.900112.4T59 M63 Y64 Q65T59-E61 PolarHBondContact O-N 2.71Å; E61-M63 PolarHBondContact O-N 3.46Å; E61-Y64 PolarHBondContact O-N 2.92Å; E61-Q65 VanDerWaalsContact O-CG 3.3Å; E61-Q65 WeakPolarHBondContact O-CG 3.42Å; E61-Q65 PolarHBondContact O-N 3.46Å; E61-Q65 PolarHBondContact OE1-NE2 2.98Å
62E88Confident80.4Confident75 Ų7595.6 Ų95.635%0.3545%0.445SS..Hα-helixtrans-61.5-34.6173.3-75.2178.6176.300111.7V58 T59 L66V58-E62 WeakPolarHBondContact CA-OE2 3.38Å; V58-E62 HydrophobicContact CG1-CB 3.85Å; T59-E62 WeakPolarHBondContact O-CB 3.41Å; T59-E62 PolarHBondContact O-N 3.23Å; T59-E62 VanDerWaalsContact O-N 3.1Å; T59-E62 VanDerWaalsContact OG1-CG 3.32Å; T59-E62 WeakPolarHBondContact OG1-CG 3.46Å; T59-E62 PolarHBondContact OG1-N 2.87Å; E62-L66 WeakPolarHBondContact O-CB 3.47Å; E62-L66 PolarHBondContact O-N 3.22Å
63M87.8Confident83.1Confident14 Ų1491.4 Ų91.47%0.06943%0.429CS..Hα-helixtrans-65.2-49.2175.8-121.7-59.4161.700111.7V26 V58 T59 E60 E61 Q65 L66 R67V26-M63 HydrophobicContact CB-CE 3.78Å; V26-M63 HydrophobicContact CG1-CE 3.33Å; V26-M63 HydrophobicContact CG2-CE 3.06Å; V58-M63 HydrophobicContact CG1-CB 4.39Å; V58-M63 HydrophobicContact CG1-CG 4.09Å; T59-M63 PolarHBondContact O-N 2.89Å; E60-M63 WeakPolarHBondContact O-CB 3.49Å; E60-M63 PolarHBondContact O-N 2.83Å; E61-M63 PolarHBondContact O-N 3.46Å; M63-Q65 PolarHBondContact O-N 3.22Å; M63-L66 WeakPolarHBondContact O-CB 3.38Å; M63-L66 PolarHBondContact O-N 3.43Å; M63-R67 WeakPolarHBondContact O-CG 3.35Å; M63-R67 PolarHBondContact O-N 2.87Å; M63-R67 HydrophobicContact SD-CG 4.5Å
64Y90.1Very high85.3Confident132 Ų13286.8 Ų86.852%0.51841%0.41SS..Hα-helixtrans-59-47.1176.5177-107.1000111.5E60 E61 L66 R67 L68E60-Y64 PolarHBondContact O-N 3.31Å; E61-Y64 PolarHBondContact O-N 2.92Å; Y64-L66 VanDerWaalsContact C-N 3.31Å; Y64-L66 PolarHBondContact O-N 3.46Å; Y64-R67 WeakPolarHBondContact O-CB 3.43Å; Y64-R67 PolarHBondContact O-N 2.87Å; Y64-L68 HydrophobicContact CD1-CD1 3.93Å; Y64-L68 HydrophobicContact CD1-CG 4.48Å; Y64-L68 HydrophobicContact CE1-CD1 3.32Å; Y64-L68 HydrophobicContact CE1-CG 4.07Å; Y64-L68 HydrophobicContact CE2-CD1 4.43Å; Y64-L68 HydrophobicContact CE2-CG 4.36Å; Y64-L68 PolarHBondContact O-N 2.95Å
65Q92.3Very high87.6Confident81 Ų8189.5 Ų89.538%0.37941%0.41SS..Hα-helixtrans-61.8-37.6176.7-69.4176.420.400112.6E61 M63 L68 K69E61-Q65 VanDerWaalsContact O-CG 3.3Å; E61-Q65 WeakPolarHBondContact O-CG 3.42Å; E61-Q65 PolarHBondContact O-N 3.46Å; E61-Q65 PolarHBondContact OE1-NE2 2.98Å; M63-Q65 PolarHBondContact O-N 3.22Å; Q65-L68 PolarHBondContact O-N 3.14Å; Q65-K69 WeakPolarHBondContact O-CB 3.42Å; Q65-K69 VanDerWaalsContact O-CG 3.31Å; Q65-K69 WeakPolarHBondContact O-CG 3.4Å; Q65-K69 PolarHBondContact O-N 3.41Å
66L92.3Very high89.8Confident6 Ų686.7 Ų86.73%0.03140%0.403CS..Hα-helixtrans-64.7-44.2174.9-177.662.9000111.4V26 L29 L30 E33 E62 M63 Y64 L68 K69 I70V26-L66 HydrophobicContact CG1-CD2 3.75Å; L29-L66 HydrophobicContact CB-CD1 4.48Å; L29-L66 HydrophobicContact CB-CD2 4.25Å; L30-L66 HydrophobicContact CD2-CB 4.39Å; L30-L66 HydrophobicContact CD2-CD1 3.86Å; L30-L66 HydrophobicContact CD2-CD2 4.08Å; L30-L66 HydrophobicContact CD2-CG 4.33Å; L30-L66 HydrophobicContact CG-CD1 4.4Å; L30-L66 HydrophobicContact CG-CD2 3.99Å; E33-L66 HydrophobicContact CG-CD1 4.1Å; E62-L66 WeakPolarHBondContact O-CB 3.47Å; E62-L66 PolarHBondContact O-N 3.22Å; M63-L66 WeakPolarHBondContact O-CB 3.38Å; M63-L66 PolarHBondContact O-N 3.43Å; Y64-L66 VanDerWaalsContact C-N 3.31Å; Y64-L66 PolarHBondContact O-N 3.46Å; L66-L68 VanDerWaalsContact C-N 3.33Å; L66-L68 PolarHBondContact O-N 3.34Å; L66-K69 PolarHBondContact O-N 3.22Å; L66-I70 HydrophobicContact CD1-CD1 4.04Å; L66-I70 HydrophobicContact CD1-CG1 4.27Å; L66-I70 HydrophobicContact CD2-CD1 4.46Å; L66-I70 HydrophobicContact CG-CD1 3.82Å; L66-I70 HydrophobicContact CG-CG1 4.45Å; L66-I70 WeakPolarHBondContact O-CB 3.43Å; L66-I70 VanDerWaalsContact O-CG1 3.29Å; L66-I70 WeakPolarHBondContact O-CG1 3.46Å; L66-I70 PolarHBondContact O-N 3.1Å
67R94.8Very high91.5Very high125 Ų12591.5 Ų91.547%0.47242%0.415SS..Hα-helixtrans-58.8-45.2175.2-67.4178.8-164.7-160.36.7111M63 Y64 K69 I70 N71M63-R67 WeakPolarHBondContact O-CG 3.35Å; M63-R67 PolarHBondContact O-N 2.87Å; M63-R67 HydrophobicContact SD-CG 4.5Å; Y64-R67 WeakPolarHBondContact O-CB 3.43Å; Y64-R67 PolarHBondContact O-N 2.87Å; R67-K69 PolarHBondContact O-N 3.43Å; R67-I70 PolarHBondContact O-N 3.28Å; R67-N71 VanDerWaalsContact O-CB 3.32Å; R67-N71 WeakPolarHBondContact O-CB 3.48Å; R67-N71 PolarHBondContact O-N 3.45Å; R67-N71 PolarHBondContact O-ND2 2.94Å
68L96.1Very high93.2Very high79 Ų7989.9 Ų89.941%0.41441%0.408SS..Hα-helixtrans-61.1-44.1176.6-73.1-179.7000112.6Y64 Q65 L66 N71 G72Y64-L68 HydrophobicContact CD1-CD1 3.93Å; Y64-L68 HydrophobicContact CD1-CG 4.48Å; Y64-L68 HydrophobicContact CE1-CD1 3.32Å; Y64-L68 HydrophobicContact CE1-CG 4.07Å; Y64-L68 HydrophobicContact CE2-CD1 4.43Å; Y64-L68 HydrophobicContact CE2-CG 4.36Å; Y64-L68 PolarHBondContact O-N 2.95Å; Q65-L68 PolarHBondContact O-N 3.14Å; L66-L68 VanDerWaalsContact C-N 3.33Å; L66-L68 PolarHBondContact O-N 3.34Å; L68-N71 PolarHBondContact O-N 3.16Å; L68-G72 PolarHBondContact O-N 2.9Å
69K94.8Very high94.4Very high120 Ų12094.1 Ų94.152%0.52243%0.426SS..Hα-helixtrans-62.7-46.1177.2-75.8171.4-177.7168.50112Q65 L66 R67 G72 R73Q65-K69 WeakPolarHBondContact O-CB 3.42Å; Q65-K69 VanDerWaalsContact O-CG 3.31Å; Q65-K69 WeakPolarHBondContact O-CG 3.4Å; Q65-K69 PolarHBondContact O-N 3.41Å; L66-K69 PolarHBondContact O-N 3.22Å; R67-K69 PolarHBondContact O-N 3.43Å; K69-G72 PolarHBondContact O-N 3.36Å; K69-R73 PolarHBondContact O-N 3.26Å
70I95.7Very high94.9Very high61 Ų6194.6 Ų94.631%0.31343%0.426SS..Hα-helixtrans-61.4-47.9177.1-69.1168.8000110.3L29 L66 R67 G72 R73 E74L29-I70 HydrophobicContact CD1-CD1 3.97Å; L66-I70 HydrophobicContact CD1-CD1 4.04Å; L66-I70 HydrophobicContact CD1-CG1 4.27Å; L66-I70 HydrophobicContact CD2-CD1 4.46Å; L66-I70 HydrophobicContact CG-CD1 3.82Å; L66-I70 HydrophobicContact CG-CG1 4.45Å; L66-I70 WeakPolarHBondContact O-CB 3.43Å; L66-I70 VanDerWaalsContact O-CG1 3.29Å; L66-I70 WeakPolarHBondContact O-CG1 3.46Å; L66-I70 PolarHBondContact O-N 3.1Å; R67-I70 PolarHBondContact O-N 3.28Å; I70-G72 VanDerWaalsContact C-N 3.31Å; I70-G72 PolarHBondContact O-N 2.93Å; I70-R73 WeakPolarHBondContact O-CB 3.47Å; I70-R73 PolarHBondContact O-N 3.31Å; I70-E74 PolarHBondContact O-N 3.43Å
71N97.6Very high95.4Very high84 Ų8493.4 Ų93.445%0.44942%0.423SS..Hα-helixtrans-62.8-38.2178.3-71.7-15.2000112R67 L68 E74 R75R67-N71 VanDerWaalsContact O-CB 3.32Å; R67-N71 WeakPolarHBondContact O-CB 3.48Å; R67-N71 PolarHBondContact O-N 3.45Å; R67-N71 PolarHBondContact O-ND2 2.94Å; L68-N71 PolarHBondContact O-N 3.16Å; N71-E74 PolarHBondContact O-N 3.01Å; N71-R75 WeakPolarHBondContact O-CG 3.43Å; N71-R75 PolarHBondContact O-N 2.95Å
72G98.3Very high95.8Very high27 Ų2790.5 Ų90.528%0.27841%0.411SS..Hα-helixtrans-61.3-44.1173.900000112.4L68 K69 I70 R75 K76L68-G72 PolarHBondContact O-N 2.9Å; K69-G72 PolarHBondContact O-N 3.36Å; I70-G72 VanDerWaalsContact C-N 3.31Å; I70-G72 PolarHBondContact O-N 2.93Å; G72-R75 PolarHBondContact O-N 3.37Å; G72-K76 PolarHBondContact O-N 3.26Å; G72-K76 VanDerWaalsContact O-N 3.11Å
