A0A087XJ42_POEFO Loading...

Mitochondrial fission regulator

May play a role in mitochondrial aerobic respiration. May also regulate mitochondrial organization and fission. Plays a role in mitochondrial aerobic respiration. Regulates mitochondrial organization and fission.

AlphaFold DB , UniProt , Accession A0A087XJ42, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 327 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
1M36.8Very low42.5Very low243 Ų243165.9 Ų165.9100%1.19784%0.841SS**  090.70-73.1-163157.600108.3
2S36.4Very low43.1Very low120 Ų120160.1 Ų160.184%0.83981%0.813SS**  trans-102.5114.2-176.6-54.70000108.1E4S2-E4 PolarHBondContact O-N 3.24Å
3K46.7Very low43.1Very low199 Ų199154.5 Ų154.587%0.86581%0.807SS**  trans-77114.3176.6-78.5175.6177.1174.20108.4H5K3-H5 PolarHBondContact O-N 3.21Å
4E44.4Very low43.6Very low191 Ų191152.4 Ų152.489%0.89379%0.788SS**  trans-63.9126.4173.4-63.8-173.1159.700110.1S2 A6S2-E4 PolarHBondContact O-N 3.24Å; E4-A6 PolarHBondContact O-N 2.76Å
5H42.8Very low43.7Very low187 Ų187147.4 Ų147.487%0.86679%0.789SS**  trans-76.6101.6168.6-71.4-81.6000108.2K3 K7K3-H5 PolarHBondContact O-N 3.21Å; H5-K7 PolarHBondContact O-N 2.96Å
6A46Very low44.2Very low92 Ų92146.4 Ų146.476%0.7680%0.797SS**  trans-59.5109.6170.800000109.4E4 I8E4-A6 PolarHBondContact O-N 2.76Å; A6-I8 PolarHBondContact O-N 3.5Å; A6-I8 VanDerWaalsContact O-N 3.16Å
7K42.7Very low44.8Very low202 Ų202141.5 Ų141.588%0.87879%0.788SS**  trans-65.3108.8172.2-166.2179-176.6-1760107.2H5 E9H5-K7 PolarHBondContact O-N 2.96Å; K7-E9 VanDerWaalsContact C-N 3.27Å; K7-E9 PolarHBondContact O-N 3.3Å
8I45.9Very low45.3Very low155 Ų155144.7 Ų144.780%0.79579%0.792SS**  trans-7090.5176.1-62.1162.1000107.3A6 M10A6-I8 PolarHBondContact O-N 3.5Å; A6-I8 VanDerWaalsContact O-N 3.16Å; I8-M10 HydrophobicContact CG2-CG 4.34Å; I8-M10 PolarHBondContact O-N 3.37Å
9E43.2Very low45.5Very low171 Ų171143.9 Ų143.980%0.79980%0.795SS**  trans-69104166.4-173.4166-16300107.2K7 D11K7-E9 VanDerWaalsContact C-N 3.27Å; K7-E9 PolarHBondContact O-N 3.3Å; E9-D11 PolarHBondContact O-N 3.28Å
10M43.2Very low46Very low126 Ų126144.9 Ų144.962%0.62179%0.787SS**  trans-7681.4173.1-64.4-151.6-36.400109I8 L12I8-M10 HydrophobicContact CG2-CG 4.34Å; I8-M10 PolarHBondContact O-N 3.37Å; M10-L12 HydrophobicContact CB-CD1 4.45Å; M10-L12 HydrophobicContact CE-CD1 4.19Å; M10-L12 PolarHBondContact O-N 3.44Å; M10-L12 VanDerWaalsContact O-N 3.12Å
11D39.9Very low46.4Very low139 Ų139139.3 Ų139.374%0.74376%0.763SS**  trans-76.794.1169.3-157.215000108.3E9 A13E9-D11 PolarHBondContact O-N 3.28Å; D11-A13 VanDerWaalsContact C-N 3.26Å; D11-A13 PolarHBondContact O-N 2.95Å
12L49.3Very low47.1Very low96 Ų96130.6 Ų130.650%0.50373%0.726SS.*  trans-73.782171.2-80111.2000108.4M10 F14M10-L12 HydrophobicContact CB-CD1 4.45Å; M10-L12 HydrophobicContact CE-CD1 4.19Å; M10-L12 PolarHBondContact O-N 3.44Å; M10-L12 VanDerWaalsContact O-N 3.12Å; L12-F14 HydrophobicContact CB-CE1 4.28Å; L12-F14 HydrophobicContact CB-CZ 4.45Å; L12-F14 WeakPolarHBondContact O-CE1 3.48Å; L12-F14 VanDerWaalsContact O-CE2 3.25Å; L12-F14 WeakPolarHBondContact O-CE2 3.45Å; L12-F14 WeakPolarHBondContact O-CZ 3.42Å
13A42.6Very low48.2Very low88 Ų88129.7 Ų129.773%0.72772%0.72SS**PPolyproline II helixtrans-77.6129.3170.800000110.7D11D11-A13 VanDerWaalsContact C-N 3.26Å; D11-A13 PolarHBondContact O-N 2.95Å
14F51Low49.4Very low125 Ų125125 Ų12555%0.54870%0.697SS.*PPolyproline II helixtrans-81.4134.7-161.8-59-64.1000114.1L12 S22L12-F14 HydrophobicContact CB-CE1 4.28Å; L12-F14 HydrophobicContact CB-CZ 4.45Å; L12-F14 WeakPolarHBondContact O-CE1 3.48Å; L12-F14 VanDerWaalsContact O-CE2 3.25Å; L12-F14 WeakPolarHBondContact O-CE2 3.45Å; L12-F14 WeakPolarHBondContact O-CZ 3.42Å; F14-S22 VanDerWaalsContact CD1-N 3.27Å; F14-S22 WeakPolarHBondContact CE1-OG 3.5Å; F14-S22 VanDerWaalsContact CZ-N 3.32Å
15G44.2Very low51.4Low77 Ų77118.8 Ų118.879%0.79468%0.675SS**PPolyproline II helixtrans-61135.5167.200000112G17G15-G17 PolarHBondContact O-N 3.48Å
16S52.3Low53.4Low131 Ų131112.9 Ų112.992%0.91665%0.649SS**SBendtrans-68.3110.5-179.954.80000112.1
17G53.4Low55.4Low63 Ų63113.7 Ų113.765%0.64964%0.644SS**SBendtrans177.468.3173.700000112.6G15G15-G17 PolarHBondContact O-N 3.48Å
18K54.5Low57.5Low200 Ų200111.8 Ų111.887%0.8763%0.632SS**SBendtrans73.1147-175.4-63.5121.8178.1-179.70115.5Y20K18-Y20 VanDerWaalsContact C-N 3.34Å; K18-Y20 PolarHBondContact O-N 3.2Å
19P49Very low59.4Low129 Ų129108.1 Ų108.184%0.83861%0.608SS**SBendtrans-89.358.6-154.538.6-37.5000112.6
20Y56Low61.5Low164 Ų164101.2 Ų101.264%0.64358%0.576SS**  trans-129.295.7167.7-119.4-86.5000107.7K18 R24K18-Y20 VanDerWaalsContact C-N 3.34Å; K18-Y20 PolarHBondContact O-N 3.2Å; Y20-R24 HydrophobicContact CD1-CG 4.35Å
21G54.1Low63.5Low27 Ų2797.9 Ų97.928%0.27857%0.569SS.*  trans-66.6-158.9-17800000114.3S23G21-S23 PolarHBondContact O-N 3.36Å
22S51.6Low65.5Low60 Ų6095.3 Ų95.342%0.4256%0.561SS.*THydrogen-bonded Turntrans-48.5-14.9-171.8-124.10000115.8F14 R24F14-S22 VanDerWaalsContact CD1-N 3.27Å; F14-S22 WeakPolarHBondContact CE1-OG 3.5Å; F14-S22 VanDerWaalsContact CZ-N 3.32Å; S22-R24 PolarHBondContact O-N 3.41Å
23S59.1Low67.1Low102 Ų10293.1 Ų93.171%0.71355%0.554SS**THydrogen-bonded Turntrans-67.4-4-172.6-41.30000113.9G21G21-S23 PolarHBondContact O-N 3.36Å
24R71.9Confident69.1Low99 Ų9992 Ų9237%0.37454%0.536SS..SBendtrans-83128.9174.4-66-171.2-178.5-121.9-5.3110Y20 S22 R28 R29Y20-R24 HydrophobicContact CD1-CG 4.35Å; S22-R24 PolarHBondContact O-N 3.41Å; R24-R28 HydrophobicContact CB-CB 4.07Å; R24-R29 HydrophobicContact CB-CG 4.18Å
25S85.8Confident70.7Confident62 Ų6292.6 Ų92.643%0.43455%0.552SS.*  trans-55.4151.3168.361.20000110.4V27 R28 R29S25-V27 PolarHBondContact O-N 3.24Å; S25-V27 VanDerWaalsContact O-N 3.14Å; S25-R28 WeakPolarHBondContact O-CA 3.3Å; S25-R28 WeakPolarHBondContact O-CB 3.41Å; S25-R28 PolarHBondContact O-N 2.81Å; S25-R28 PolarHBondContact OG-N 3.22Å; S25-R29 PolarHBondContact O-N 3.38Å
26L85.8Confident72.6Confident62 Ų6294.7 Ų94.733%0.32554%0.544SS..Hα-helixtrans-50.5-40.3176.5-178.569.8000111.8R28 R29 I30 L270 A274L26-R28 PolarHBondContact O-N 2.83Å; L26-R29 WeakPolarHBondContact O-CB 3.35Å; L26-R29 PolarHBondContact O-N 2.92Å; L26-I30 HydrophobicContact CD1-CD1 4.37Å; L26-I30 HydrophobicContact CD2-CD1 4.41Å; L26-I30 HydrophobicContact CG-CD1 3.89Å; L26-I30 WeakPolarHBondContact O-CG1 3.39Å; L26-I30 PolarHBondContact O-N 3.44Å; L26-L270 HydrophobicContact CD1-CB 4.3Å; L26-A274 HydrophobicContact CD2-CB 3.26Å
27V88.7Confident74.1Confident110 Ų11097.5 Ų97.567%0.66754%0.539SS*.Hα-helixtrans-59.6-42.9175.7-179.40000111.8S25 R29 A31S25-V27 PolarHBondContact O-N 3.24Å; S25-V27 VanDerWaalsContact O-N 3.14Å; V27-R29 VanDerWaalsContact C-N 3.35Å; V27-A31 VanDerWaalsContact O-CB 3.25Å; V27-A31 WeakPolarHBondContact O-CB 3.29Å; V27-A31 PolarHBondContact O-N 2.94Å