73R98.1Very high96.3Very high128 Ų12891.4 Ų91.448%0.48342%0.417SS..Hα-helixtrans-63.6-44.2176.6-173.4-174-65.8-154.9-7.4112.2E33 K69 I70 K76 R77E33-R73 IonicContact OE1-CZ 2.81Å; E33-R73 IonicContact OE1-NE 3.33Å; E33-R73 PolarHBondContact OE1-NE 3.2Å; E33-R73 IonicContact OE1-NH1 2.92Å; E33-R73 IonicContact OE1-NH2 3.6Å; E33-R73 PolarHBondContact OE1-NH2 3.4Å; E33-R73 IonicContact OE2-CZ 3.78Å; E33-R73 IonicContact OE2-NH2 3.79Å; E33-R73 PolarHBondContact OE2-NH2 3.11Å; K69-R73 PolarHBondContact O-N 3.26Å; I70-R73 WeakPolarHBondContact O-CB 3.47Å; I70-R73 PolarHBondContact O-N 3.31Å; R73-K76 WeakPolarHBondContact O-CB 3.34Å; R73-K76 PolarHBondContact O-N 2.98Å; R73-R77 PolarHBondContact O-N 3.1Å
74E98.1Very high96.8Very high90 Ų9093.9 Ų93.942%0.42144%0.44SS..Hα-helixtrans-66.5-38.1179.1-173.457.8-157.200111.8I70 N71 K76 R77 M78I70-E74 PolarHBondContact O-N 3.43Å; N71-E74 PolarHBondContact O-N 3.01Å; E74-K76 VanDerWaalsContact C-N 3.3Å; E74-K76 PolarHBondContact O-N 3Å; E74-R77 PolarHBondContact O-N 2.88Å; E74-R77 IonicContact OE1-NH1 3.47Å; E74-R77 PolarHBondContact OE1-NH1 3.46Å; E74-R77 WeakPolarHBondContact OE2-CD 3.32Å; E74-R77 IonicContact OE2-NH1 2.67Å; E74-M78 WeakPolarHBondContact O-CB 3.4Å; E74-M78 PolarHBondContact O-N 3.14Å
75R98.7Very high97.2Very high156 Ų15688.6 Ų88.659%0.58942%0.42SS*.Hα-helixtrans-57.8-44.2171.7-77-169-64-91.24.7111.7N71 G72 M78 H79N71-R75 WeakPolarHBondContact O-CG 3.43Å; N71-R75 PolarHBondContact O-N 2.95Å; G72-R75 PolarHBondContact O-N 3.37Å; R75-M78 PolarHBondContact O-N 2.91Å; R75-H79 WeakPolarHBondContact O-CB 3.43Å; R75-H79 PolarHBondContact O-N 3.42Å
76K98.5Very high97.5Very high143 Ų14387 Ų8762%0.62242%0.415SS*.Hα-helixtrans-61.8-48.5175.8-175.4172.4-178.9171.80111.6G72 R73 E74 M78 H79 D80G72-K76 PolarHBondContact O-N 3.26Å; G72-K76 VanDerWaalsContact O-N 3.11Å; R73-K76 WeakPolarHBondContact O-CB 3.34Å; R73-K76 PolarHBondContact O-N 2.98Å; E74-K76 VanDerWaalsContact C-N 3.3Å; E74-K76 PolarHBondContact O-N 3Å; K76-M78 VanDerWaalsContact C-N 3.28Å; K76-M78 PolarHBondContact O-N 3.3Å; K76-H79 WeakPolarHBondContact O-CB 3.49Å; K76-H79 PolarHBondContact O-N 2.98Å; K76-H79 VanDerWaalsContact O-N 3.14Å; K76-D80 PolarHBondContact O-N 2.74Å
77R98.6Very high97.7Very high163 Ų16388.1 Ų88.162%0.61543%0.428SS*.Hα-helixtrans-55.6-43.4175.9-178.9-172.6174.5-115.4-0.6112.2R73 E74 D80 L81R73-R77 PolarHBondContact O-N 3.1Å; E74-R77 PolarHBondContact O-N 2.88Å; E74-R77 IonicContact OE1-NH1 3.47Å; E74-R77 PolarHBondContact OE1-NH1 3.46Å; E74-R77 WeakPolarHBondContact OE2-CD 3.32Å; E74-R77 IonicContact OE2-NH1 2.67Å; R77-D80 PolarHBondContact O-N 2.77Å; R77-L81 PolarHBondContact O-N 3.09Å
78M98.7Very high97.9Very high85 Ų8584.5 Ų84.542%0.41942%0.417SS..Hα-helixtrans-69.9-35.4180-161.4-77-5700111.6E74 R75 K76 N82E74-M78 WeakPolarHBondContact O-CB 3.4Å; E74-M78 PolarHBondContact O-N 3.14Å; R75-M78 PolarHBondContact O-N 2.91Å; K76-M78 VanDerWaalsContact C-N 3.28Å; K76-M78 PolarHBondContact O-N 3.3Å; M78-N82 VanDerWaalsContact O-CG 3.26Å; M78-N82 PolarHBondContact O-N 3Å; M78-N82 PolarHBondContact O-ND2 2.9Å; M78-N82 PolarHBondContact SD-ND2 3.04Å
79H98.7Very high97.9Very high110 Ų11082.6 Ų82.651%0.50941%0.405SS..Hα-helixtrans-62.3-49.3171.3-173.670.4000111.4R75 K76 L81 N82 L83R75-H79 WeakPolarHBondContact O-CB 3.43Å; R75-H79 PolarHBondContact O-N 3.42Å; K76-H79 WeakPolarHBondContact O-CB 3.49Å; K76-H79 PolarHBondContact O-N 2.98Å; K76-H79 VanDerWaalsContact O-N 3.14Å; H79-L81 VanDerWaalsContact C-N 3.3Å; H79-L81 PolarHBondContact O-N 3.38Å; H79-N82 WeakPolarHBondContact O-CB 3.34Å; H79-N82 PolarHBondContact O-N 3.12Å; H79-L83 WeakPolarHBondContact O-CG 3.32Å; H79-L83 PolarHBondContact O-N 3.1Å
80D98.5Very high98Very high83 Ų8383.9 Ų83.944%0.44441%0.412SS..Hα-helixtrans-59.7-41.1178.1-63.6-12.4000111.6K76 R77 N82 L83 A84K76-D80 PolarHBondContact O-N 2.74Å; R77-D80 PolarHBondContact O-N 2.77Å; D80-N82 PolarHBondContact O-N 2.87Å; D80-L83 PolarHBondContact O-N 3.37Å; D80-A84 PolarHBondContact O-N 3.44Å
81L98.5Very high98Very high93 Ų9385.4 Ų85.449%0.48742%0.424SS..Hα-helixtrans-61.3-42.8173.4174.662.8000112.1R77 H79 L83 A84 M85R77-L81 PolarHBondContact O-N 3.09Å; H79-L81 VanDerWaalsContact C-N 3.3Å; H79-L81 PolarHBondContact O-N 3.38Å; L81-L83 VanDerWaalsContact C-N 3.34Å; L81-A84 PolarHBondContact O-N 3.31Å; L81-M85 WeakPolarHBondContact O-CG 3.23Å; L81-M85 PolarHBondContact O-N 2.88Å
82N98.4Very high98Very high46 Ų4681.8 Ų81.825%0.24641%0.405CS..Hα-helixtrans-67.8-35.6178.1-72.1-19.1000111.8M78 H79 D80 M85 D86 K105M78-N82 VanDerWaalsContact O-CG 3.26Å; M78-N82 PolarHBondContact O-N 3Å; M78-N82 PolarHBondContact O-ND2 2.9Å; M78-N82 PolarHBondContact SD-ND2 3.04Å; H79-N82 WeakPolarHBondContact O-CB 3.34Å; H79-N82 PolarHBondContact O-N 3.12Å; D80-N82 PolarHBondContact O-N 2.87Å; N82-M85 PolarHBondContact O-N 3.42Å; N82-D86 PolarHBondContact O-N 3.3Å; N82-K105 WeakPolarHBondContact OD1-CE 3.37Å; N82-K105 PolarHBondContact OD1-NZ 3.46Å
83L98.4Very high97.7Very high93 Ų9384 Ų8449%0.48741%0.414SS..Hα-helixtrans-61.3-45.8172.8-68.6177000110.9H79 D80 L81 M85 D86 G87H79-L83 WeakPolarHBondContact O-CG 3.32Å; H79-L83 PolarHBondContact O-N 3.1Å; D80-L83 PolarHBondContact O-N 3.37Å; L81-L83 VanDerWaalsContact C-N 3.34Å; L83-M85 VanDerWaalsContact C-N 3.33Å; L83-M85 PolarHBondContact O-N 3.01Å; L83-D86 PolarHBondContact O-N 3.48Å; L83-G87 PolarHBondContact O-N 3.36Å
84A98.6Very high97.5Very high66 Ų6683.6 Ų83.655%0.54541%0.414SS..Hα-helixtrans-62.3-39.7175.100000112.4D80 L81 D86 G87 L88D80-A84 PolarHBondContact O-N 3.44Å; L81-A84 PolarHBondContact O-N 3.31Å; A84-D86 VanDerWaalsContact C-N 3.33Å; A84-D86 PolarHBondContact O-N 3.03Å; A84-G87 PolarHBondContact O-N 3.14Å; A84-L88 PolarHBondContact O-N 3.17Å
85M98.5Very high96.9Very high21 Ų2182 Ų8210%0.10342%0.416CS..Hα-helixtrans-66-33174.8-78.6-62.3-56.200113L81 N82 L83 R89 K105 T108 L109L81-M85 WeakPolarHBondContact O-CG 3.23Å; L81-M85 PolarHBondContact O-N 2.88Å; N82-M85 PolarHBondContact O-N 3.42Å; L83-M85 VanDerWaalsContact C-N 3.33Å; L83-M85 PolarHBondContact O-N 3.01Å; M85-R89 WeakPolarHBondContact O-CG 3.46Å; M85-R89 PolarHBondContact O-N 3.01Å; M85-R89 PolarHBondContact O-NH1 3.36Å; M85-K105 HydrophobicContact CE-CB 4.25Å; M85-K105 HydrophobicContact CE-CG 4.36Å; M85-T108 HydrophobicContact CE-CG2 4.02Å; M85-L109 HydrophobicContact CE-CD2 4.22Å; M85-L109 HydrophobicContact CE-CG 4.21Å; M85-L109 HydrophobicContact SD-CD2 4.08Å
86D96.9Very high96.5Very high49 Ų4980.3 Ų80.326%0.26242%0.415SS..Hα-helixtrans-73.1-42.4174.5-83.4-0.1000110.7N82 L83 A84 L88 R89 E90 K102N82-D86 PolarHBondContact O-N 3.3Å; L83-D86 PolarHBondContact O-N 3.48Å; A84-D86 VanDerWaalsContact C-N 3.33Å; A84-D86 PolarHBondContact O-N 3.03Å; D86-L88 VanDerWaalsContact C-N 3.26Å; D86-L88 PolarHBondContact O-N 2.98Å; D86-R89 WeakPolarHBondContact O-CA 3.38Å; D86-R89 WeakPolarHBondContact O-CB 3.17Å; D86-R89 PolarHBondContact O-N 2.87Å; D86-R89 IonicContact OD1-CZ 2.88Å; D86-R89 IonicContact OD1-NH1 3.09Å; D86-R89 PolarHBondContact OD1-NH1 3.47Å; D86-E90 PolarHBondContact O-N 3.14Å; D86-K102 IonicContact OD1-NZ 2.9Å; D86-K102 IonicContact OD2-NZ 3.96Å; D86-K102 PolarHBondContact OD2-NZ 3.33Å