28R86.1Confident75.4Confident161 Ų161100.4 Ų100.461%0.60855%0.547SS*.Hα-helixtrans-68.2-33.8176.7-80.7-179.3174.2152.10.4112.4R24 S25 L26 S32R24-R28 HydrophobicContact CB-CB 4.07Å; S25-R28 WeakPolarHBondContact O-CA 3.3Å; S25-R28 WeakPolarHBondContact O-CB 3.41Å; S25-R28 PolarHBondContact O-N 2.81Å; S25-R28 PolarHBondContact OG-N 3.22Å; L26-R28 PolarHBondContact O-N 2.83Å; R28-S32 PolarHBondContact O-N 3.45Å; R28-S32 VanDerWaalsContact O-N 3.15Å; R28-S32 PolarHBondContact O-OG 3.47Å
29R84.8Confident76.6Confident78 Ų7896.3 Ų96.329%0.29454%0.542SS..Hα-helixtrans-65.3-50.2174-82.4169.951.9-158.7-9.9111.2R24 S25 L26 V27 A31 S32 S33 E263R24-R29 HydrophobicContact CB-CG 4.18Å; S25-R29 PolarHBondContact O-N 3.38Å; L26-R29 WeakPolarHBondContact O-CB 3.35Å; L26-R29 PolarHBondContact O-N 2.92Å; V27-R29 VanDerWaalsContact C-N 3.35Å; R29-A31 PolarHBondContact O-N 3.49Å; R29-S32 PolarHBondContact O-N 3.08Å; R29-S32 PolarHBondContact O-OG 2.89Å; R29-S33 PolarHBondContact O-N 2.93Å; R29-E263 IonicContact CZ-OE1 3.11Å; R29-E263 IonicContact CZ-OE2 3.83Å; R29-E263 IonicContact NE-OE1 3.04Å; R29-E263 PolarHBondContact NE-OE1 3.39Å; R29-E263 IonicContact NH2-OE1 2.61Å; R29-E263 PolarHBondContact NH2-OE1 3.04Å; R29-E263 IonicContact NH2-OE2 3.37Å; R29-E263 PolarHBondContact NH2-OE2 3.2Å
30I87.9Confident78.3Confident26 Ų2696.3 Ų96.313%0.13354%0.542CS..Hα-helixtrans-58.6-49.7175.3-67163.7000110.2L26 S32 S33 L34 P267 L270 I271L26-I30 HydrophobicContact CD1-CD1 4.37Å; L26-I30 HydrophobicContact CD2-CD1 4.41Å; L26-I30 HydrophobicContact CG-CD1 3.89Å; L26-I30 WeakPolarHBondContact O-CG1 3.39Å; L26-I30 PolarHBondContact O-N 3.44Å; I30-S32 PolarHBondContact O-N 3.3Å; I30-S32 VanDerWaalsContact O-N 3.14Å; I30-S33 PolarHBondContact O-N 3.46Å; I30-S33 PolarHBondContact O-OG 3.22Å; I30-L34 WeakPolarHBondContact O-CG 3.22Å; I30-L34 PolarHBondContact O-N 3.29Å; I30-P267 HydrophobicContact CG2-CB 3.88Å; I30-L270 HydrophobicContact CD1-CB 4.4Å; I30-L270 HydrophobicContact CG1-CB 4.01Å; I30-L270 HydrophobicContact CG1-CD1 3.93Å; I30-I271 HydrophobicContact CD1-CD1 4.29Å; I30-I271 HydrophobicContact CD1-CG1 3.58Å
31A85.2Confident79.7Confident56 Ų5698.3 Ų98.346%0.46355%0.549SS..Hα-helixtrans-60-29.3-178.900000113.4V27 R29V27-A31 VanDerWaalsContact O-CB 3.25Å; V27-A31 WeakPolarHBondContact O-CB 3.29Å; V27-A31 PolarHBondContact O-N 2.94Å; R29-A31 PolarHBondContact O-N 3.49Å
32S82.2Confident81.3Confident85 Ų85102.1 Ų102.159%0.59457%0.566SS**Hα-helixtrans-77.6-18.7177.1570000114.9R28 R29 I30R28-S32 PolarHBondContact O-N 3.45Å; R28-S32 VanDerWaalsContact O-N 3.15Å; R28-S32 PolarHBondContact O-OG 3.47Å; R29-S32 PolarHBondContact O-N 3.08Å; R29-S32 PolarHBondContact O-OG 2.89Å; I30-S32 PolarHBondContact O-N 3.3Å; I30-S32 VanDerWaalsContact O-N 3.14Å
33S83Confident82.8Confident51 Ų51107.1 Ų107.136%0.35758%0.583SS.*Hα-helixtrans-93.6-6.917559.90000113.3R29 I30R29-S33 PolarHBondContact O-N 2.93Å; I30-S33 PolarHBondContact O-N 3.46Å; I30-S33 PolarHBondContact O-OG 3.22Å
34L83.8Confident84Confident65 Ų65110 Ų11034%0.3458%0.583SS.*SBendtrans-74.7143.2176-63175.7000111.1I30 I36 P267I30-L34 WeakPolarHBondContact O-CG 3.22Å; I30-L34 PolarHBondContact O-N 3.29Å; L34-I36 HydrophobicContact CB-CD1 3.67Å; L34-I36 HydrophobicContact CB-CG1 3.81Å; L34-I36 HydrophobicContact CD1-CD1 3.66Å; L34-I36 HydrophobicContact CG-CD1 4.29Å; L34-I36 PolarHBondContact O-N 3.17Å; L34-P267 HydrophobicContact CD2-CB 4.24Å; L34-P267 HydrophobicContact CD2-CG 4.12Å
35P84.4Confident84.5Confident136 Ų136112.2 Ų112.288%0.88360%0.597SS**SBendtrans-76.353.617734.1-37.2000111.5
36I84.4Confident84.1Confident121 Ų121116.7 Ų116.762%0.62162%0.615SS**  trans-114133.7-177.1-53.2170.5000108.4L34L34-I36 HydrophobicContact CB-CD1 3.67Å; L34-I36 HydrophobicContact CB-CG1 3.81Å; L34-I36 HydrophobicContact CD1-CD1 3.66Å; L34-I36 HydrophobicContact CG-CD1 4.29Å; L34-I36 PolarHBondContact O-N 3.17Å
37K83.9Confident83.7Confident190 Ų190121.6 Ų121.683%0.82663%0.631SS**PPolyproline II helixtrans-68.5132.1175.4-67179.3-178.7174.20109.3C39K37-C39 PolarHBondContact O-N 2.92Å
38P81.3Confident83Confident124 Ų124121.2 Ų121.281%0.80563%0.63SS**PPolyproline II helixtrans-62.4132.217525.7-32.5000109.5
39C80.1Confident81.8Confident115 Ų115123.2 Ų123.278%0.77764%0.639SS**PPolyproline II helixtrans-64.7139176.4-56.10000109.8K37 R41K37-C39 PolarHBondContact O-N 2.92Å; C39-R41 PolarHBondContact O-N 3.45Å
40P85.1Confident80.8Confident129 Ų129123.1 Ų123.184%0.83865%0.648SS**  trans-60.5115.5177.523.4-31.1000109.3
41R84.9Confident79.5Confident206 Ų206129.8 Ų129.878%0.77768%0.678SS**PPolyproline II helixtrans-81.3122.8174.1-163.4170.1-173.6173.5-1107.6C39 H43C39-R41 PolarHBondContact O-N 3.45Å; R41-H43 PolarHBondContact O-CE1 3.18Å; R41-H43 PolarHBondContact O-N 3.27Å; R41-H43 PolarHBondContact O-ND1 3.18Å
42V86.5Confident78.2Confident107 Ų107134.8 Ų134.865%0.64869%0.692SS**PPolyproline II helixtrans-64120.4169.3-70.70000108.1F44V42-F44 HydrophobicContact CB-CE2 4.44Å; V42-F44 HydrophobicContact CB-CZ 4.3Å; V42-F44 HydrophobicContact CG2-CE2 3.76Å; V42-F44 HydrophobicContact CG2-CZ 3.77Å
43H83.9Confident76.8Confident165 Ų165132.2 Ų132.276%0.76468%0.676SS**PPolyproline II helixtrans-99.3117.9173.3-6283.9000106.4R41R41-H43 PolarHBondContact O-CE1 3.18Å; R41-H43 PolarHBondContact O-N 3.27Å; R41-H43 PolarHBondContact O-ND1 3.18Å
44F84.1Confident75.5Confident163 Ų163132 Ų13272%0.71568%0.682SS**PPolyproline II helixtrans-85.3124.5171.6-59.2-77.8000107.7V42 L46V42-F44 HydrophobicContact CB-CE2 4.44Å; V42-F44 HydrophobicContact CB-CZ 4.3Å; V42-F44 HydrophobicContact CG2-CE2 3.76Å; V42-F44 HydrophobicContact CG2-CZ 3.77Å; F44-L46 PolarHBondContact O-N 3.21Å
45Q82.9Confident74.2Confident144 Ų144133.9 Ų133.967%0.67370%0.696SS**  trans-71.398.8168-171.5173.713.200107.3Y47Q45-Y47 HydrophobicContact CB-CE2 4.25Å; Q45-Y47 HydrophobicContact CG-CD2 4.17Å; Q45-Y47 HydrophobicContact CG-CE2 3.8Å; Q45-Y47 PolarHBondContact NE2-OH 3.48Å; Q45-Y47 PolarHBondContact O-N 3.16Å; Q45-Y47 VanDerWaalsContact O-N 3.14Å; Q45-Y47 PolarHBondContact OE1-OH 3.47Å; Q45-Y47 VanDerWaalsContact OE1-OH 3.08Å
46L77.2Confident72.8Confident156 Ų156133.8 Ų133.882%0.81769%0.687SS**  trans-74102.3169.3-63.7177.6000106.8F44F44-L46 PolarHBondContact O-N 3.21Å
47Y77.9Confident71.4Confident166 Ų166132.2 Ų132.265%0.65168%0.679SS**  trans-66.2127.8168.9-78.4-90.7000107.8Q45 Y49Q45-Y47 HydrophobicContact CB-CE2 4.25Å; Q45-Y47 HydrophobicContact CG-CD2 4.17Å; Q45-Y47 HydrophobicContact CG-CE2 3.8Å; Q45-Y47 PolarHBondContact NE2-OH 3.48Å; Q45-Y47 PolarHBondContact O-N 3.16Å; Q45-Y47 VanDerWaalsContact O-N 3.14Å; Q45-Y47 PolarHBondContact OE1-OH 3.47Å; Q45-Y47 VanDerWaalsContact OE1-OH 3.08Å; Y47-Y49 PolarHBondContact O-N 2.96Å; Y47-Y49 VanDerWaalsContact O-N 3.15Å
48P74.1Confident69.9Low101 Ų101132.9 Ų132.966%0.65668%0.677SS**  trans-55.4125.7168.623.2-30.4000107.3T50P48-T50 PolarHBondContact O-N 2.89Å
49Y60.5Low68.5Low203 Ų203130.4 Ų130.480%0.79667%0.667SS**  trans-66.490.5174.8-178.4-94.3000107.7Y47 E51Y47-Y49 PolarHBondContact O-N 2.96Å; Y47-Y49 VanDerWaalsContact O-N 3.15Å; Y49-E51 HydrophobicContact CE1-CG 3.96Å
50T64.3Low67Low76 Ų76133.4 Ų133.447%0.46667%0.666SS.*  trans-88.2126.8161.354.30000106.1P48 E52 A53P48-T50 PolarHBondContact O-N 2.89Å; T50-E52 PolarHBondContact O-N 3.46Å; T50-A53 WeakPolarHBondContact O-CB 3.36Å; T50-A53 PolarHBondContact O-N 3.22Å