87G97.3Very high95.9Very high29 Ų2975.3 Ų75.330%0.29940%0.403SS..Hα-helixtrans-58.9-35.9171.700000113.1L83 A84 R89 E90L83-G87 PolarHBondContact O-N 3.36Å; A84-G87 PolarHBondContact O-N 3.14Å; G87-R89 VanDerWaalsContact C-N 3.31Å; G87-R89 PolarHBondContact O-N 2.92Å; G87-E90 PolarHBondContact O-N 2.07Å
88L98.3Very high95.3Very high49 Ų4974.8 Ų74.826%0.25742%0.421SS..Hα-helixtrans-62.8-36.8171.7-178.962.2000112.2A84 D86 E90 V91 M92 T108 L109 A112A84-L88 PolarHBondContact O-N 3.17Å; D86-L88 VanDerWaalsContact C-N 3.26Å; D86-L88 PolarHBondContact O-N 2.98Å; L88-E90 VanDerWaalsContact C-N 3.3Å; L88-E90 PolarHBondContact O-N 3.43Å; L88-V91 HydrophobicContact CD1-CG2 4.19Å; L88-V91 WeakPolarHBondContact O-CG2 3.18Å; L88-V91 PolarHBondContact O-N 3.15Å; L88-M92 HydrophobicContact CD1-CE 3.64Å; L88-M92 HydrophobicContact CG-CE 4.24Å; L88-M92 WeakPolarHBondContact O-CG 3.47Å; L88-T108 HydrophobicContact CB-CG2 4.5Å; L88-T108 HydrophobicContact CD2-CG2 3.88Å; L88-T108 HydrophobicContact CG-CG2 3.99Å; L88-L109 HydrophobicContact CD2-CD2 4.14Å; L88-A112 HydrophobicContact CD1-CB 4.19Å; L88-A112 HydrophobicContact CD2-CB 4.17Å
89R97.4Very high94.9Very high39 Ų3976.4 Ų76.415%0.14744%0.44CS..Hα-helixtrans-67.9-30.9179.1-70.6176.5-175.393.4-14.9112.5M85 D86 G87 V91 M92 H96 L103 T108M85-R89 WeakPolarHBondContact O-CG 3.46Å; M85-R89 PolarHBondContact O-N 3.01Å; M85-R89 PolarHBondContact O-NH1 3.36Å; D86-R89 WeakPolarHBondContact O-CA 3.38Å; D86-R89 WeakPolarHBondContact O-CB 3.17Å; D86-R89 PolarHBondContact O-N 2.87Å; D86-R89 IonicContact OD1-CZ 2.88Å; D86-R89 IonicContact OD1-NH1 3.09Å; D86-R89 PolarHBondContact OD1-NH1 3.47Å; G87-R89 VanDerWaalsContact C-N 3.31Å; G87-R89 PolarHBondContact O-N 2.92Å; R89-V91 PolarHBondContact O-N 3.48Å; R89-M92 PolarHBondContact O-N 3.23Å; R89-H96 PolarHBondContact O-CE1 2.97Å; R89-L103 PolarHBondContact NE-O 3.37Å; R89-L103 PolarHBondContact NH2-O 3.46Å; R89-T108 HydrophobicContact CG-CG2 3.64Å; R89-T108 PolarHBondContact NE-OG1 3Å
90E95.9Very high94.6Very high146 Ų14673.8 Ų73.868%0.68243%0.432SS*.Hα-helixtrans-64.4-25.8178.8-66.9173.2-17800112.6D86 G87 L88D86-E90 PolarHBondContact O-N 3.14Å; G87-E90 PolarHBondContact O-N 2.07Å; L88-E90 VanDerWaalsContact C-N 3.3Å; L88-E90 PolarHBondContact O-N 3.43Å
91V96.3Very high94.3Very high94 Ų9480.4 Ų80.457%0.5745%0.451SS*.THydrogen-bonded Turntrans-100.90.5-180-58.60000113.7L88 R89L88-V91 HydrophobicContact CD1-CG2 4.19Å; L88-V91 WeakPolarHBondContact O-CG2 3.18Å; L88-V91 PolarHBondContact O-N 3.15Å; R89-V91 PolarHBondContact O-N 3.48Å
92M97.1Very high94.1Very high8 Ų883 Ų834%0.03946%0.458CS..SBendtrans-77.3138.8178-71.3-58.194.100111.2L88 R89 Y94 H96 T108 L111 A112 Y115L88-M92 HydrophobicContact CD1-CE 3.64Å; L88-M92 HydrophobicContact CG-CE 4.24Å; L88-M92 WeakPolarHBondContact O-CG 3.47Å; R89-M92 PolarHBondContact O-N 3.23Å; M92-Y94 PolarHBondContact O-N 3.11Å; M92-H96 PolarHBondContact O-CE1 3.13Å; M92-H96 VanDerWaalsContact O-CE1 3.24Å; M92-H96 PolarHBondContact O-NE2 3.43Å; M92-H96 VanDerWaalsContact O-NE2 3.08Å; M92-T108 HydrophobicContact CG-CG2 4.39Å; M92-L111 HydrophobicContact CB-CD2 3.94Å; M92-L111 HydrophobicContact CG-CD2 4.2Å; M92-L111 HydrophobicContact SD-CB 4.31Å; M92-L111 HydrophobicContact SD-CD2 4.35Å; M92-L111 HydrophobicContact SD-CG 4.06Å; M92-A112 HydrophobicContact CE-CB 3.88Å; M92-A112 WeakPolarHBondContact SD-CA 3.34Å; M92-A112 HydrophobicContact SD-CB 3.7Å; M92-Y115 HydrophobicContact CE-CD1 4.18Å
93P93.4Very high94Very high73 Ų7382.6 Ų82.647%0.47446%0.456SS..SBendtrans-75.375.7176.233.1-35.9000109.9Y115P93-Y115 HydrophobicContact CB-CE2 4.4Å; P93-Y115 VanDerWaalsContact CD-CD1 3.49Å; P93-Y115 HydrophobicContact CG-CD1 4.03Å; P93-Y115 HydrophobicContact CG-CD2 3.74Å; P93-Y115 HydrophobicContact CG-CE1 4.16Å; P93-Y115 HydrophobicContact CG-CE2 3.88Å; P93-Y115 HydrophobicContact CG-CG 3.81Å
94Y92.4Very high94Very high120 Ų12081.2 Ų81.247%0.47145%0.454SS..SBendtrans-142.4165.4178.4-172.2-109.4000110.2M92 H96 V100 L103M92-Y94 PolarHBondContact O-N 3.11Å; Y94-H96 PolarHBondContact O-CD2 3.24Å; Y94-H96 PolarHBondContact O-N 3.48Å; Y94-H96 PolarHBondContact O-NE2 2.95Å; Y94-V100 HydrophobicContact CE1-CG1 3.83Å; Y94-L103 HydrophobicContact CD1-CD1 4.21Å; Y94-L103 HydrophobicContact CD1-CD2 4.21Å; Y94-L103 HydrophobicContact CD1-CG 4.19Å; Y94-L103 HydrophobicContact CE1-CD2 3.99Å; Y94-L103 HydrophobicContact CE1-CG 4.37Å; Y94-L103 HydrophobicContact CG-CD1 4.3Å
95A86.6Confident94Very high57 Ų5782.7 Ų82.747%0.47145%0.448SS..  trans-60.2122.6177.900000110.7V100A95-V100 HydrophobicContact CB-CG1 4.2Å; A95-V100 HydrophobicContact CB-CG2 4.19Å; A95-V100 WeakPolarHBondContact O-CG1 3.43Å
96H89.7Confident94Very high120 Ų12087 Ų8756%0.55647%0.471SS*.  trans-105.9131.9172.1-55.6-52.6000109.1R89 M92 Y94R89-H96 PolarHBondContact O-CE1 2.97Å; M92-H96 PolarHBondContact O-CE1 3.13Å; M92-H96 VanDerWaalsContact O-CE1 3.24Å; M92-H96 PolarHBondContact O-NE2 3.43Å; M92-H96 VanDerWaalsContact O-NE2 3.08Å; Y94-H96 PolarHBondContact O-CD2 3.24Å; Y94-H96 PolarHBondContact O-N 3.48Å; Y94-H96 PolarHBondContact O-NE2 2.95Å
97G86.4Confident94Very high37 Ų3786.4 Ų86.438%0.38147%0.472SS..SBendtrans175.9155174.900000111.7S99 V100G97-S99 PolarHBondContact O-N 3.27Å; G97-S99 VanDerWaalsContact O-N 3.13Å; G97-V100 PolarHBondContact O-N 3.23Å
98P85.7Confident94.1Very high152 Ų15285 Ų8599%0.98746%0.458SS*.THydrogen-bonded Turntrans-62.8-21.1-178.625.5-34000112.9
99S89.9Confident94.1Very high119 Ų11987 Ų8783%0.83247%0.468SS*.THydrogen-bonded Turntrans-92.7-7.5175.8-171.10000113.9G97G97-S99 PolarHBondContact O-N 3.27Å; G97-S99 VanDerWaalsContact O-N 3.13Å
100V91.6Very high94.1Very high56 Ų5689.6 Ų89.634%0.33949%0.485SS..SBendtrans-90.8132.1-176.5-175.80000109.8Y94 A95 G97Y94-V100 HydrophobicContact CE1-CG1 3.83Å; A95-V100 HydrophobicContact CB-CG1 4.2Å; A95-V100 HydrophobicContact CB-CG2 4.19Å; A95-V100 WeakPolarHBondContact O-CG1 3.43Å; G97-V100 PolarHBondContact O-N 3.23Å
101R93.9Very high94.2Very high221 Ų22185 Ų8583%0.83447%0.465SS*.PPolyproline II helixtrans-67.5135-179.9-168.9-176.5-66.5126-1.8110.6
102K94.1Very high94.3Very high147 Ų14781.1 Ų81.164%0.63944%0.442SS*.PPolyproline II helixtrans-59.9136.6172.5-69.6-170.8172.8-169.20111.1D86D86-K102 IonicContact OD1-NZ 2.9Å; D86-K102 IonicContact OD2-NZ 3.96Å; D86-K102 PolarHBondContact OD2-NZ 3.33Å
103L95.4Very high94.4Very high38 Ų3888 Ų8820%0.19947%0.468CS..PPolyproline II helixtrans-64.4146.1171.3-62.9176.3000111.2R89 Y94 A107 L111R89-L103 PolarHBondContact NE-O 3.37Å; R89-L103 PolarHBondContact NH2-O 3.46Å; Y94-L103 HydrophobicContact CD1-CD1 4.21Å; Y94-L103 HydrophobicContact CD1-CD2 4.21Å; Y94-L103 HydrophobicContact CD1-CG 4.19Å; Y94-L103 HydrophobicContact CE1-CD2 3.99Å; Y94-L103 HydrophobicContact CE1-CG 4.37Å; Y94-L103 HydrophobicContact CG-CD1 4.3Å; L103-A107 HydrophobicContact CB-CB 4.43Å; L103-L111 HydrophobicContact CD1-CD2 3.82Å