51E60.4Low65.4Low167 Ų167134.8 Ų134.878%0.7866%0.655SS**THydrogen-bonded Turntrans-51.1-26-179.3-76174.7148.800112.8Y49Y49-E51 HydrophobicContact CE1-CG 3.96Å
52E56.6Low63.8Low160 Ų160133.4 Ų133.475%0.74866%0.658SS**THydrogen-bonded Turntrans-72.5-23.8177.2-60.5179.8175.500114.5T50 G54 V55T50-E52 PolarHBondContact O-N 3.46Å; E52-G54 VanDerWaalsContact C-N 3.27Å; E52-G54 PolarHBondContact O-N 3.48Å; E52-V55 WeakPolarHBondContact O-CB 3.38Å; E52-V55 PolarHBondContact O-N 2.84Å
53A54.4Low62.3Low32 Ų32133.8 Ų133.826%0.26466%0.66SS.*Hα-helixtrans-71.2-22.8-179.300000112.6T50 V55 I57T50-A53 WeakPolarHBondContact O-CB 3.36Å; T50-A53 PolarHBondContact O-N 3.22Å; A53-V55 PolarHBondContact O-N 3.39Å; A53-I57 WeakPolarHBondContact O-CD1 3.45Å; A53-I57 VanDerWaalsContact O-CG1 3.23Å; A53-I57 WeakPolarHBondContact O-CG1 3.23Å; A53-I57 PolarHBondContact O-N 3.16Å
54G55.6Low60.7Low47 Ų47131.6 Ų131.649%0.48565%0.654SS.*Hα-helixtrans-62.4-27.6172.300000113E52 R58E52-G54 VanDerWaalsContact C-N 3.27Å; E52-G54 PolarHBondContact O-N 3.48Å; G54-R58 PolarHBondContact O-N 3.19Å
55V56.3Low59.3Low104 Ų104130.5 Ų130.563%0.6366%0.663SS**Hα-helixtrans-79.2-42.1-178-174.40000111.2E52 A53 R58 A59E52-V55 WeakPolarHBondContact O-CB 3.38Å; E52-V55 PolarHBondContact O-N 2.84Å; A53-V55 PolarHBondContact O-N 3.39Å; V55-R58 WeakPolarHBondContact O-CB 3.4Å; V55-R58 PolarHBondContact O-N 3.44Å; V55-A59 PolarHBondContact O-N 3.32Å
56L54.2Low57.7Low133 Ų133129.3 Ų129.370%0.69667%0.666SS**Hα-helixtrans-72.7-33.5179.3-67.6174.9000112.8R58 A59 K60L56-R58 VanDerWaalsContact C-N 3.27Å; L56-R58 PolarHBondContact O-N 2.9Å; L56-A59 PolarHBondContact O-N 3.41Å; L56-K60 PolarHBondContact O-N 2.88Å
57I55.8Low56.6Low88 Ų88126.1 Ų126.145%0.45166%0.662SS.*Hα-helixtrans-69.2-29.2175.4-63.1166.8000110.7A53 R61A53-I57 WeakPolarHBondContact O-CD1 3.45Å; A53-I57 VanDerWaalsContact O-CG1 3.23Å; A53-I57 WeakPolarHBondContact O-CG1 3.23Å; A53-I57 PolarHBondContact O-N 3.16Å; I57-R61 VanDerWaalsContact O-CG 3.23Å; I57-R61 WeakPolarHBondContact O-CG 3.47Å; I57-R61 PolarHBondContact O-N 2.96Å
58R51.1Low55.7Low204 Ų204120.4 Ų120.477%0.7765%0.646SS**Hα-helixtrans-69.3-40.2173.9-163177.5-157.3173.65.5112.3G54 V55 L56 R61G54-R58 PolarHBondContact O-N 3.19Å; V55-R58 WeakPolarHBondContact O-CB 3.4Å; V55-R58 PolarHBondContact O-N 3.44Å; L56-R58 VanDerWaalsContact C-N 3.27Å; L56-R58 PolarHBondContact O-N 2.9Å; R58-R61 PolarHBondContact O-N 3.45Å
59A52.8Low54.9Low72 Ų72123.6 Ų123.660%0.59566%0.656SS**Hα-helixtrans-67.9-35.1179.800000112.9V55 L56V55-A59 PolarHBondContact O-N 3.32Å; L56-A59 PolarHBondContact O-N 3.41Å
60K49.1Very low54.9Low178 Ų178118 Ų11877%0.77465%0.652SS**Hα-helixtrans-81.9-10.5-179.4-148.7179.7-177.1-179.70114.3L56L56-K60 PolarHBondContact O-N 2.88Å
61R51.3Low54.5Low158 Ų158119.7 Ų119.760%0.59666%0.659SS**G310 helixtrans-90.71.1-178.6-80-178.3-174.8-1694.2114.6I57 R58 T63I57-R61 VanDerWaalsContact O-CG 3.23Å; I57-R61 WeakPolarHBondContact O-CG 3.47Å; I57-R61 PolarHBondContact O-N 2.96Å; R58-R61 PolarHBondContact O-N 3.45Å; R61-T63 PolarHBondContact O-N 2.91Å
62Q51.8Low54.3Low178 Ų178116.5 Ų116.583%0.83265%0.65SS**G310 helixtrans-73.5-6.3176.7-69-158.6-5.400114.2
63T54.4Low54.2Low114 Ų114112.8 Ų112.870%0.69965%0.647SS**G310 helixtrans-112.58-174.565.60000115.4R61R61-T63 PolarHBondContact O-N 2.91Å
64N49.6Very low53.9Low120 Ų120122.9 Ų122.964%0.64268%0.678SS**  trans-148.6117.5173.5-81.9-30.6000110V66N64-V66 HydrophobicContact CB-CG2 4.47Å; N64-V66 PolarHBondContact O-N 2.94Å
65P54.4Low53.5Low139 Ų139128.6 Ų128.690%0.90370%0.696SS**  trans-77.377.3175.432.8-32.8000109.3
66V49.6Very low53.1Low120 Ų120132.5 Ų132.573%0.72771%0.707SS**  trans-92.7111.3163.7-1790000106.1N64 S68N64-V66 HydrophobicContact CB-CG2 4.47Å; N64-V66 PolarHBondContact O-N 2.94Å; V66-S68 PolarHBondContact O-N 3.28Å
67A53.5Low52.8Low89 Ų89129.3 Ų129.374%0.73671%0.707SS**  trans-50.9114176.300000109.4
68S60Low52.2Low45 Ų45132.4 Ų132.432%0.31572%0.724SS.*  trans-80.6149.6177.6-178.10000108V66 A70 D71V66-S68 PolarHBondContact O-N 3.28Å; S68-A70 PolarHBondContact O-N 3.33Å; S68-D71 PolarHBondContact N-OD2 3.35Å; S68-D71 WeakPolarHBondContact O-CB 3.42Å; S68-D71 PolarHBondContact O-N 3.44Å
69L58.2Low52.1Low168 Ų168131.6 Ų131.688%0.8873%0.729SS**THydrogen-bonded Turntrans-58.8-9.9174.3-79.6166.6000113.8D71L69-D71 VanDerWaalsContact C-N 3.34Å
70A59.3Low51.5Low86 Ų86136.6 Ų136.671%0.71174%0.74SS**THydrogen-bonded Turntrans-79-1417100000113.8S68S68-A70 PolarHBondContact O-N 3.33Å
71D56.4Low51Low112 Ų112135.3 Ų135.360%0.59974%0.742SS**  trans-93.62.1-177.3-54.9-34.4000112.6S68 L69 A73S68-D71 PolarHBondContact N-OD2 3.35Å; S68-D71 WeakPolarHBondContact O-CB 3.42Å; S68-D71 PolarHBondContact O-N 3.44Å; L69-D71 VanDerWaalsContact C-N 3.34Å; D71-A73 VanDerWaalsContact C-N 3.29Å; D71-A73 PolarHBondContact O-N 3.2Å
72V56.6Low50.5Low99 Ų99135.5 Ų135.560%0.676%0.755SS**  trans-7887.3166.9-175.10000107W74V72-W74 PolarHBondContact O-N 2.93Å
73A52.8Low49.9Very low82 Ų82135.3 Ų135.368%0.67875%0.754SS**  trans-52.7122.8162.900000107.5D71 I75D71-A73 VanDerWaalsContact C-N 3.29Å; D71-A73 PolarHBondContact O-N 3.2Å; A73-I75 PolarHBondContact O-N 2.96Å
74W49.1Very low48.9Very low245 Ų245132.8 Ų132.893%0.92875%0.75SS**  trans-55.2124.8175.9-70.569.8000107.6V72 E76V72-W74 PolarHBondContact O-N 2.93Å; W74-E76 PolarHBondContact O-N 3Å
75I46.1Very low48.4Very low167 Ų167138.1 Ų138.186%0.85676%0.763SS**  trans-60.2115.7174.3-62172.5000106A73 G77A73-I75 PolarHBondContact O-N 2.96Å; I75-G77 PolarHBondContact O-N 3.01Å; I75-G77 VanDerWaalsContact O-N 3.1Å
76E49Very low47.5Very low185 Ų185141 Ų14186%0.86476%0.762SS**  trans-49.6111.7169.9-174.3159.1-12900107.9W74W74-E76 PolarHBondContact O-N 3Å
77G47.9Very low46.7Very low67 Ų67139 Ų13969%0.69177%0.765SS**  trans-102.7101.9172.800000107.1I75I75-G77 PolarHBondContact O-N 3.01Å; I75-G77 VanDerWaalsContact O-N 3.1Å
78D42.3Very low45.8Very low152 Ų152146.6 Ų146.681%0.81377%0.774SS**  trans30.2112157.1-61.1-17000117.8
79E50.2Low44.8Very low187 Ų187150 Ų15087%0.87480%0.798SS**  trans-15.7122.1141.7-55174.9176.100113.7
80E40.8Very low43.9Very low178 Ų178153.1 Ų153.183%0.83280%0.798SS**  trans175.5116.3136-95.2165.4-155.600109.7
81D38.4Very low43.3Very low150 Ų150154 Ų15480%0.80280%0.797SS**  trans46.8118.9146.9-57.8-24.2000120.4
82D39.4Very low42.4Very low162 Ų162152.3 Ų152.387%0.86681%0.805SS**  -175.2144.999-149.362.2000111.8
83E39.9Very low41.7Very low175 Ų175154.3 Ų154.382%0.81882%0.818SS**  trans-80147.5-168.6-72.8-86-177.300114.4
84G34Very low41.2Very low60 Ų60155.8 Ų155.862%0.61982%0.82SS**  trans74.1113.2143.500000120
85Y38.1Very low41Very low232 Ų232150.9 Ų150.991%0.9182%0.82SS**  177.6144.9105.4-118.4-104.2000112.7
86F35.5Very low41Very low201 Ų201145.1 Ų145.188%0.88280%0.802SS**  trans-71153.6-173.5-66.6-97.1000115.1
87G33.4Very low40.9Very low76 Ų76146 Ų14678%0.78480%0.803SS**  trans174.779.3160.100000118.9
88R34.4Very low40.5Very low249 Ų249151.7 Ų151.794%0.9481%0.814SS**  trans49.2119.5146.9-81-179.2178.4-121.30.2122.2