104S97.9Very high94.7Very high64 Ų6488.4 Ų88.445%0.44847%0.466SS..PPolyproline II helixtrans-65.3162.6172.774.90000111.2I106 A107 T108S104-I106 VanDerWaalsContact C-N 3.34Å; S104-I106 PolarHBondContact O-N 3.33Å; S104-I106 WeakPolarHBondContact OG-CG2 3.44Å; S104-A107 PolarHBondContact O-N 3.21Å; S104-A107 VanDerWaalsContact OG-CB 3.26Å; S104-A107 WeakPolarHBondContact OG-CB 3.49Å; S104-A107 PolarHBondContact OG-N 2.67Å; S104-T108 WeakPolarHBondContact O-CB 3.45Å; S104-T108 PolarHBondContact O-N 3.3Å; S104-T108 PolarHBondContact O-OG1 3.5Å
105K98.3Very high95Very high98 Ų9886.6 Ų86.643%0.42646%0.459SS..Hα-helixtrans-57.9-46.7179.1-68.9-174.9175.1-173.80111.5N82 M85 T108 L109N82-K105 WeakPolarHBondContact OD1-CE 3.37Å; N82-K105 PolarHBondContact OD1-NZ 3.46Å; M85-K105 HydrophobicContact CE-CB 4.25Å; M85-K105 HydrophobicContact CE-CG 4.36Å; K105-T108 PolarHBondContact O-N 3.36Å; K105-L109 WeakPolarHBondContact O-CG 3.37Å; K105-L109 PolarHBondContact O-N 3.43Å; K105-L109 VanDerWaalsContact O-N 3.13Å
106I98.5Very high95.5Very high112 Ų11289 Ų8957%0.57446%0.463SS*.Hα-helixtrans-66.1-42.6179.4-172.960.7000112S104 T108 L109 L110S104-I106 VanDerWaalsContact C-N 3.34Å; S104-I106 PolarHBondContact O-N 3.33Å; S104-I106 WeakPolarHBondContact OG-CG2 3.44Å; I106-T108 VanDerWaalsContact C-N 3.32Å; I106-T108 PolarHBondContact O-N 3.3Å; I106-L109 PolarHBondContact O-N 2.92Å; I106-L110 HydrophobicContact CD1-CD1 4.48Å; I106-L110 HydrophobicContact CD1-CG 4.38Å; I106-L110 HydrophobicContact CG1-CD1 4.11Å; I106-L110 HydrophobicContact CG1-CG 4.45Å; I106-L110 WeakPolarHBondContact O-CG 3.33Å; I106-L110 PolarHBondContact O-N 3.34Å
107A98Very high95.9Very high35 Ų3587.7 Ų87.729%0.28946%0.459SS..Hα-helixtrans-63.2-41178.200000111.5L103 S104 L110 L111L103-A107 HydrophobicContact CB-CB 4.43Å; S104-A107 PolarHBondContact O-N 3.21Å; S104-A107 VanDerWaalsContact OG-CB 3.26Å; S104-A107 WeakPolarHBondContact OG-CB 3.49Å; S104-A107 PolarHBondContact OG-N 2.67Å; A107-L110 PolarHBondContact O-N 2.91Å; A107-L111 WeakPolarHBondContact O-CB 3.33Å; A107-L111 PolarHBondContact O-N 3.19Å
108T98.4Very high96.5Very high0 Ų091.9 Ų91.90%047%0.471CS..Hα-helixtrans-61-46.3177-51.50000111.1M85 L88 R89 M92 S104 K105 I106 L111 A112M85-T108 HydrophobicContact CE-CG2 4.02Å; L88-T108 HydrophobicContact CB-CG2 4.5Å; L88-T108 HydrophobicContact CD2-CG2 3.88Å; L88-T108 HydrophobicContact CG-CG2 3.99Å; R89-T108 HydrophobicContact CG-CG2 3.64Å; R89-T108 PolarHBondContact NE-OG1 3Å; M92-T108 HydrophobicContact CG-CG2 4.39Å; S104-T108 WeakPolarHBondContact O-CB 3.45Å; S104-T108 PolarHBondContact O-N 3.3Å; S104-T108 PolarHBondContact O-OG1 3.5Å; K105-T108 PolarHBondContact O-N 3.36Å; I106-T108 VanDerWaalsContact C-N 3.32Å; I106-T108 PolarHBondContact O-N 3.3Å; T108-L111 PolarHBondContact O-N 2.88Å; T108-A112 WeakPolarHBondContact O-CB 3.26Å; T108-A112 PolarHBondContact O-N 2.95Å
109L98.7Very high97.1Very high90 Ų9088.3 Ų88.347%0.47144%0.443SS..Hα-helixtrans-67.1-39.5180-66.2176.7000112.7M85 L88 K105 I106 A112 R113M85-L109 HydrophobicContact CE-CD2 4.22Å; M85-L109 HydrophobicContact CE-CG 4.21Å; M85-L109 HydrophobicContact SD-CD2 4.08Å; L88-L109 HydrophobicContact CD2-CD2 4.14Å; K105-L109 WeakPolarHBondContact O-CG 3.37Å; K105-L109 PolarHBondContact O-N 3.43Å; K105-L109 VanDerWaalsContact O-N 3.13Å; I106-L109 PolarHBondContact O-N 2.92Å; L109-A112 PolarHBondContact O-N 2.94Å; L109-R113 PolarHBondContact O-N 3.08Å
110L98.4Very high97.5Very high94 Ų9485.9 Ų85.949%0.49242%0.423SS..Hα-helixtrans-64-45.5175.4-72.4173.2000111.6I106 A107 R113 N114I106-L110 HydrophobicContact CD1-CD1 4.48Å; I106-L110 HydrophobicContact CD1-CG 4.38Å; I106-L110 HydrophobicContact CG1-CD1 4.11Å; I106-L110 HydrophobicContact CG1-CG 4.45Å; I106-L110 WeakPolarHBondContact O-CG 3.33Å; I106-L110 PolarHBondContact O-N 3.34Å; A107-L110 PolarHBondContact O-N 2.91Å; L110-R113 PolarHBondContact O-N 3.22Å; L110-N114 PolarHBondContact O-N 3.08Å; L110-N114 VanDerWaalsContact O-N 3.08Å
111L98.3Very high97.8Very high50 Ų5087 Ų8726%0.26243%0.433SS..Hα-helixtrans-62.6-43.8177.3-17559.3000111.1M92 L103 A107 T108 R113 N114 Y115M92-L111 HydrophobicContact CB-CD2 3.94Å; M92-L111 HydrophobicContact CG-CD2 4.2Å; M92-L111 HydrophobicContact SD-CB 4.31Å; M92-L111 HydrophobicContact SD-CD2 4.35Å; M92-L111 HydrophobicContact SD-CG 4.06Å; L103-L111 HydrophobicContact CD1-CD2 3.82Å; A107-L111 WeakPolarHBondContact O-CB 3.33Å; A107-L111 PolarHBondContact O-N 3.19Å; T108-L111 PolarHBondContact O-N 2.88Å; L111-R113 PolarHBondContact O-N 3.18Å; L111-N114 PolarHBondContact O-N 3.1Å; L111-Y115 VanDerWaalsContact O-CB 3.3Å; L111-Y115 WeakPolarHBondContact O-CB 3.46Å; L111-Y115 PolarHBondContact O-N 3.22Å
112A98.7Very high98Very high12 Ų1279 Ų7910%0.09941%0.411CS..Hα-helixtrans-59.7-45.4177.100000112.2L88 M92 T108 L109 N114 Y115 I116L88-A112 HydrophobicContact CD1-CB 4.19Å; L88-A112 HydrophobicContact CD2-CB 4.17Å; M92-A112 HydrophobicContact CE-CB 3.88Å; M92-A112 WeakPolarHBondContact SD-CA 3.34Å; M92-A112 HydrophobicContact SD-CB 3.7Å; T108-A112 WeakPolarHBondContact O-CB 3.26Å; T108-A112 PolarHBondContact O-N 2.95Å; L109-A112 PolarHBondContact O-N 2.94Å; A112-N114 PolarHBondContact O-N 2.82Å; A112-Y115 PolarHBondContact O-N 3.24Å; A112-I116 WeakPolarHBondContact O-CG1 3.4Å; A112-I116 PolarHBondContact O-N 3.42Å
113R98.6Very high98.2Very high153 Ų15376.4 Ų76.458%0.57740%0.404SS*.Hα-helixtrans-57.8-49.6176-179.4-174.5179.3-79.5-2.1111.3L109 L110 L111 Y115 I116 L117L109-R113 PolarHBondContact O-N 3.08Å; L110-R113 PolarHBondContact O-N 3.22Å; L111-R113 PolarHBondContact O-N 3.18Å; R113-Y115 VanDerWaalsContact C-N 3.29Å; R113-Y115 PolarHBondContact O-N 3.02Å; R113-I116 PolarHBondContact O-N 2.93Å; R113-L117 WeakPolarHBondContact O-CG 3.35Å; R113-L117 PolarHBondContact O-N 3.37Å
114N98.4Very high98.3Very high82 Ų8278.4 Ų78.444%0.43942%0.415SS..Hα-helixtrans-66.6-35.6-178.5-68.7-14.2000111.5L110 L111 A112 L117 M118L110-N114 PolarHBondContact O-N 3.08Å; L110-N114 VanDerWaalsContact O-N 3.08Å; L111-N114 PolarHBondContact O-N 3.1Å; A112-N114 PolarHBondContact O-N 2.82Å; N114-L117 PolarHBondContact O-N 2.79Å; N114-M118 PolarHBondContact O-N 3.13Å
115Y98.6Very high98.3Very high81 Ų8179.2 Ų79.232%0.31841%0.411SS..Hα-helixtrans-66.3-43.3177.8-174.1-146000111.9M92 P93 L111 A112 R113 L117 M118 L119M92-Y115 HydrophobicContact CE-CD1 4.18Å; P93-Y115 HydrophobicContact CB-CE2 4.4Å; P93-Y115 VanDerWaalsContact CD-CD1 3.49Å; P93-Y115 HydrophobicContact CG-CD1 4.03Å; P93-Y115 HydrophobicContact CG-CD2 3.74Å; P93-Y115 HydrophobicContact CG-CE1 4.16Å; P93-Y115 HydrophobicContact CG-CE2 3.88Å; P93-Y115 HydrophobicContact CG-CG 3.81Å; L111-Y115 VanDerWaalsContact O-CB 3.3Å; L111-Y115 WeakPolarHBondContact O-CB 3.46Å; L111-Y115 PolarHBondContact O-N 3.22Å; A112-Y115 PolarHBondContact O-N 3.24Å; R113-Y115 VanDerWaalsContact C-N 3.29Å; R113-Y115 PolarHBondContact O-N 3.02Å; Y115-L117 VanDerWaalsContact C-N 3.32Å; Y115-L117 PolarHBondContact O-N 2.97Å; Y115-M118 PolarHBondContact O-N 2.74Å; Y115-L119 HydrophobicContact CD1-CD1 4.2Å; Y115-L119 HydrophobicContact CD2-CD1 4.04Å; Y115-L119 HydrophobicContact CD2-CD2 4.42Å; Y115-L119 HydrophobicContact CD2-CG 3.86Å; Y115-L119 HydrophobicContact CE1-CD1 3.9Å; Y115-L119 HydrophobicContact CE2-CD1 3.72Å; Y115-L119 HydrophobicContact CE2-CD2 3.69Å; Y115-L119 HydrophobicContact CE2-CG 3.58Å; Y115-L119 HydrophobicContact CG-CD1 4.27Å; Y115-L119 WeakPolarHBondContact O-CG 3.34Å; Y115-L119 PolarHBondContact O-N 3.33Å