89S38.3Very low40.5Very low116 Ų116154.4 Ų154.481%0.81182%0.819SS**  trans-61.6142.8155.2-42.30000112.2
90R40.9Very low40.1Very low234 Ų234156 Ų15688%0.88382%0.817SS**  160.4-176.576.6-124.2-163.8-168.7-137.91.6106.6
91P45.2Very low40.4Very low106 Ų106152 Ų15269%0.68881%0.814SS**  cis-132.2158.4-43.832.6-13.4000114.7
92G38.3Very low40.6Very low75 Ų75151.6 Ų151.677%0.77381%0.807SS**  trans71.4101.9139.700000121.7
93V42.7Very low40.8Very low142 Ų142150.9 Ų150.986%0.86180%0.799SS**  trans-151.3138.4154.5179.20000107.4
94P41.9Very low41Very low112 Ų112147.6 Ų147.673%0.72779%0.793SS**  trans-71.1151.3-164.629.5-36.5000113.1G96P94-G96 PolarHBondContact O-N 3.33Å; P94-G96 VanDerWaalsContact O-N 3.09Å
95P43.5Very low41.6Very low143 Ų143155.3 Ų155.393%0.92980%0.803SS**  trans-82.793.3178.318.9-4.9000109.7
96G46.3Very low42Very low46 Ų46148.7 Ų148.747%0.47479%0.789SS.*  trans-138.3109.5167.800000109.3P94P94-G96 PolarHBondContact O-N 3.33Å; P94-G96 VanDerWaalsContact O-N 3.09Å
97F48Very low42.8Very low204 Ų204148.7 Ų148.790%0.89579%0.792SS**  trans68.183.3165.1-45.4-75.7000117.2
98M39.5Very low43.3Very low186 Ų186156 Ų15692%0.91680%0.796SS**  trans-135.298.1160.7-60.2-88-103.700108.7R100M98-R100 PolarHBondContact O-N 3.08Å
99F41.1Very low44.3Very low208 Ų208153 Ų15391%0.91279%0.79SS**  trans-63.3114.7162.2-77-90.4000107.3A101F99-A101 PolarHBondContact O-N 3.49Å
100R43.1Very low44.7Very low221 Ų221153.6 Ų153.683%0.83479%0.79SS**  trans-67.584.4176.6-175.8-177.5-76.9-114.11.4109.5M98 Q102M98-R100 PolarHBondContact O-N 3.08Å; R100-Q102 HydrophobicContact CG-CB 3.8Å; R100-Q102 HydrophobicContact CG-CG 3.84Å; R100-Q102 PolarHBondContact O-N 2.91Å
101A47.4Very low45Very low94 Ų94148.9 Ų148.978%0.77779%0.787SS**  trans-72.787.714700000106.8F99F99-A101 PolarHBondContact O-N 3.49Å
102Q41.7Very low45Very low141 Ų141147.8 Ų147.866%0.65979%0.787SS**  trans-127.3104.9161.2-73.4-67.95.500107.3R100 P104R100-Q102 HydrophobicContact CG-CB 3.8Å; R100-Q102 HydrophobicContact CG-CG 3.84Å; R100-Q102 PolarHBondContact O-N 2.91Å; Q102-P104 WeakPolarHBondContact O-CD 3.27Å
103Q44.7Very low45.1Very low147 Ų147155.6 Ų155.669%0.68779%0.793SS**  trans-83.5120.3160.6177.8177.4700107.1R105Q103-R105 HydrophobicContact CG-CG 4.46Å
104P42.2Very low45.2Very low107 Ų107159.9 Ų159.970%0.69579%0.794SS**  trans-111.1119.3142.52.716.9000107.3Q102 P106Q102-P104 WeakPolarHBondContact O-CD 3.27Å; P104-P106 WeakPolarHBondContact O-CD 3.42Å
105R47.2Very low45.4Very low221 Ų221165.8 Ų165.883%0.83480%0.802SS**  trans-75.3121.1157.9-76.4-176.4176179.31107.5Q103Q103-R105 HydrophobicContact CG-CG 4.46Å
106P46.1Very low45.5Very low94 Ų94164.1 Ų164.161%0.6179%0.794SS**  trans-104.4132.8138.731.9-27000108P104 R108P104-P106 WeakPolarHBondContact O-CD 3.42Å; P106-R108 VanDerWaalsContact C-N 3.3Å; P106-R108 PolarHBondContact O-N 3.44Å
107Q53.5Low45.7Very low201 Ų201168.6 Ų168.694%0.93981%0.806SS**  trans-53.490170.5-72.9-110.718.100109.8K109Q107-K109 PolarHBondContact O-N 3.5Å
108R43.6Very low45.6Very low229 Ų229164.7 Ų164.786%0.86480%0.801SS**  trans-82.4112.7169.5-80.9-171.6168.4-175.4-3.3108.1P106P106-R108 VanDerWaalsContact C-N 3.3Å; P106-R108 PolarHBondContact O-N 3.44Å
109K55.3Low45.7Very low187 Ų187161.1 Ų161.181%0.81379%0.79SS**  trans-41.6132162-65.5173.3179.8175.90108.2Q107 V111Q107-K109 PolarHBondContact O-N 3.5Å; K109-V111 PolarHBondContact O-N 2.92Å
110P45.5Very low45.7Very low127 Ų127159.2 Ų159.283%0.82579%0.788SS**  trans-64.5108.5179.325.3-30.6000107.8A112P110-A112 PolarHBondContact O-N 3.42Å
111V47.9Very low45.7Very low136 Ų136157.6 Ų157.682%0.82478%0.783SS**  trans-59.8108.6164.1-177.20000104.8K109 R113K109-V111 PolarHBondContact O-N 2.92Å; V111-R113 PolarHBondContact O-N 2.89Å
112A44.6Very low45.9Very low82 Ų82162.4 Ų162.468%0.67879%0.79SS**  trans-50.7112171.600000106.4P110 R114P110-A112 PolarHBondContact O-N 3.42Å; A112-R114 VanDerWaalsContact C-N 3.26Å; A112-R114 PolarHBondContact O-N 3.24Å
113R41.5Very low45.8Very low240 Ų240162.5 Ų162.591%0.90680%0.795SS**  trans-57.3100171.3-82.1-176.7179.7168.3-0.3105.8V111 R115V111-R113 PolarHBondContact O-N 2.89Å; R113-R115 PolarHBondContact O-N 3.48Å
114R45.4Very low46.1Very low232 Ų232159.7 Ų159.788%0.87580%0.796SS**  trans-61.1101.2160-68.9-151.6179.1-87.72.5104.8A112 S116A112-R114 VanDerWaalsContact C-N 3.26Å; A112-R114 PolarHBondContact O-N 3.24Å; R114-S116 PolarHBondContact O-N 3.39Å
115R44.5Very low46.6Very low235 Ų235160.7 Ų160.789%0.88780%0.803SS**  trans-61.987153.9-76-177172.5176-1.7104.8R113 L117R113-R115 PolarHBondContact O-N 3.48Å; R115-L117 VanDerWaalsContact C-N 3.28Å; R115-L117 PolarHBondContact O-N 3Å
116S46.3Very low46.7Very low109 Ų109156.3 Ų156.376%0.76280%0.796SS**  trans-67.7101.8157.739.40000105.4R114R114-S116 PolarHBondContact O-N 3.39Å
117L51Low47.4Very low140 Ų140157.1 Ų157.173%0.73380%0.802SS**  trans-53.4147.5153.6-66.4171.1000107.2R115 T119R115-L117 VanDerWaalsContact C-N 3.28Å; R115-L117 PolarHBondContact O-N 3Å; L117-T119 PolarHBondContact O-N 2.74Å
118P44.8Very low47.5Very low121 Ų121158.1 Ų158.179%0.78680%0.797SS**  trans-56.9113.8163.2-13.227.2000106.5L120P118-L120 PolarHBondContact O-N 3.01Å
119T42.6Very low48.4Very low112 Ų112148.5 Ų148.569%0.68777%0.769SS**  trans-56.1111.6159.2-58.70000104.9L117 Y121L117-T119 PolarHBondContact O-N 2.74Å; T119-Y121 HydrophobicContact CG2-CD2 4.02Å; T119-Y121 HydrophobicContact CG2-CE2 4.24Å; T119-Y121 PolarHBondContact O-N 3.47Å
120L41.1Very low48.7Very low167 Ų167144.6 Ų144.687%0.87476%0.763SS**  trans-61.989.9165.7-98.6170.1000106P118 E122P118-L120 PolarHBondContact O-N 3.01Å; L120-E122 PolarHBondContact O-N 3.15Å
121Y42.4Very low50Low187 Ų187143 Ų14373%0.73375%0.751SS**  trans-64.9124.6151.6-98.9-94.6000106.1T119 D123T119-Y121 HydrophobicContact CG2-CD2 4.02Å; T119-Y121 HydrophobicContact CG2-CE2 4.24Å; T119-Y121 PolarHBondContact O-N 3.47Å; Y121-D123 PolarHBondContact O-N 2.96Å
122E51.3Low51.3Low195 Ų195138.8 Ų138.891%0.91173%0.73SS**  trans-66.779.8174.1-170.2165.6-170.900108.2L120L120-E122 PolarHBondContact O-N 3.15Å
123D41Very low53Low144 Ų144137.7 Ų137.777%0.7772%0.721SS**  trans-106.4110.9170.3-85.9-32.2000109.2Y121Y121-D123 PolarHBondContact O-N 2.96Å
124A49.7Very low55.3Low87 Ų87131 Ų13172%0.71970%0.703SS**  trans32.4117.5159.600000118.3D126A124-D126 PolarHBondContact O-N 3.43Å
125P53.5Low57.6Low128 Ų128123.7 Ų123.783%0.83168%0.682SS**  trans-66.5112.8173.428.1-31.9000110.2P127P125-P127 WeakPolarHBondContact O-CD 3.39Å
126D49.5Very low59.9Low130 Ų130117.3 Ų117.370%0.69566%0.662SS**  trans-60.4117160.6-175.34.6000107.9A124 R128A124-D126 PolarHBondContact O-N 3.43Å; D126-R128 PolarHBondContact O-N 3.03Å
127P59.1Low62.3Low111 Ų111114.2 Ų114.272%0.72164%0.643SS**THydrogen-bonded Turntrans-69.35.4-166.325.5-35.2000114.8P125P125-P127 WeakPolarHBondContact O-CD 3.39Å
128R57.4Low64.4Low221 Ų221112.5 Ų112.583%0.83463%0.633SS**THydrogen-bonded Turntrans-133.131.2-170.8-75.8-147.152162.5-7114.7D126D126-R128 PolarHBondContact O-N 3.03Å