116I98.6Very high98.3Very high108 Ų10879.5 Ų79.555%0.55442%0.416SS*.Hα-helixtrans-56.8-46.8173.2-68165.3000110.5A112 R113 M118 L119 T120A112-I116 WeakPolarHBondContact O-CG1 3.4Å; A112-I116 PolarHBondContact O-N 3.42Å; R113-I116 PolarHBondContact O-N 2.93Å; I116-M118 PolarHBondContact O-N 2.93Å; I116-L119 PolarHBondContact O-N 3.41Å; I116-T120 PolarHBondContact O-N 3.43Å; I116-T120 PolarHBondContact O-OG1 3.19Å
117L98.5Very high98.1Very high92 Ų9280.5 Ų80.548%0.48242%0.416SS..Hα-helixtrans-61.3-44.2179.2-68.7175.1000112.7R113 N114 Y115 T120 S121R113-L117 WeakPolarHBondContact O-CG 3.35Å; R113-L117 PolarHBondContact O-N 3.37Å; N114-L117 PolarHBondContact O-N 2.79Å; Y115-L117 VanDerWaalsContact C-N 3.32Å; Y115-L117 PolarHBondContact O-N 2.97Å; L117-T120 PolarHBondContact O-N 3.43Å; L117-S121 PolarHBondContact O-N 2.99Å
118M98.4Very high98Very high126 Ų12684.3 Ų84.362%0.62142%0.423SS*.Hα-helixtrans-60-46.1176.1-87.2-73.2-60.800112.1N114 Y115 I116 S121 S122N114-M118 PolarHBondContact O-N 3.13Å; Y115-M118 PolarHBondContact O-N 2.74Å; I116-M118 PolarHBondContact O-N 2.93Å; M118-S121 PolarHBondContact O-N 3.43Å; M118-S122 WeakPolarHBondContact O-CB 3.3Å; M118-S122 PolarHBondContact O-N 3.31Å; M118-S122 PolarHBondContact O-OG 3.4Å
119L98.4Very high97.9Very high77 Ų7787.8 Ų87.840%0.40344%0.441SS..Hα-helixtrans-64.1-43.9178.1-71175.3000111.3Y115 I116 S122 L123Y115-L119 HydrophobicContact CD1-CD1 4.2Å; Y115-L119 HydrophobicContact CD2-CD1 4.04Å; Y115-L119 HydrophobicContact CD2-CD2 4.42Å; Y115-L119 HydrophobicContact CD2-CG 3.86Å; Y115-L119 HydrophobicContact CE1-CD1 3.9Å; Y115-L119 HydrophobicContact CE2-CD1 3.72Å; Y115-L119 HydrophobicContact CE2-CD2 3.69Å; Y115-L119 HydrophobicContact CE2-CG 3.58Å; Y115-L119 HydrophobicContact CG-CD1 4.27Å; Y115-L119 WeakPolarHBondContact O-CG 3.34Å; Y115-L119 PolarHBondContact O-N 3.33Å; I116-L119 PolarHBondContact O-N 3.41Å; L119-S122 PolarHBondContact O-N 3.42Å; L119-L123 WeakPolarHBondContact O-CB 3.34Å; L119-L123 VanDerWaalsContact O-CG 3.31Å; L119-L123 WeakPolarHBondContact O-CG 3.31Å; L119-L123 PolarHBondContact O-N 2.92Å
120T98.4Very high97.7Very high67 Ų6787.1 Ų87.141%0.41144%0.44SS..Hα-helixtrans-59.6-49.3176.3-59.10000111.4I116 L117 S122 L123 D124I116-T120 PolarHBondContact O-N 3.43Å; I116-T120 PolarHBondContact O-OG1 3.19Å; L117-T120 PolarHBondContact O-N 3.43Å; T120-S122 VanDerWaalsContact C-N 3.28Å; T120-S122 PolarHBondContact O-N 2.97Å; T120-L123 PolarHBondContact O-N 3.29Å; T120-D124 PolarHBondContact O-N 2.82Å
121S98.1Very high97.5Very high79 Ų7984.6 Ų84.655%0.55244%0.437SS*.Hα-helixtrans-59.8-39.4177.4-172.90000112.2L117 M118 D124 E125L117-S121 PolarHBondContact O-N 2.99Å; M118-S121 PolarHBondContact O-N 3.43Å; S121-D124 PolarHBondContact O-N 3.46Å; S121-E125 WeakPolarHBondContact O-CB 3.36Å; S121-E125 PolarHBondContact O-N 3.45Å
122S98.3Very high97.1Very high54 Ų5486.8 Ų86.838%0.37845%0.446SS..Hα-helixtrans-67.7-39.7178-58.20000111.8M118 L119 T120 M126M118-S122 WeakPolarHBondContact O-CB 3.3Å; M118-S122 PolarHBondContact O-N 3.31Å; M118-S122 PolarHBondContact O-OG 3.4Å; L119-S122 PolarHBondContact O-N 3.42Å; T120-S122 VanDerWaalsContact C-N 3.28Å; T120-S122 PolarHBondContact O-N 2.97Å; S122-M126 WeakPolarHBondContact O-CE 3.46Å; S122-M126 WeakPolarHBondContact O-CG 3.42Å; S122-M126 PolarHBondContact O-N 3.28Å
123L98.3Very high96.8Very high92 Ų9292.3 Ų92.348%0.48247%0.472SS..Hα-helixtrans-64.9-41.2176-74172.9000111.8L119 T120 M126 K127L119-L123 WeakPolarHBondContact O-CB 3.34Å; L119-L123 VanDerWaalsContact O-CG 3.31Å; L119-L123 WeakPolarHBondContact O-CG 3.31Å; L119-L123 PolarHBondContact O-N 2.92Å; T120-L123 PolarHBondContact O-N 3.29Å; L123-M126 HydrophobicContact CD2-CE 3.84Å; L123-M126 PolarHBondContact O-N 3.47Å; L123-K127 VanDerWaalsContact O-CG 3.27Å; L123-K127 WeakPolarHBondContact O-CG 3.34Å; L123-K127 PolarHBondContact O-N 3.27Å
124D97.4Very high96.1Very high80 Ų8094.4 Ų94.443%0.42848%0.481SS..Hα-helixtrans-70.3-38-179.7-67.5-24.9000112.1T120 S121 K127 R128T120-D124 PolarHBondContact O-N 2.82Å; S121-D124 PolarHBondContact O-N 3.46Å; D124-K127 PolarHBondContact O-N 3.01Å; D124-K127 IonicContact OD1-NZ 2.89Å; D124-K127 PolarHBondContact OD1-NZ 3.34Å; D124-R128 PolarHBondContact O-N 3.26Å
125E97.5Very high94.8Very high82 Ų8293.6 Ų93.638%0.38349%0.492SS..Hα-helixtrans-64.2-44.3172.6-179.957.6-165.300111.8S121 K127 R128 L129S121-E125 WeakPolarHBondContact O-CB 3.36Å; S121-E125 PolarHBondContact O-N 3.45Å; E125-K127 VanDerWaalsContact C-N 3.31Å; E125-K127 PolarHBondContact O-N 2.82Å; E125-R128 WeakPolarHBondContact O-CB 3.27Å; E125-R128 PolarHBondContact O-N 3.32Å; E125-R128 VanDerWaalsContact O-N 3.15Å; E125-R128 IonicContact OE1-CZ 3.47Å; E125-R128 IonicContact OE1-NE 3.47Å; E125-R128 PolarHBondContact OE1-NE 3.38Å; E125-R128 IonicContact OE1-NH2 2.67Å; E125-R128 PolarHBondContact OE1-NH2 3.02Å; E125-R128 IonicContact OE2-CZ 3.69Å; E125-R128 IonicContact OE2-NE 2.92Å; E125-R128 PolarHBondContact OE2-NE 3.46Å; E125-R128 IonicContact OE2-NH2 3.59Å; E125-L129 HydrophobicContact CG-CD1 4.27Å; E125-L129 WeakPolarHBondContact O-CG 3.27Å; E125-L129 PolarHBondContact O-N 3.46Å
126M97.4Very high92.9Very high104 Ų10491.5 Ų91.551%0.51250%0.496SS..Hα-helixtrans-60.8-39.6174.7-75.4-172.6-70.800112S122 L123 R128 L129 V130S122-M126 WeakPolarHBondContact O-CE 3.46Å; S122-M126 WeakPolarHBondContact O-CG 3.42Å; S122-M126 PolarHBondContact O-N 3.28Å; L123-M126 HydrophobicContact CD2-CE 3.84Å; L123-M126 PolarHBondContact O-N 3.47Å; M126-R128 VanDerWaalsContact C-N 3.35Å; M126-L129 PolarHBondContact O-N 2.91Å; M126-V130 WeakPolarHBondContact O-CB 3.48Å; M126-V130 WeakPolarHBondContact O-CG2 3.38Å; M126-V130 PolarHBondContact O-N 3.08Å
127K95.6Very high90.8Very high132 Ų13295 Ų9557%0.57451%0.51SS*.Hα-helixtrans-63.4-40.1174.6-71.4170.1-159.61560112L123 D124 E125 G131L123-K127 VanDerWaalsContact O-CG 3.27Å; L123-K127 WeakPolarHBondContact O-CG 3.34Å; L123-K127 PolarHBondContact O-N 3.27Å; D124-K127 PolarHBondContact O-N 3.01Å; D124-K127 IonicContact OD1-NZ 2.89Å; D124-K127 PolarHBondContact OD1-NZ 3.34Å; E125-K127 VanDerWaalsContact C-N 3.31Å; E125-K127 PolarHBondContact O-N 2.82Å; K127-G131 PolarHBondContact O-N 2.96Å
128R95.8Very high88.7Confident116 Ų11699.6 Ų99.644%0.43853%0.528SS..Hα-helixtrans-60.7-51176-173.3-172.571.283.41.2110.7D124 E125 M126 V130 G131 E132D124-R128 PolarHBondContact O-N 3.26Å; E125-R128 WeakPolarHBondContact O-CB 3.27Å; E125-R128 PolarHBondContact O-N 3.32Å; E125-R128 VanDerWaalsContact O-N 3.15Å; E125-R128 IonicContact OE1-CZ 3.47Å; E125-R128 IonicContact OE1-NE 3.47Å; E125-R128 PolarHBondContact OE1-NE 3.38Å; E125-R128 IonicContact OE1-NH2 2.67Å; E125-R128 PolarHBondContact OE1-NH2 3.02Å; E125-R128 IonicContact OE2-CZ 3.69Å; E125-R128 IonicContact OE2-NE 2.92Å; E125-R128 PolarHBondContact OE2-NE 3.46Å; E125-R128 IonicContact OE2-NH2 3.59Å; M126-R128 VanDerWaalsContact C-N 3.35Å; R128-V130 PolarHBondContact O-N 3.18Å; R128-G131 WeakPolarHBondContact O-CA 3.2Å; R128-G131 PolarHBondContact O-N 3.46Å; R128-G131 VanDerWaalsContact O-N 3.15Å; R128-E132 IonicContact CZ-OE1 3.59Å; R128-E132 IonicContact CZ-OE2 3.93Å; R128-E132 IonicContact NH1-OE1 2.57Å; R128-E132 PolarHBondContact NH1-OE1 2.91Å; R128-E132 IonicContact NH1-OE2 3.17Å; R128-E132 PolarHBondContact NH1-OE2 3.38Å; R128-E132 VanDerWaalsContact NH1-OE2 3.17Å; R128-E132 WeakPolarHBondContact O-CG 3.37Å; R128-E132 PolarHBondContact O-N 2.97Å
129L95.4Very high86.7Confident72 Ų7298.6 Ų98.638%0.37753%0.534SS..Hα-helixtrans-61.9-42.5179.1-66.5173.6000112.3E125 M126 E132 I133E125-L129 HydrophobicContact CG-CD1 4.27Å; E125-L129 WeakPolarHBondContact O-CG 3.27Å; E125-L129 PolarHBondContact O-N 3.46Å; M126-L129 PolarHBondContact O-N 2.91Å; L129-E132 PolarHBondContact O-N 3.32Å; L129-I133 VanDerWaalsContact O-CG1 3.31Å; L129-I133 WeakPolarHBondContact O-CG1 3.36Å; L129-I133 PolarHBondContact O-N 3.31Å
130V94.9Very high84.6Confident76 Ų7699 Ų9946%0.46155%0.549SS..Hα-helixtrans-63.5-43.8173.7170.80000110.2M126 R128 E132 I133 Y134M126-V130 WeakPolarHBondContact O-CB 3.48Å; M126-V130 WeakPolarHBondContact O-CG2 3.38Å; M126-V130 PolarHBondContact O-N 3.08Å; R128-V130 PolarHBondContact O-N 3.18Å; V130-E132 VanDerWaalsContact C-N 3.25Å; V130-E132 PolarHBondContact O-N 3.2Å; V130-I133 PolarHBondContact O-N 3.31Å; V130-Y134 HydrophobicContact CG1-CD2 3.59Å; V130-Y134 HydrophobicContact CG1-CE2 3.89Å; V130-Y134 VanDerWaalsContact O-CD2 3.27Å; V130-Y134 WeakPolarHBondContact O-CD2 3.31Å; V130-Y134 PolarHBondContact O-N 2.92Å
131G93.1Very high82.1Confident41 Ų41105.7 Ų105.742%0.42357%0.572SS.*Hα-helixtrans-57.9-37174.700000113.1K127 R128 G135K127-G131 PolarHBondContact O-N 2.96Å; R128-G131 WeakPolarHBondContact O-CA 3.2Å; R128-G131 PolarHBondContact O-N 3.46Å; R128-G131 VanDerWaalsContact O-N 3.15Å; G131-G135 VanDerWaalsContact O-CA 3.23Å; G131-G135 WeakPolarHBondContact O-CA 3.43Å; G131-G135 PolarHBondContact O-N 2.98Å
132E91.7Very high79.6Confident97 Ų97110.2 Ų110.245%0.45358%0.584SS.*Hα-helixtrans-69.2-41.9175.8-74.5167.6-17300112.4R128 L129 V130 G136R128-E132 IonicContact CZ-OE1 3.59Å; R128-E132 IonicContact CZ-OE2 3.93Å; R128-E132 IonicContact NH1-OE1 2.57Å; R128-E132 PolarHBondContact NH1-OE1 2.91Å; R128-E132 IonicContact NH1-OE2 3.17Å; R128-E132 PolarHBondContact NH1-OE2 3.38Å; R128-E132 VanDerWaalsContact NH1-OE2 3.17Å; R128-E132 WeakPolarHBondContact O-CG 3.37Å; R128-E132 PolarHBondContact O-N 2.97Å; L129-E132 PolarHBondContact O-N 3.32Å; V130-E132 VanDerWaalsContact C-N 3.25Å; V130-E132 PolarHBondContact O-N 3.2Å; E132-G136 WeakPolarHBondContact O-CA 3.48Å; E132-G136 PolarHBondContact O-N 3.46Å
133I91.4Very high76.9Confident127 Ų127113.7 Ų113.765%0.65161%0.607SS**Hα-helixtrans-68.4-42.1179-66.3165.6000111.4L129 V130L129-I133 VanDerWaalsContact O-CG1 3.31Å; L129-I133 WeakPolarHBondContact O-CG1 3.36Å; L129-I133 PolarHBondContact O-N 3.31Å; V130-I133 PolarHBondContact O-N 3.31Å
134Y84.7Confident74.5Confident197 Ų197112.1 Ų112.177%0.77361%0.613SS**Hα-helixtrans-93.9-21.1-174.4-72.1-87.3000114.1V130V130-Y134 HydrophobicContact CG1-CD2 3.59Å; V130-Y134 HydrophobicContact CG1-CE2 3.89Å; V130-Y134 VanDerWaalsContact O-CD2 3.27Å; V130-Y134 WeakPolarHBondContact O-CD2 3.31Å; V130-Y134 PolarHBondContact O-N 2.92Å
135G70.9Confident71.8Confident65 Ų65114.8 Ų114.867%0.6763%0.632SS**Hα-helixtrans-108.62.9-177.800000115.1G131G131-G135 VanDerWaalsContact O-CA 3.23Å; G131-G135 WeakPolarHBondContact O-CA 3.43Å; G131-G135 PolarHBondContact O-N 2.98Å
136G58.9Low69.3Low37 Ų37117.5 Ų117.538%0.38165%0.654SS.*  trans-135.939.2-160.100000117.4E132 H138E132-G136 WeakPolarHBondContact O-CA 3.48Å; E132-G136 PolarHBondContact O-N 3.46Å; G136-H138 VanDerWaalsContact C-N 3.27Å
137Q54.6Low66.8Low183 Ų183116.3 Ų116.386%0.85566%0.661SS**SBendtrans-90.322.9162-117.8162.5-600113
138H53.4Low64.2Low187 Ų187119.5 Ų119.587%0.86668%0.678SS**SBendtrans-128.720.7-175.3-76-83.9000116G136G136-H138 VanDerWaalsContact C-N 3.27Å
139S57.5Low61.6Low105 Ų105118.8 Ų118.873%0.73470%0.696SS**SBendtrans-137.79.5173.854.30000115.3F141S139-F141 PolarHBondContact O-N 3.44Å
140A53.9Low58.8Low87 Ų87120.6 Ų120.672%0.71972%0.721SS**  trans-91.116.1178.500000114.8
141F44.3Very low56Low206 Ų206120.5 Ų120.590%0.90474%0.736SS**  trans-121.668.9168.5-73.8-81.2000110.7S139S139-F141 PolarHBondContact O-N 3.44Å
142H47Very low53.7Low175 Ų175125.7 Ų125.781%0.8176%0.76SS**  trans-137.462.2148.2-132.3-60.2000109.2
143C41.7Very low51Low126 Ų126124.5 Ų124.585%0.85177%0.774SS**  trans-86.6124.7158.7-175.30000108
144G47.7Very low48.4Very low59 Ų59121.3 Ų121.361%0.60877%0.772SS**  trans74.4110.4149.200000118.4
145T40.5Very low46.2Very low136 Ų136121.2 Ų121.283%0.83478%0.779SS**  trans-151.7106.8137.4-6.40000110.6
146V45.6Very low44.5Very low139 Ų139124 Ų12484%0.84279%0.788SS**  trans-69.6134.5162.1-109.70000109.1
147A44Very low43.3Very low79 Ų79127.1 Ų127.165%0.65381%0.81SS**  trans50.1133.415000000120.8
148H40.2Very low42.5Very low200 Ų200124.5 Ų124.593%0.92681%0.806SS**  -178.7140.7112.1-89.6-69.9000110.8
149A41.5Very low41.8Very low100 Ų100121.7 Ų121.783%0.82680%0.804SS**  trans-92.1150.6-17200000113.6
150A38Very low40.6Very low110 Ų110121.3 Ų121.391%0.90981%0.808SS**  trans174.7131.413600000111.8
151G36.4Very low39.8Very low75 Ų75122.2 Ų122.277%0.77382%0.815SS**  trans144.568.4162.700000117.8
152T43.6Very low39.2Very low149 Ų149116.7 Ų116.791%0.91481%0.807SS**  trans0.7132.2159.457.30000121.5
153G34.5Very low38.6Very low73 Ų73113 Ų11375%0.75381%0.807SS**  trans146.872.3139.200000119.5
154G37.8Very low38.2Very low60 Ų60111.6 Ų111.662%0.61981%0.805SS**  trans90.7138.1135.800000120.8
155H37.6Very low37.3Very low195 Ų195113.1 Ų113.190%0.90381%0.812SS**  trans76125.9158.537.2-79.6000120.7
156S36Very low37Very low124 Ų124111.4 Ų111.487%0.86781%0.811SS**  trans-84141.4-159.2-45.40000114.8
157A33.8Very low36.3Very low101 Ų101109.6 Ų109.684%0.83581%0.811SS**  trans-165124.6135.200000110.3
158V36.5Very low35.6Very low129 Ų129110.4 Ų110.478%0.78282%0.817SS**  trans-71.4145.9-179.81760000110.1A160V158-A160 HydrophobicContact CG1-CB 4.22Å; V158-A160 VanDerWaalsContact CG1-N 3.29Å
159P40.1Very low35.2Very low128 Ų128105.7 Ų105.783%0.83181%0.813SS**  -129132.4108.833.6-23.9000111.9A161P159-A161 PolarHBondContact O-N 3.45Å
160A31.2Very low34.7Very low97 Ų97105.6 Ų105.680%0.80281%0.812SS**  trans-76.7110.2175.300000109.5V158V158-A160 HydrophobicContact CG1-CB 4.22Å; V158-A160 VanDerWaalsContact CG1-N 3.29Å