129G61.8Low66.9Low28 Ų28113 Ų11329%0.28963%0.625SS.*SBendtrans-76.2172.5171.100000114.8T131 A132G129-T131 PolarHBondContact O-N 3.28Å; G129-A132 PolarHBondContact O-N 3.47Å
130P62.3Low69.5Low104 Ų104113.2 Ų113.268%0.67562%0.616SS**Hα-helixtrans-56.6-18.517424.3-34.5000113.8A133 N134P130-A133 PolarHBondContact O-N 2.98Å; P130-N134 PolarHBondContact O-N 3.4Å; P130-N134 VanDerWaalsContact O-N 3.13Å; P130-N134 PolarHBondContact O-ND2 2.92Å
131T71.6Confident72.2Confident95 Ų95109.7 Ų109.758%0.58360%0.598SS**Hα-helixtrans-61.9-42.8172.1-43.10000112G129 A133 N134 D135G129-T131 PolarHBondContact O-N 3.28Å; T131-A133 VanDerWaalsContact C-N 3.31Å; T131-A133 PolarHBondContact O-N 3.18Å; T131-N134 WeakPolarHBondContact O-CB 3.29Å; T131-N134 PolarHBondContact O-N 3.02Å; T131-N134 VanDerWaalsContact O-N 3.12Å; T131-D135 VanDerWaalsContact O-CG 3.24Å; T131-D135 PolarHBondContact O-N 3.18Å
132A75Confident74.8Confident46 Ų46103.5 Ų103.538%0.3858%0.582SS.*Hα-helixtrans-65-34.6178.700000112.5G129 D135 E136G129-A132 PolarHBondContact O-N 3.47Å; A132-D135 PolarHBondContact O-N 3.25Å; A132-E136 PolarHBondContact O-N 3.49Å; A132-E136 VanDerWaalsContact O-N 3.08Å
133A80.8Confident77.1Confident59 Ų5996.3 Ų96.349%0.48856%0.556SS.*Hα-helixtrans-70.1-35.1174.400000112.3P130 T131 A137P130-A133 PolarHBondContact O-N 2.98Å; T131-A133 VanDerWaalsContact C-N 3.31Å; T131-A133 PolarHBondContact O-N 3.18Å; A133-A137 PolarHBondContact O-N 2.73Å; A133-A137 VanDerWaalsContact O-N 3.08Å
134N89.6Confident79.8Confident100 Ų10094.7 Ų94.754%0.53555%0.547SS..Hα-helixtrans-68.8-39.2173.4-72.4-36.3000111.6P130 T131 E136 A137 I138P130-N134 PolarHBondContact O-N 3.4Å; P130-N134 VanDerWaalsContact O-N 3.13Å; P130-N134 PolarHBondContact O-ND2 2.92Å; T131-N134 WeakPolarHBondContact O-CB 3.29Å; T131-N134 PolarHBondContact O-N 3.02Å; T131-N134 VanDerWaalsContact O-N 3.12Å; N134-E136 PolarHBondContact O-N 3.47Å; N134-A137 WeakPolarHBondContact O-CB 3.5Å; N134-A137 PolarHBondContact O-N 3.28Å; N134-I138 VanDerWaalsContact O-CG1 3.3Å; N134-I138 WeakPolarHBondContact O-CG1 3.42Å; N134-I138 PolarHBondContact O-N 3.21Å
135D93.4Very high82.1Confident79 Ų7996.4 Ų96.442%0.42254%0.54SS..Hα-helixtrans-63.8-41.3176.7-64.9-27.2000111.4T131 A132 A137 I138 Q139T131-D135 VanDerWaalsContact O-CG 3.24Å; T131-D135 PolarHBondContact O-N 3.18Å; A132-D135 PolarHBondContact O-N 3.25Å; D135-A137 VanDerWaalsContact C-N 3.33Å; D135-A137 PolarHBondContact O-N 2.94Å; D135-I138 PolarHBondContact O-N 2.64Å; D135-Q139 WeakPolarHBondContact O-CG 3.33Å; D135-Q139 PolarHBondContact O-N 3.5Å
136E94.4Very high84.2Confident100 Ų10094 Ų9447%0.46752%0.523SS..Hα-helixtrans-62.7-39.6173.2-167.8-170.3158.900111.7A132 N134 Q139 K140A132-E136 PolarHBondContact O-N 3.49Å; A132-E136 VanDerWaalsContact O-N 3.08Å; N134-E136 PolarHBondContact O-N 3.47Å; E136-Q139 PolarHBondContact O-N 3.18Å; E136-K140 WeakPolarHBondContact O-CG 3.48Å; E136-K140 PolarHBondContact O-N 2.99Å; E136-K140 WeakPolarHBondContact OE1-CE 3.39Å; E136-K140 IonicContact OE1-NZ 2.71Å; E136-K140 PolarHBondContact OE1-NZ 3.4Å
137A95.7Very high86.5Confident44 Ų4493.5 Ų93.536%0.36452%0.516SS..Hα-helixtrans-64.5-42.317600000111.9A133 N134 D135 Q139 K140 I141A133-A137 PolarHBondContact O-N 2.73Å; A133-A137 VanDerWaalsContact O-N 3.08Å; N134-A137 WeakPolarHBondContact O-CB 3.5Å; N134-A137 PolarHBondContact O-N 3.28Å; D135-A137 VanDerWaalsContact C-N 3.33Å; D135-A137 PolarHBondContact O-N 2.94Å; A137-Q139 VanDerWaalsContact C-N 3.35Å; A137-Q139 PolarHBondContact O-N 2.98Å; A137-K140 PolarHBondContact O-N 2.96Å; A137-I141 VanDerWaalsContact O-CG1 3.28Å; A137-I141 WeakPolarHBondContact O-CG1 3.48Å; A137-I141 PolarHBondContact O-N 2.71Å
138I95.8Very high88.4Confident104 Ų10492.1 Ų92.153%0.53350%0.502SS..Hα-helixtrans-63.4-41.3176.6-67.4164.4000110.7N134 D135 K140 I141 S142N134-I138 VanDerWaalsContact O-CG1 3.3Å; N134-I138 WeakPolarHBondContact O-CG1 3.42Å; N134-I138 PolarHBondContact O-N 3.21Å; D135-I138 PolarHBondContact O-N 2.64Å; I138-K140 VanDerWaalsContact C-N 3.35Å; I138-K140 PolarHBondContact O-N 2.89Å; I138-I141 PolarHBondContact O-N 3.38Å; I138-S142 PolarHBondContact O-N 3.48Å; I138-S142 PolarHBondContact O-OG 3.26Å
139Q97.3Very high90.3Very high132 Ų13284.3 Ų84.362%0.61749%0.485SS*.Hα-helixtrans-63.9-38.1175.3-71.717515.700112.6D135 E136 A137 S142 A143D135-Q139 WeakPolarHBondContact O-CG 3.33Å; D135-Q139 PolarHBondContact O-N 3.5Å; E136-Q139 PolarHBondContact O-N 3.18Å; A137-Q139 VanDerWaalsContact C-N 3.35Å; A137-Q139 PolarHBondContact O-N 2.98Å; Q139-S142 PolarHBondContact O-OG 3.45Å; Q139-A143 WeakPolarHBondContact O-CB 3.33Å; Q139-A143 PolarHBondContact O-N 2.86Å
140K97.6Very high92.1Very high116 Ų11689.6 Ų89.650%0.50450%0.5SS..Hα-helixtrans-66.8-40.1174.5-73.7173.8-176.1169.10111.8E136 A137 I138 A143 L144E136-K140 WeakPolarHBondContact O-CG 3.48Å; E136-K140 PolarHBondContact O-N 2.99Å; E136-K140 WeakPolarHBondContact OE1-CE 3.39Å; E136-K140 IonicContact OE1-NZ 2.71Å; E136-K140 PolarHBondContact OE1-NZ 3.4Å; A137-K140 PolarHBondContact O-N 2.96Å; I138-K140 VanDerWaalsContact C-N 3.35Å; I138-K140 PolarHBondContact O-N 2.89Å; K140-A143 PolarHBondContact O-N 3.39Å; K140-L144 VanDerWaalsContact O-CG 3.3Å; K140-L144 WeakPolarHBondContact O-CG 3.19Å; K140-L144 PolarHBondContact O-N 3.28Å
141I97.3Very high93.8Very high94 Ų9489.2 Ų89.248%0.48249%0.492SS..Hα-helixtrans-61.6-49.2175.9-68.4163.4000109.9A137 I138 A143 L144 E145A137-I141 VanDerWaalsContact O-CG1 3.28Å; A137-I141 WeakPolarHBondContact O-CG1 3.48Å; A137-I141 PolarHBondContact O-N 2.71Å; I138-I141 PolarHBondContact O-N 3.38Å; I141-A143 PolarHBondContact O-N 3.41Å; I141-L144 PolarHBondContact O-N 3.14Å; I141-E145 HydrophobicContact CG2-CG 4.42Å; I141-E145 WeakPolarHBondContact O-CG 3.3Å; I141-E145 PolarHBondContact O-N 3.15Å
142S97.6Very high95.1Very high56 Ų5693 Ų9339%0.39250%0.495SS..Hα-helixtrans-64.5-39.3-18067.90000112.4I138 Q139 L144 E145 T146I138-S142 PolarHBondContact O-N 3.48Å; I138-S142 PolarHBondContact O-OG 3.26Å; Q139-S142 PolarHBondContact O-OG 3.45Å; S142-L144 PolarHBondContact O-N 2.69Å; S142-E145 PolarHBondContact O-N 3.22Å; S142-T146 WeakPolarHBondContact O-CG2 3.3Å; S142-T146 PolarHBondContact O-N 3.33Å
143A98.1Very high96.1Very high45 Ų4593.3 Ų93.337%0.37250%0.498SS..Hα-helixtrans-57.9-50.1173.800000111.3Q139 K140 I141 E145 T146 E147Q139-A143 WeakPolarHBondContact O-CB 3.33Å; Q139-A143 PolarHBondContact O-N 2.86Å; K140-A143 PolarHBondContact O-N 3.39Å; I141-A143 PolarHBondContact O-N 3.41Å; A143-E145 VanDerWaalsContact C-N 3.32Å; A143-E145 PolarHBondContact O-N 2.98Å; A143-T146 PolarHBondContact O-N 3.36Å; A143-T146 PolarHBondContact O-OG1 3.17Å; A143-E147 PolarHBondContact O-N 3.47Å; A143-E147 VanDerWaalsContact O-N 3.08Å
144L98.5Very high97Very high110 Ų11095.8 Ų95.858%0.57650%0.5SS*.Hα-helixtrans-61.8-39.1177.8-70.7174.4000112.3K140 I141 S142 T146 E147 L148K140-L144 VanDerWaalsContact O-CG 3.3Å; K140-L144 WeakPolarHBondContact O-CG 3.19Å; K140-L144 PolarHBondContact O-N 3.28Å; I141-L144 PolarHBondContact O-N 3.14Å; S142-L144 PolarHBondContact O-N 2.69Å; L144-T146 VanDerWaalsContact C-N 3.34Å; L144-T146 PolarHBondContact O-N 2.69Å; L144-E147 PolarHBondContact O-N 3.49Å; L144-L148 VanDerWaalsContact O-CB 3.3Å; L144-L148 WeakPolarHBondContact O-CB 3.26Å; L144-L148 PolarHBondContact O-N 3.35Å