161A36.9Very low34.3Very low105 Ų105104.4 Ų104.487%0.86880%0.803SS**  trans-135.4104.3149.400000107P159P159-A161 PolarHBondContact O-N 3.45Å
162A33.5Very low34.1Very low90 Ų90109.3 Ų109.374%0.74481%0.805SS**  trans-127.4120.3160.400000104.7
163A33.2Very low33.6Very low97 Ų97110.1 Ų110.180%0.80280%0.798SS**  51.4128.87000000109.7
164A33.7Very low34Very low98 Ų98112.9 Ų112.981%0.8180%0.8SS**  cis-171.7170.56.500000105.9
165A29.1Very low34Very low91 Ų91118 Ų11875%0.75281%0.808SS**  trans155.6103.5141.400000106.8
166A32.9Very low34.9Very low100 Ų100113.5 Ų113.583%0.82680%0.796SS**  53.197.373.800000112.8
167A31.1Very low34.9Very low101 Ų101115.8 Ų115.884%0.83580%0.797SS**  162.6152.8106.900000112.7
168A30.7Very low35.5Very low95 Ų95119.2 Ų119.279%0.78580%0.801SS**  trans84.699155.500000119.4
169A31.8Very low35.3Very low101 Ų101116.8 Ų116.884%0.83580%0.802SS**  30.3119.1121.200000119.1
170A29.8Very low35Very low98 Ų98114.7 Ų114.781%0.8180%0.803SS**  164146.2113.300000111.4
171A30.8Very low35.2Very low86 Ų86114.9 Ų114.971%0.71181%0.805SS**  trans69.7116.4147.400000120
172H31.1Very low35.6Very low177 Ų177117.8 Ų117.882%0.81981%0.805SS**  61114.1127.2-81.641.1000117.7
173Q33.7Very low35.8Very low166 Ų166119.9 Ų119.978%0.77681%0.809SS**  171.9126.194.6-80.1-141.724.600111.8
174V43.3Very low35.9Very low132 Ų132120.5 Ų120.580%0.881%0.807SS**  trans-54.8133.7153-94.10000110
175H37.4Very low36.1Very low167 Ų167121.1 Ų121.177%0.77381%0.806SS**  trans-152131141.9-126-86.3000113.2
176P55.8Low36.4Very low100 Ų100123.9 Ų123.965%0.64981%0.813SS**  trans-88.3154.3169.536.4-32.6000110.4
177L36.3Very low36.6Very low172 Ų172124.1 Ų124.190%0.90181%0.809SS**  trans-142.892.1163.4-100.5155.7000110.1
178L47.1Very low37.1Very low174 Ų174124.4 Ų124.491%0.91181%0.805SS**  trans-72140.5145.8-83.2151.4000108
179G31.9Very low37.3Very low78 Ų78126.6 Ų126.680%0.80481%0.809SS**  trans158.499.815500000117.6
180G33.2Very low37.8Very low83 Ų83130.2 Ų130.286%0.85681%0.813SS**  trans99.6146.7143.500000116.2
181A36.2Very low38.1Very low102 Ų102131.4 Ų131.484%0.84382%0.816SS**  cis-161.1157.4-1400000106.4
182L44.5Very low38.6Very low166 Ų166133.1 Ų133.187%0.86982%0.822SS**  trans-63142.5172.5-60.6155.3000110.6
183T37.3Very low39Very low134 Ų134129.5 Ų129.582%0.82282%0.823SS**  178.7109.1123.846.70000112.8
184S36.6Very low39.4Very low110 Ų110129.8 Ų129.877%0.76983%0.829SS**  42.9122.4125.7-51.90000123.9
185S38.1Very low39.5Very low111 Ų111129.7 Ų129.778%0.77683%0.831SS**  79.9117.6129.2-55.50000121.2
186T35.9Very low39.3Very low148 Ų148125.4 Ų125.491%0.90883%0.832SS**  -166.2156.7120.720.90000111.5
187S36.2Very low38.5Very low105 Ų105129.1 Ų129.173%0.73485%0.845SS**  trans-87.6155.8-155.1-50.50000116.4
188S41Very low38.8Very low107 Ų107127.5 Ų127.575%0.74884%0.843SS**  trans58.5123.2139.751.90000121.5
189T36Very low38.4Very low141 Ų141124.5 Ų124.587%0.86584%0.836SS**  -166.9127.7115.323.30000110.3
190L41.5Very low38.7Very low178 Ų178128.1 Ų128.193%0.93284%0.835SS**  trans-82.5126171.8-71.4156.5000108.3
191S35.4Very low38.8Very low123 Ų123135.1 Ų135.186%0.8684%0.836SS**  trans-127106.9165.4-76.90000110.3
192S41.9Very low39.2Very low122 Ų122133.8 Ų133.885%0.85383%0.825SS**  trans-66.4131.4166.336.50000112.2
193A39.2Very low39.4Very low101 Ų101131.9 Ų131.984%0.83582%0.823SS**  trans-149102.2158.300000110
194L43.6Very low39.9Very low172 Ų172133.5 Ų133.590%0.90182%0.821SS**  trans-111.3128.5164.5-86.8157.6000107
195P43.8Very low39.9Very low130 Ų130134.6 Ų134.684%0.84482%0.823SS**  trans-93.7116.7164.330.2-24.8000111.4
196G34Very low40.1Very low76 Ų76136.2 Ų136.278%0.78482%0.822SS**  81.699124.100000119.1
197L38.7Very low40.1Very low178 Ų178137.5 Ų137.593%0.93282%0.82SS**  trans-79.8128.4155-75.1162.5000109.8
198T42.5Very low40.5Very low138 Ų138142.3 Ų142.385%0.84783%0.827SS**  trans-120.9111.5153.252.50000109.5
199S38.4Very low40.1Very low112 Ų112140.5 Ų140.578%0.78383%0.825SS**  trans-74.4127.5162.6172.40000108.4
200I39.2Very low40.6Very low153 Ų153139.6 Ų139.679%0.78583%0.825SS**  trans-160.1111.8151.8-82.4126.4000109.1
201R35.4Very low40.7Very low231 Ų231137.1 Ų137.187%0.87282%0.82SS**  trans61.3122.1130.8-156.2160.5-170.4147.50.4121.6
202A44.3Very low40.8Very low74 Ų74135.8 Ų135.861%0.61282%0.816SS**  trans-69.3148.3160.300000112.5
203P49Very low40.7Very low125 Ų125134.7 Ų134.781%0.81281%0.814SS**  trans-112.4125.6152.132.7-22.4000111.4
204H46.5Very low41.1Very low169 Ų169135.3 Ų135.378%0.78281%0.81SS**  trans-80.6133.9154.7-48.7-95.2000107.6
205T36.8Very low41.2Very low132 Ų132132.5 Ų132.581%0.8180%0.802SS**  157.1114.3126.146.30000112.9
206L42.3Very low41.3Very low146 Ų146131.4 Ų131.476%0.76480%0.803SS**  5797.7118.5-130.8153.8000118.4
207M36.9Very low41.7Very low175 Ų175135.2 Ų135.286%0.86281%0.805SS**  trans-154.6150.9138.6-98.5-57.7108.600111.4
208K44.7Very low41.9Very low206 Ų206135.8 Ų135.890%0.89680%0.803SS**  trans-87.3136.9-158.3-179154.8175.9169.10112.1
209G33.1Very low42.1Very low68 Ų68137.7 Ų137.770%0.70181%0.807SS**  trans-174.6103.9169.100000111.4
210S45.3Very low42.3Very low122 Ų122135.5 Ų135.585%0.85380%0.802SS**  trans-66.8144.7164.7-64.20000109.5
211P43.1Very low43Very low127 Ų127134 Ų13483%0.82581%0.805SS**  -135.2167.6120.527.4-9.7000113.7
212A37.8Very low43.8Very low95 Ų95125.5 Ų125.579%0.78579%0.789SS**  trans-45.4145.3-164.400000118.2
213A40.9Very low44.1Very low99 Ų99130.5 Ų130.582%0.81880%0.797SS**PPolyproline II helixtrans-65.1134.1167.900000111.8
214P46.6Very low44.6Very low113 Ų113130.8 Ų130.873%0.73479%0.788SS**PPolyproline II helixtrans-83.8151.5157.732.7-28.1000110
215P45.5Very low45.2Very low114 Ų114126.8 Ų126.874%0.7477%0.769SS**PPolyproline II helixtrans-69.3140.8-17329.2-33.2000111L217P215-L217 PolarHBondContact O-N 3.48Å; P215-L217 VanDerWaalsContact O-N 3.12Å
216A45.4Very low45.9Very low106 Ų106132.5 Ų132.588%0.87678%0.776SS**  trans-62.4109.6170.600000109.7
217L43.1Very low46.7Very low157 Ų157130 Ų13082%0.82278%0.777SS**  trans-108.5134.6164.3-71.5179.8000110.3P215P215-L217 PolarHBondContact O-N 3.48Å; P215-L217 VanDerWaalsContact O-N 3.12Å
218Q42.3Very low48.1Very low189 Ų189123.7 Ų123.788%0.88376%0.757SS**  trans-56.1142.1-164.6-86.3151-7000115G220Q218-G220 PolarHBondContact O-N 2.96Å; Q218-G220 VanDerWaalsContact O-N 3.1Å
219L47.5Very low49.2Very low179 Ų179119.3 Ų119.394%0.93774%0.743SS**  trans-49.699.3169.3-170.868.5000112.5
220G42Very low50.8Low65 Ų65121.4 Ų121.467%0.6774%0.743SS**  trans-101.7124.3162.100000110.1Q218 G222Q218-G220 PolarHBondContact O-N 2.96Å; Q218-G220 VanDerWaalsContact O-N 3.1Å; G220-G222 PolarHBondContact O-N 3.18Å
221S54.2Low51.8Low123 Ų123117.3 Ų117.386%0.8671%0.714SS**  trans-73.490.1179.7-167.20000110.3
222G53.2Low52.8Low51 Ų51117 Ų11753%0.52671%0.713SS.*  trans-151.1134.9173.900000110.3G220 Q224G220-G222 PolarHBondContact O-N 3.18Å; G222-Q224 PolarHBondContact O-N 2.88Å; G222-Q224 VanDerWaalsContact O-N 3.09Å
223F50.9Low54.2Low180 Ų180114.4 Ų114.479%0.78969%0.688SS**  trans-74.599.2179.1-149.1-94.5000108.7H225F223-H225 PolarHBondContact O-N 2.96Å