145E97.3Very high97.4Very high123 Ų12395.3 Ų95.358%0.57550%0.496SS*.Hα-helixtrans-61.4-41.5175.7-74.3174.8172.600111.9I141 S142 A143 L148 A149I141-E145 HydrophobicContact CG2-CG 4.42Å; I141-E145 WeakPolarHBondContact O-CG 3.3Å; I141-E145 PolarHBondContact O-N 3.15Å; S142-E145 PolarHBondContact O-N 3.22Å; A143-E145 VanDerWaalsContact C-N 3.32Å; A143-E145 PolarHBondContact O-N 2.98Å; E145-L148 PolarHBondContact O-N 3.39Å; E145-A149 WeakPolarHBondContact O-CB 3.37Å; E145-A149 PolarHBondContact O-N 3.49Å
146T98.1Very high97.6Very high77 Ų7793.8 Ų93.847%0.47250%0.495SS..Hα-helixtrans-67.1-38.7177.166.60000112.6S142 A143 L144 A149 K150S142-T146 WeakPolarHBondContact O-CG2 3.3Å; S142-T146 PolarHBondContact O-N 3.33Å; A143-T146 PolarHBondContact O-N 3.36Å; A143-T146 PolarHBondContact O-OG1 3.17Å; L144-T146 VanDerWaalsContact C-N 3.34Å; L144-T146 PolarHBondContact O-N 2.69Å; T146-A149 PolarHBondContact O-N 3.08Å; T146-K150 WeakPolarHBondContact O-CG 3.34Å; T146-K150 PolarHBondContact O-N 3.11Å
147E98.2Very high97.7Very high120 Ų12095.5 Ų95.556%0.56150%0.503SS*.Hα-helixtrans-67.1-41175.8-70.3-176.4172.900111.5A143 L144 A149 K150 L151A143-E147 PolarHBondContact O-N 3.47Å; A143-E147 VanDerWaalsContact O-N 3.08Å; L144-E147 PolarHBondContact O-N 3.49Å; E147-A149 VanDerWaalsContact C-N 3.35Å; E147-A149 PolarHBondContact O-N 3.35Å; E147-K150 WeakPolarHBondContact O-CB 3.39Å; E147-K150 PolarHBondContact O-N 3.04Å; E147-L151 PolarHBondContact O-N 3.5Å
148L98.6Very high97.8Very high82 Ų8297.9 Ų97.943%0.42951%0.508SS..Hα-helixtrans-63.6-41.9175.7-153.9177.3000110.8L144 E145 K150 L151 R152L144-L148 VanDerWaalsContact O-CB 3.3Å; L144-L148 WeakPolarHBondContact O-CB 3.26Å; L144-L148 PolarHBondContact O-N 3.35Å; E145-L148 PolarHBondContact O-N 3.39Å; L148-K150 PolarHBondContact O-N 3.34Å; L148-L151 PolarHBondContact O-N 3.31Å; L148-R152 HydrophobicContact CD2-CG 3.81Å; L148-R152 VanDerWaalsContact CD2-CZ 3.46Å; L148-R152 WeakPolarHBondContact O-CG 3.38Å; L148-R152 PolarHBondContact O-N 3.03Å
149A98.1Very high97.8Very high57 Ų5796 Ų9647%0.47150%0.501SS..Hα-helixtrans-61-43.2174.100000112E145 T146 E147 R152 A153E145-A149 WeakPolarHBondContact O-CB 3.37Å; E145-A149 PolarHBondContact O-N 3.49Å; T146-A149 PolarHBondContact O-N 3.08Å; E147-A149 VanDerWaalsContact C-N 3.35Å; E147-A149 PolarHBondContact O-N 3.35Å; A149-R152 PolarHBondContact O-N 3.12Å; A149-A153 PolarHBondContact O-N 3.1Å
150K98.3Very high97.7Very high138 Ų13894 Ų9460%0.649%0.494SS*.Hα-helixtrans-61.8-44.7174.5-72.9171-175170.30111.9T146 E147 L148 R152 A153 Q154T146-K150 WeakPolarHBondContact O-CG 3.34Å; T146-K150 PolarHBondContact O-N 3.11Å; E147-K150 WeakPolarHBondContact O-CB 3.39Å; E147-K150 PolarHBondContact O-N 3.04Å; L148-K150 PolarHBondContact O-N 3.34Å; K150-R152 PolarHBondContact O-N 2.64Å; K150-A153 WeakPolarHBondContact O-CB 3.28Å; K150-A153 PolarHBondContact O-N 3.08Å; K150-Q154 WeakPolarHBondContact O-CG 3.49Å; K150-Q154 PolarHBondContact O-N 3.47Å
151L98.6Very high97.5Very high97 Ų9790.8 Ų90.851%0.50849%0.49SS..Hα-helixtrans-62.8-42.7178.3-174.965.6000111.3E147 L148 A153 Q154 I155E147-L151 PolarHBondContact O-N 3.5Å; L148-L151 PolarHBondContact O-N 3.31Å; L151-A153 VanDerWaalsContact C-N 3.32Å; L151-A153 PolarHBondContact O-N 2.9Å; L151-Q154 PolarHBondContact O-N 2.91Å; L151-I155 HydrophobicContact CG-CD1 4.05Å; L151-I155 VanDerWaalsContact O-CG1 3.29Å; L151-I155 WeakPolarHBondContact O-CG1 3.46Å; L151-I155 PolarHBondContact O-N 3.1Å
152R98.2Very high97.2Very high173 Ų17392.2 Ų92.265%0.65350%0.495SS*.Hα-helixtrans-59.5-42.2173.8-75.9175.7175.1168.34.2111.9L148 A149 K150 I155 A156L148-R152 HydrophobicContact CD2-CG 3.81Å; L148-R152 VanDerWaalsContact CD2-CZ 3.46Å; L148-R152 WeakPolarHBondContact O-CG 3.38Å; L148-R152 PolarHBondContact O-N 3.03Å; A149-R152 PolarHBondContact O-N 3.12Å; K150-R152 PolarHBondContact O-N 2.64Å; R152-I155 PolarHBondContact O-N 3.45Å; R152-A156 WeakPolarHBondContact O-CB 3.33Å; R152-A156 PolarHBondContact O-N 3.04Å
153A97.9Very high96.8Very high53 Ų5394.4 Ų94.444%0.43850%0.498SS..Hα-helixtrans-64.8-41.9176.600000112.3A149 K150 L151 A156 Q157A149-A153 PolarHBondContact O-N 3.1Å; K150-A153 WeakPolarHBondContact O-CB 3.28Å; K150-A153 PolarHBondContact O-N 3.08Å; L151-A153 VanDerWaalsContact C-N 3.32Å; L151-A153 PolarHBondContact O-N 2.9Å; A153-A156 PolarHBondContact O-N 3.08Å; A153-Q157 WeakPolarHBondContact O-CG 3.4Å; A153-Q157 PolarHBondContact O-N 2.71Å
154Q98.2Very high96.1Very high111 Ų111100.5 Ų100.552%0.51951%0.512SS..Hα-helixtrans-63.9-43.6175.5-74.3179.3-15.800112.1K150 L151 A156 Q157 I158K150-Q154 WeakPolarHBondContact O-CG 3.49Å; K150-Q154 PolarHBondContact O-N 3.47Å; L151-Q154 PolarHBondContact O-N 2.91Å; Q154-A156 VanDerWaalsContact C-N 3.33Å; Q154-A156 PolarHBondContact O-N 2.82Å; Q154-Q157 WeakPolarHBondContact O-CB 3.42Å; Q154-Q157 PolarHBondContact O-N 2.61Å; Q154-I158 WeakPolarHBondContact O-CG1 3.46Å; Q154-I158 PolarHBondContact O-N 3.25Å
155I98Very high95.3Very high90 Ų9099.9 Ų99.946%0.46251%0.513SS..Hα-helixtrans-60-46.4174.8-68.4167.1000109.9L151 R152 Q157 I158 V159L151-I155 HydrophobicContact CG-CD1 4.05Å; L151-I155 VanDerWaalsContact O-CG1 3.29Å; L151-I155 WeakPolarHBondContact O-CG1 3.46Å; L151-I155 PolarHBondContact O-N 3.1Å; R152-I155 PolarHBondContact O-N 3.45Å; I155-Q157 VanDerWaalsContact C-N 3.29Å; I155-Q157 PolarHBondContact O-N 3.19Å; I155-I158 PolarHBondContact O-N 3.1Å; I155-I158 VanDerWaalsContact O-N 3.16Å; I155-V159 HydrophobicContact CG2-CG2 4.26Å; I155-V159 WeakPolarHBondContact O-CG2 3.49Å; I155-V159 PolarHBondContact O-N 3.47Å
156A97.8Very high94.2Very high48 Ų4896.9 Ų96.940%0.39751%0.509SS..Hα-helixtrans-58.5-40.6176.800000112.1R152 A153 Q154 V159 L160R152-A156 WeakPolarHBondContact O-CB 3.33Å; R152-A156 PolarHBondContact O-N 3.04Å; A153-A156 PolarHBondContact O-N 3.08Å; Q154-A156 VanDerWaalsContact C-N 3.33Å; Q154-A156 PolarHBondContact O-N 2.82Å; A156-V159 PolarHBondContact O-N 3.43Å; A156-L160 WeakPolarHBondContact O-CB 3.45Å; A156-L160 VanDerWaalsContact O-CG 3.27Å; A156-L160 WeakPolarHBondContact O-CG 3.34Å; A156-L160 PolarHBondContact O-N 2.94Å
157Q96.9Very high92.6Very high135 Ų13599.6 Ų99.663%0.63152%0.517SS*.Hα-helixtrans-63.2-43.9174.7-74.6178.3-10.700112.6A153 Q154 I155 L160 A161A153-Q157 WeakPolarHBondContact O-CG 3.4Å; A153-Q157 PolarHBondContact O-N 2.71Å; Q154-Q157 WeakPolarHBondContact O-CB 3.42Å; Q154-Q157 PolarHBondContact O-N 2.61Å; I155-Q157 VanDerWaalsContact C-N 3.29Å; I155-Q157 PolarHBondContact O-N 3.19Å; Q157-L160 PolarHBondContact O-N 3.24Å; Q157-A161 WeakPolarHBondContact O-CB 3.3Å; Q157-A161 PolarHBondContact O-N 3.04Å
158I96.8Very high90.7Very high95 Ų9597.9 Ų97.949%0.48752%0.517SS..Hα-helixtrans-63-45.9177.6-67.9166.7000110.4Q154 I155 L160 A161 Q162Q154-I158 WeakPolarHBondContact O-CG1 3.46Å; Q154-I158 PolarHBondContact O-N 3.25Å; I155-I158 PolarHBondContact O-N 3.1Å; I155-I158 VanDerWaalsContact O-N 3.16Å; I158-L160 PolarHBondContact O-N 3.17Å; I158-A161 PolarHBondContact O-N 3.23Å; I158-Q162 HydrophobicContact CG2-CG 4.28Å; I158-Q162 WeakPolarHBondContact O-CB 3.49Å; I158-Q162 VanDerWaalsContact O-CG 3.29Å; I158-Q162 WeakPolarHBondContact O-CG 3.48Å; I158-Q162 PolarHBondContact O-N 2.91Å
159V96.6Very high88.5Confident63 Ų6397.5 Ų97.538%0.38253%0.526SS..Hα-helixtrans-60.1-47.1177.9172.40000110.5I155 A156 A161 Q162 E163I155-V159 HydrophobicContact CG2-CG2 4.26Å; I155-V159 WeakPolarHBondContact O-CG2 3.49Å; I155-V159 PolarHBondContact O-N 3.47Å; A156-V159 PolarHBondContact O-N 3.43Å; V159-A161 VanDerWaalsContact C-N 3.33Å; V159-A161 PolarHBondContact O-N 3.39Å; V159-Q162 PolarHBondContact O-N 2.82Å; V159-E163 WeakPolarHBondContact O-CG 3.39Å; V159-E163 PolarHBondContact O-N 3.37Å
160L95.4Very high86.3Confident90 Ų90100.8 Ų100.847%0.47154%0.54SS..Hα-helixtrans-63.6-35.7176.9-73.1172.2000113.1A156 Q157 I158 R164A156-L160 WeakPolarHBondContact O-CB 3.45Å; A156-L160 VanDerWaalsContact O-CG 3.27Å; A156-L160 WeakPolarHBondContact O-CG 3.34Å; A156-L160 PolarHBondContact O-N 2.94Å; Q157-L160 PolarHBondContact O-N 3.24Å; I158-L160 PolarHBondContact O-N 3.17Å; L160-R164 PolarHBondContact O-N 2.97Å; L160-R164 VanDerWaalsContact O-N 3.08Å
161A92.3Very high84.3Confident50 Ų50100.3 Ų100.341%0.41355%0.549SS..Hα-helixtrans-70-39.3175.500000111.5Q157 I158 V159 R164 T165Q157-A161 WeakPolarHBondContact O-CB 3.3Å; Q157-A161 PolarHBondContact O-N 3.04Å; I158-A161 PolarHBondContact O-N 3.23Å; V159-A161 VanDerWaalsContact C-N 3.33Å; V159-A161 PolarHBondContact O-N 3.39Å; A161-R164 PolarHBondContact O-N 3.03Å; A161-T165 WeakPolarHBondContact O-CB 3.2Å; A161-T165 PolarHBondContact O-N 3.4Å; A161-T165 PolarHBondContact O-OG1 3.35Å
162Q92.4Very high81.9Confident124 Ų12499 Ų9958%0.57955%0.552SS**Hα-helixtrans-65.2-42.2174.1-74.3178.90.100111.5I158 V159 T165 A166I158-Q162 HydrophobicContact CG2-CG 4.28Å; I158-Q162 WeakPolarHBondContact O-CB 3.49Å; I158-Q162 VanDerWaalsContact O-CG 3.29Å; I158-Q162 WeakPolarHBondContact O-CG 3.48Å; I158-Q162 PolarHBondContact O-N 2.91Å; V159-Q162 PolarHBondContact O-N 2.82Å; Q162-T165 PolarHBondContact O-N 2.87Å; Q162-A166 VanDerWaalsContact O-CB 3.3Å; Q162-A166 WeakPolarHBondContact O-CB 3.37Å; Q162-A166 PolarHBondContact O-N 2.79Å
163E88.4Confident79.6Confident101 Ų10194.7 Ų94.747%0.47256%0.561SS.*Hα-helixtrans-61.1-44.4174.7-75.7179.9175.900111.8V159 T165 A166 Q167V159-E163 WeakPolarHBondContact O-CG 3.39Å; V159-E163 PolarHBondContact O-N 3.37Å; E163-T165 PolarHBondContact O-N 3.27Å; E163-A166 PolarHBondContact O-N 3.43Å; E163-Q167 WeakPolarHBondContact O-CB 3.31Å; E163-Q167 WeakPolarHBondContact O-CG 3.37Å; E163-Q167 PolarHBondContact O-N 3.13Å
164R84.4Confident77.2Confident173 Ų17398.2 Ų98.265%0.65358%0.577SS**Hα-helixtrans-62.4-41.2173.6-79.5-167.317987.7-3112.8L160 A161 Q167 S168L160-R164 PolarHBondContact O-N 2.97Å; L160-R164 VanDerWaalsContact O-N 3.08Å; A161-R164 PolarHBondContact O-N 3.03Å; R164-Q167 PolarHBondContact O-N 3.2Å; R164-S168 WeakPolarHBondContact O-CB 3.35Å; R164-S168 PolarHBondContact O-N 2.87Å
165T80.1Confident75.1Confident97 Ų9798.3 Ų98.360%0.59559%0.587SS**Hα-helixtrans-67.8-41.6179.4-52.70000111A161 Q162 E163 Q167 S168 A169A161-T165 WeakPolarHBondContact O-CB 3.2Å; A161-T165 PolarHBondContact O-N 3.4Å; A161-T165 PolarHBondContact O-OG1 3.35Å; Q162-T165 PolarHBondContact O-N 2.87Å; E163-T165 PolarHBondContact O-N 3.27Å; T165-Q167 VanDerWaalsContact C-N 3.34Å; T165-Q167 PolarHBondContact O-N 2.96Å; T165-S168 PolarHBondContact O-N 3.25Å; T165-A169 WeakPolarHBondContact O-CB 3.47Å; T165-A169 PolarHBondContact O-N 3.04Å
166A74.1Confident73.4Confident60 Ų6099.8 Ų99.850%0.49660%0.602SS.*Hα-helixtrans-64.6-37.1174.900000112.1Q162 E163 V170Q162-A166 VanDerWaalsContact O-CB 3.3Å; Q162-A166 WeakPolarHBondContact O-CB 3.37Å; Q162-A166 PolarHBondContact O-N 2.79Å; E163-A166 PolarHBondContact O-N 3.43Å; A166-V170 WeakPolarHBondContact O-CG2 3.2Å
167Q64.4Low71.3Confident135 Ų135103.5 Ų103.563%0.63162%0.623SS**Hα-helixtrans-69.7-36.1174.2-72.617211.400112.7E163 R164 T165E163-Q167 WeakPolarHBondContact O-CB 3.31Å; E163-Q167 WeakPolarHBondContact O-CG 3.37Å; E163-Q167 PolarHBondContact O-N 3.13Å; R164-Q167 PolarHBondContact O-N 3.2Å; T165-Q167 VanDerWaalsContact C-N 3.34Å; T165-Q167 PolarHBondContact O-N 2.96Å
168S58.9Low69.4Low83 Ų83103.4 Ų103.458%0.5864%0.637SS**Hα-helixtrans-73.1-32176.1-168.90000113.2R164 T165 V170 V171R164-S168 WeakPolarHBondContact O-CB 3.35Å; R164-S168 PolarHBondContact O-N 2.87Å; T165-S168 PolarHBondContact O-N 3.25Å; S168-V170 PolarHBondContact O-N 3.29Å; S168-V171 PolarHBondContact O-N 3.02Å
169A53Low67.2Low74 Ų74102.3 Ų102.361%0.61265%0.649SS**Hα-helixtrans-71.4-16.917900000113.6T165T165-A169 WeakPolarHBondContact O-CB 3.47Å; T165-A169 PolarHBondContact O-N 3.04Å
170V52.3Low64.8Low127 Ų127105.1 Ų105.177%0.7767%0.671SS**THydrogen-bonded Turntrans-81.2-17.8174.8173.20000112.3A166 S168A166-V170 WeakPolarHBondContact O-CG2 3.2Å; S168-V170 PolarHBondContact O-N 3.29Å
171V55Low62.8Low128 Ų128107 Ų10778%0.77669%0.686SS**THydrogen-bonded Turntrans-100.2-19.3-175.7178.30000113.8S168S168-V171 PolarHBondContact O-N 3.02Å
172A47.9Very low61.2Low70 Ų70110 Ų11058%0.57970%0.702SS**  trans-118.386.5-177.600000112.3V174A172-V174 PolarHBondContact O-N 2.95Å
173G50.9Low60Low81 Ų81109.4 Ų109.484%0.83571%0.709SS**  trans-78.789.6165.700000111.5
174V47.9Very low59.1Low128 Ų128110.1 Ų110.178%0.77672%0.722SS**  trans-151.2135.8167.9-175.20000110.2A172A172-V174 PolarHBondContact O-N 2.95Å
175P53.8Low58.5Low112 Ų112107.6 Ų107.673%0.72773%0.728SS**PPolyproline II helixtrans-85.7159.5-179.735.5-33.5000113
176P61.2Low58.1Low121 Ų121108.4 Ų108.479%0.78674%0.735SS**PPolyproline II helixtrans-84.8153.4-175.934.3-33.2000113.3
177P55.5Low58.1Low127 Ų127110.9 Ų110.983%0.82575%0.746SS**PPolyproline II helixtrans-81.9149.7179.833.4-32.5000112.8
178S55.4Low58.5Low132 Ų132110.1 Ų110.192%0.92375%0.752SS**PPolyproline II helixtrans-66146.7177.2-70.50000113.7
179G51Low58.9Low73 Ų73111.2 Ų111.275%0.75376%0.758SS**  trans147.299.9153.800000115.7
180S45.7Very low59.9Low121 Ų121112.9 Ų112.985%0.84676%0.762SS**  trans167.1130.6132.346.80000111.8
181V53.7Low60.8Low130 Ų130113 Ų11379%0.78877%0.766SS**  trans12.9131.2162.2-166.30000119.4
182P59.4Low61.4Low114 Ų114114.2 Ų114.274%0.7477%0.767SS**PPolyproline II helixtrans-74.7137.5177.831.4-33.1000112
183P67.5Low62.5Low111 Ų111116 Ų11672%0.72177%0.773SS**PPolyproline II helixtrans-70.2159170.729.5-33.5000111.7
184P68.8Low63.3Low115 Ų115117.9 Ų117.975%0.74777%0.77SS**PPolyproline II helixtrans-61.1151.2177.626.9-34.7000111.5
185P71.8Confident63.7Low120 Ų120117.9 Ų117.978%0.77977%0.773SS**PPolyproline II helixtrans-65.7138.7-17727-33.6000111.1
186P72Confident63.9Low114 Ų114116.7 Ų116.774%0.7477%0.773SS**PPolyproline II helixtrans-66.9153.2174.728-33.7000111.4
187P73Confident63.4Low113 Ų113117 Ų11773%0.73477%0.774SS**PPolyproline II helixtrans-59.6151.8174.626.1-34.3000111.4
188P73.3Confident63.3Low118 Ų118115 Ų11577%0.76677%0.769SS**PPolyproline II helixtrans-61.7136.2-177.425.2-33.4000111.1