224Q58Low55.1Low131 Ų131115.7 Ų115.761%0.61269%0.686SS**PPolyproline II helixtrans-72.4122.9176.4-65.4-82.257.800109G222G222-Q224 PolarHBondContact O-N 2.88Å; G222-Q224 VanDerWaalsContact O-N 3.09Å
225H59.3Low56.3Low85 Ų85118 Ų11839%0.39469%0.69SS.*PPolyproline II helixtrans-94.1168.7166.868.4-93.7000110.4F223 A227 G228 L229F223-H225 PolarHBondContact O-N 2.96Å; H225-A227 PolarHBondContact O-N 2.92Å; H225-G228 PolarHBondContact O-N 3Å; H225-G228 VanDerWaalsContact O-N 3.08Å; H225-L229 PolarHBondContact CE1-O 3.4Å
226W52.1Low57.3Low251 Ų251115.2 Ų115.295%0.95167%0.673SS**THydrogen-bonded Turntrans-46.8122.9-176.4-53.690.3000111.1
227A59.8Low58.1Low94 Ų94116.4 Ų116.478%0.77766%0.661SS**THydrogen-bonded Turntrans92.72.1-17600000118.4H225 L229H225-A227 PolarHBondContact O-N 2.92Å; A227-L229 VanDerWaalsContact C-N 3.26Å; A227-L229 PolarHBondContact O-N 2.82Å
228G65.4Low59.4Low43 Ų43114.1 Ų114.144%0.44365%0.653SS.*SBendtrans71.116.6166.100000115.6H225H225-G228 PolarHBondContact O-N 3Å; H225-G228 VanDerWaalsContact O-N 3.08Å
229L67.9Low60.1Low114 Ų114110 Ų11060%0.59764%0.643SS**PPolyproline II helixtrans-93.3143.8173.3-65.5170.1000110.5H225 A227 C231H225-L229 PolarHBondContact CE1-O 3.4Å; A227-L229 VanDerWaalsContact C-N 3.26Å; A227-L229 PolarHBondContact O-N 2.82Å; L229-C231 PolarHBondContact O-N 2.88Å
230P65.9Low60.7Low111 Ų111106.9 Ų106.972%0.72163%0.633SS**PPolyproline II helixtrans-65134.1-18025.6-32.7000111.4
231C66.6Low61.4Low36 Ų36109 Ų10924%0.24364%0.635CS.*PPolyproline II helixtrans-63.5129.2176.7-1710000110.2L229 C233 C236L229-C231 PolarHBondContact O-N 2.88Å; C231-C233 WeakPolarHBondContact CB-SG 3.42Å; C231-C233 PolarHBondContact O-N 2.67Å; C231-C233 VanDerWaalsContact O-N 3.15Å; C231-C233 WeakPolarHBondContact SG-CB 3.49Å; C231-C233 PolarHBondContact SG-N 3.47Å; C231-C233 VanDerWaalsContact SG-N 3.43Å; C231-C233 CovalentContact SG-SG 2.07Å; C231-C233 PolarHBondContact SG-SG 3.28Å; C231-C236 HydrophobicContact CB-CB 3.87Å
232P64.8Low61.6Low121 Ų121108.6 Ų108.679%0.78663%0.629SS**  trans-75.85.9175.132.3-36.1000113.2
233C67.7Low61.6Low40 Ų40114.6 Ų114.627%0.2764%0.644SS.*  trans-83.9131.6-176.4560000111.7C231 I235 C236 Q237C231-C233 WeakPolarHBondContact CB-SG 3.42Å; C231-C233 PolarHBondContact O-N 2.67Å; C231-C233 VanDerWaalsContact O-N 3.15Å; C231-C233 WeakPolarHBondContact SG-CB 3.49Å; C231-C233 PolarHBondContact SG-N 3.47Å; C231-C233 VanDerWaalsContact SG-N 3.43Å; C231-C233 CovalentContact SG-SG 2.07Å; C231-C233 PolarHBondContact SG-SG 3.28Å; C233-I235 PolarHBondContact O-N 3.26Å; C233-C236 PolarHBondContact O-N 3.03Å; C233-C236 WeakPolarHBondContact SG-CB 3.23Å; C233-C236 PolarHBondContact SG-SG 2.96Å; C233-Q237 PolarHBondContact O-N 2.91Å
234T59.8Low61.9Low127 Ų127113.3 Ų113.378%0.77964%0.643SS**THydrogen-bonded Turntrans-59.7-14.3176.845.10000114.2
235I70.1Confident61.6Low160 Ų160112.4 Ų112.482%0.82165%0.648SS**THydrogen-bonded Turntrans-80-30176.6-62161.1000111.7C233C233-I235 PolarHBondContact O-N 3.26Å
236C67.1Low61.2Low56 Ų56116.1 Ų116.138%0.37867%0.67SS.*THydrogen-bonded Turntrans-101-11.1-178.7-66.50000113.3C231 C233 V238C231-C236 HydrophobicContact CB-CB 3.87Å; C233-C236 PolarHBondContact O-N 3.03Å; C233-C236 WeakPolarHBondContact SG-CB 3.23Å; C233-C236 PolarHBondContact SG-SG 2.96Å; C236-V238 PolarHBondContact O-N 3.15Å
237Q62.7Low61Low132 Ų132109.9 Ų109.962%0.61766%0.659SS**  trans-84.2109.8179.1-156.6149.924.200109.9C233C233-Q237 PolarHBondContact O-N 2.91Å
238V70.6Confident60.6Low108 Ų108110.5 Ų110.566%0.65566%0.658SS**PPolyproline II helixtrans-71.9124.1172.8177.90000107.9C236C236-V238 PolarHBondContact O-N 3.15Å
239P57.5Low59.8Low104 Ų104114.7 Ų114.768%0.67568%0.675SS**PPolyproline II helixtrans-63.7139.9178.323.9-31.5000110.3
240P60.1Low58.6Low113 Ų113112.7 Ų112.773%0.73468%0.682SS**PPolyproline II helixtrans-62.8140.4178.825.7-32.8000110.2
241P55.1Low57.6Low109 Ų109116.1 Ų116.171%0.70869%0.693SS**PPolyproline II helixtrans-65144178.426.3-32.7000110.6H243P241-H243 PolarHBondContact O-N 3.15Å
242P58.9Low56.7Low114 Ų114120.5 Ų120.574%0.7472%0.719SS**PPolyproline II helixtrans-64.4130.1177.726.3-32.9000110.2I244P242-I244 PolarHBondContact O-N 2.97Å
243H53Low55.9Low178 Ų178125 Ų12582%0.82472%0.721SS**  trans-68.3111.2175.25.6-84.8000108.9P241P241-H243 PolarHBondContact O-N 3.15Å
244I56.8Low54.7Low153 Ų153131 Ų13179%0.78575%0.749SS**  trans-87.4117.1167.6-7.4173.8000106.7P242 I246P242-I244 PolarHBondContact O-N 2.97Å; I244-I246 PolarHBondContact O-N 3.07Å
245P51.5Low54Low111 Ų111130.3 Ų130.372%0.72175%0.745SS**  trans-68.6121.117526.6-30.6000109.2T247P245-T247 PolarHBondContact O-N 2.92Å
246I51.3Low52.6Low163 Ų163126.4 Ų126.484%0.83674%0.743SS**  trans-80.897.5172.6-52.1172.5000106.6I244 S248I244-I246 PolarHBondContact O-N 3.07Å; I246-S248 PolarHBondContact O-N 3.17Å
247T47.8Very low51.4Low120 Ų120133.4 Ų133.474%0.73677%0.771SS**  trans-77101.4169.7-270000108.1P245 T249P245-T247 PolarHBondContact O-N 2.92Å; T247-T249 PolarHBondContact O-N 2.8Å
248S52.8Low50.4Low108 Ų108130.6 Ų130.676%0.75578%0.777SS**  trans-84.699.216968.10000109.6I246I246-S248 PolarHBondContact O-N 3.17Å
249T46.8Very low49.1Very low131 Ų131135 Ų13580%0.80479%0.788SS**  trans-145.2111.6165.729.70000110.5T247T247-T249 PolarHBondContact O-N 2.8Å
250G42.8Very low48.5Very low71 Ų71137.6 Ų137.673%0.73280%0.796SS**  trans97.781.3143.400000118.1T252G250-T252 PolarHBondContact O-N 2.57Å
251L46.4Very low47.6Very low184 Ų184135.5 Ų135.596%0.96380%0.795SS**  trans-7994.8148-77.3170.3000108.1R253L251-R253 PolarHBondContact O-N 3.35Å
252T47.1Very low47.4Very low128 Ų128138.4 Ų138.479%0.78580%0.803SS**  trans-88.3103.9164.235.80000109.7G250 L254G250-T252 PolarHBondContact O-N 2.57Å; T252-L254 PolarHBondContact O-N 3.48Å
253R47.8Very low46.8Very low216 Ų216145.9 Ų145.982%0.81582%0.824SS**  trans-56.3116.6162.2-176.5-175.3-175.4-147.12.1109.3L251L251-R253 PolarHBondContact O-N 3.35Å
254L42.2Very low46.5Very low166 Ų166144.3 Ų144.387%0.86982%0.824SS**  trans-109.9101.3163.5-69.8178.1000108.8T252T252-L254 PolarHBondContact O-N 3.48Å
255T45.2Very low46Very low112 Ų112143.8 Ų143.869%0.68783%0.826SS**  trans-72.7132.1154.739.50000108.6
256G41.8Very low45.7Very low77 Ų77145.7 Ų145.779%0.79483%0.832SS**  trans-168.4101.9173.200000110.3
257E41Very low45.3Very low203 Ų203144.6 Ų144.695%0.94983%0.832SS**  trans-66.8159.8174.6-56.4-153.6132.100112.7
258G41.1Very low45.2Very low73 Ų73146.2 Ų146.275%0.75384%0.838SS**  trans149.599.5152.300000117
259K44.2Very low44.7Very low201 Ų201148.7 Ų148.787%0.87484%0.844SS**  102.5113.8120-153164.5-177.3173.80118.2
260D44.6Very low44.5Very low159 Ų159150 Ų15085%0.8585%0.846SS**  trans-44.4154.9161.5-49.9-85.6000114.7
261G41.9Very low44.6Very low69 Ų69156.1 Ų156.171%0.71186%0.855SS**  trans141.895.5149.900000116.5
262L51Low44.5Very low169 Ų169153.8 Ų153.889%0.88585%0.846SS**  58.3103.4123.9-15479.3000118.5
263K46.2Very low44.3Very low272 Ų272156.1 Ų156.1100%1.18385%0.852SS**  -178.5099.4-132.6165.6-178.1175.80111.3

Retrieved 263 of 263 residues in 84.7 ms (Link to these results)