189P68.9Low62.8Low106 Ų106117.1 Ų117.169%0.68877%0.769SS**PPolyproline II helixtrans-67.7149.117727.6-33.2000111
190P73.4Confident62.9Low109 Ų109121.8 Ų121.871%0.70877%0.771SS**PPolyproline II helixtrans-58.9151.6170.126.6-33.9000110.6L192P190-L192 PolarHBondContact O-N 3.37Å
191P71.3Confident63.4Low130 Ų130125.3 Ų125.384%0.84477%0.766SS**PPolyproline II helixtrans-58.5124.5-177.723-32.4000111.1
192L66.9Low63.2Low153 Ų153125.9 Ų125.980%0.80177%0.77SS**PPolyproline II helixtrans-67.6142.2174.5-79.7143.4000110.5P190P190-L192 PolarHBondContact O-N 3.37Å
193P70.8Confident63.3Low109 Ų109126.7 Ų126.771%0.70876%0.762SS**PPolyproline II helixtrans-63.1151.8170.526.6-32.4000111
194P67.8Low63.4Low120 Ų120124.3 Ų124.378%0.77975%0.748SS**PPolyproline II helixtrans-61.6148.2-174.724.7-33.9000112.7A196P194-A196 PolarHBondContact O-N 2.61Å
195P56.9Low63.3Low127 Ų127121.8 Ų121.883%0.82574%0.737SS**PPolyproline II helixtrans-66.7130-176.725.7-32.1000111.5
196A58.7Low63.4Low88 Ų88121.5 Ų121.573%0.72773%0.728SS**PPolyproline II helixtrans-65.7144.8166.500000110P194 A198P194-A196 PolarHBondContact O-N 2.61Å; A196-A198 PolarHBondContact O-N 2.69Å
197P50.5Low63.4Low126 Ų126121.9 Ų121.982%0.81872%0.719SS**PPolyproline II helixtrans-58.6137.3-174.821-31.3000112.4L199P197-L199 PolarHBondContact O-N 3.04Å
198A51.9Low63.8Low86 Ų86119.7 Ų119.771%0.71170%0.701SS**  trans-50.4112.5-174.400000113.8A196 Q200A196-A198 PolarHBondContact O-N 2.69Å; A198-Q200 HydrophobicContact CB-CG 4.4Å
199L46.5Very low63.8Low176 Ų176118.6 Ų118.692%0.92169%0.688SS**  trans-96.178150-68.8-180000108P197 R201P197-L199 PolarHBondContact O-N 3.04Å; L199-R201 PolarHBondContact O-N 3.19Å
200Q52.8Low64.1Low172 Ų172121.3 Ų121.380%0.80469%0.689SS**  trans-65.4121.5157.9-68.1-145.8-3.700108.5A198A198-Q200 HydrophobicContact CB-CG 4.4Å
201R54.8Low64Low195 Ų195122.2 Ų122.274%0.73668%0.684SS**  trans164.975.2139.2-179.4165.9-88.7118.1-3.9109.4L199 F203L199-R201 PolarHBondContact O-N 3.19Å; R201-F203 HydrophobicContact CG-CD2 3.37Å; R201-F203 HydrophobicContact CG-CE2 3.29Å; R201-F203 HydrophobicContact CG-CG 4.26Å; R201-F203 HydrophobicContact CG-CZ 4.07Å; R201-F203 PolarHBondContact O-N 3.28Å
202T50.3Low64Low142 Ų142125.5 Ų125.587%0.87168%0.679SS**  trans-83.888.516250.50000107.7S204T202-S204 PolarHBondContact O-N 3.5Å
203F61.4Low64Low131 Ų131128.3 Ų128.358%0.57568%0.679SS**  trans-69.8121159.4-74.5-66.6000107.4R201 A205R201-F203 HydrophobicContact CG-CD2 3.37Å; R201-F203 HydrophobicContact CG-CE2 3.29Å; R201-F203 HydrophobicContact CG-CG 4.26Å; R201-F203 HydrophobicContact CG-CZ 4.07Å; R201-F203 PolarHBondContact O-N 3.28Å; F203-A205 PolarHBondContact O-N 3.12Å
204S69.3Low63.4Low60 Ų60126.2 Ų126.242%0.4268%0.678SS.*  trans-66.4132176.11770000108.8T202 I206 E207T202-S204 PolarHBondContact O-N 3.5Å; S204-I206 PolarHBondContact O-N 3.48Å; S204-E207 PolarHBondContact O-N 3.33Å
205A66.1Low63Low63 Ų63129.3 Ų129.352%0.52168%0.679SS.*Hα-helixtrans-52.6-24.5178.100000112.8F203 I209F203-A205 PolarHBondContact O-N 3.12Å; A205-I209 WeakPolarHBondContact O-CD1 3.39Å; A205-I209 VanDerWaalsContact O-CG1 3.23Å; A205-I209 WeakPolarHBondContact O-CG1 3.47Å; A205-I209 PolarHBondContact O-N 3.46Å
206I74.3Confident62.9Low114 Ų114132.9 Ų132.959%0.58568%0.681SS**Hα-helixtrans-70.8-34.8178-57.9167.6000111.8S204 I209 K210S204-I206 PolarHBondContact O-N 3.48Å; I206-I209 PolarHBondContact O-N 3.37Å; I206-K210 PolarHBondContact O-N 2.88Å; I206-K210 VanDerWaalsContact O-N 3.17Å
207E71.9Confident62.3Low121 Ų121137.8 Ų137.857%0.56569%0.686SS**Hα-helixtrans-68.3-42.7174.2-81-176.3144.300111.6S204 I209 K210 E211S204-E207 PolarHBondContact O-N 3.33Å; E207-I209 PolarHBondContact O-N 3.48Å; E207-K210 PolarHBondContact O-N 3.47Å; E207-E211 PolarHBondContact O-N 3.48Å
208L81.7Confident61.8Low67 Ų67138.3 Ų138.335%0.35168%0.682SS.*Hα-helixtrans-60.3-33.9176.1-79.7165.6000112.5R212L208-R212 WeakPolarHBondContact O-CG 3.42Å; L208-R212 PolarHBondContact O-N 2.88Å
209I74.7Confident61.2Low96 Ų96143.4 Ų143.449%0.49269%0.691SS.*Hα-helixtrans-74.4-38.6178.1-66.5163.4000111A205 I206 E207 R213A205-I209 WeakPolarHBondContact O-CD1 3.39Å; A205-I209 VanDerWaalsContact O-CG1 3.23Å; A205-I209 WeakPolarHBondContact O-CG1 3.47Å; A205-I209 PolarHBondContact O-N 3.46Å; I206-I209 PolarHBondContact O-N 3.37Å; E207-I209 PolarHBondContact O-N 3.48Å; I209-R213 WeakPolarHBondContact O-CG 3.44Å; I209-R213 PolarHBondContact O-N 2.92Å; I209-R213 VanDerWaalsContact O-N 3.16Å
210K73.3Confident61Low162 Ų162143.5 Ų143.570%0.70469%0.687SS**Hα-helixtrans-66.3-42174.2-82.7-176.9176.1-178.40111.9I206 E207 R212 R213 G214I206-K210 PolarHBondContact O-N 2.88Å; I206-K210 VanDerWaalsContact O-N 3.17Å; E207-K210 PolarHBondContact O-N 3.47Å; K210-R212 PolarHBondContact O-N 3.14Å; K210-R213 PolarHBondContact O-N 3.21Å; K210-G214 PolarHBondContact O-N 3.15Å
211E72.9Confident60.3Low129 Ų129141.4 Ų141.460%0.60369%0.686SS**Hα-helixtrans-59.4-45.4176.6-173.3-174.4-174.800111.7E207 R213 G214E207-E211 PolarHBondContact O-N 3.48Å; E211-R213 VanDerWaalsContact C-N 3.34Å; E211-R213 PolarHBondContact O-N 2.91Å; E211-G214 PolarHBondContact O-N 3.38Å
212R70.6Confident60.3Low198 Ų198137.5 Ų137.575%0.74769%0.686SS**Hα-helixtrans-71.8-23.9179.9-73-179.6178.9146.30.9114L208 K210L208-R212 WeakPolarHBondContact O-CG 3.42Å; L208-R212 PolarHBondContact O-N 2.88Å; K210-R212 PolarHBondContact O-N 3.14Å
213R67.2Low59.5Low213 Ų213136.8 Ų136.880%0.80468%0.681SS**Hα-helixtrans-87.7-15.2177.9-73.8-164.3-179.1-151.73.5114.2I209 K210 E211I209-R213 WeakPolarHBondContact O-CG 3.44Å; I209-R213 PolarHBondContact O-N 2.92Å; I209-R213 VanDerWaalsContact O-N 3.16Å; K210-R213 PolarHBondContact O-N 3.21Å; E211-R213 VanDerWaalsContact C-N 3.34Å; E211-R213 PolarHBondContact O-N 2.91Å
214G58.9Low58.8Low65 Ų65142.1 Ų142.167%0.6770%0.699SS**SBendtrans-81-8.4-177.100000116.8K210 E211K210-G214 PolarHBondContact O-N 3.15Å; E211-G214 PolarHBondContact O-N 3.38Å
215K58.8Low57.5Low184 Ų184144.2 Ų144.280%0.871%0.714SS**SBendtrans-105.233.1-172.4-64.6-160179.4-175.30115.6
216K54.6Low56.5Low203 Ų203150.7 Ų150.788%0.88373%0.73SS**  trans-133.482.4168.6-74.4-164.7175.4-174.10110.6
217K45.8Very low55.3Low190 Ų190150.9 Ų150.983%0.82674%0.739SS**  trans-153124.2152.9-141177178.3-176.30110.4
218D40.8Very low54.3Low137 Ų137149.3 Ų149.373%0.73375%0.746SS**  trans43.4122.2160-71.6-38.7000120.4
219E37.9Very low53.3Low194 Ų194153.6 Ų153.691%0.90777%0.77SS**  -177.2145.897.1-91.9-177.2172.300111.4
220Q43.3Very low52.8Low177 Ų177156 Ų15683%0.82778%0.782SS**  trans-90.2151.4177.9-64.3177-1300111.4
221T38.3Very low52.8Low128 Ų128151.9 Ų151.979%0.78577%0.772SS**  trans82.7162160.376.60000118.5
222P54.7Low53.5Low113 Ų113148.4 Ų148.473%0.73476%0.762SS**  -131.4106.6-84.233.4-13.1000111
223V33.7Very low54.3Low128 Ų128145.7 Ų145.778%0.77676%0.759SS**  trans-144.1128.8173.9-171.30000110.4S225V223-S225 PolarHBondContact O-N 2.88Å
224Y46.3Very low55.4Low242 Ų242141 Ų14195%0.94975%0.75SS**  trans-31.4106165.9-90.1-100.7000112
225S41.8Very low56.8Low104 Ų104141.4 Ų141.473%0.72774%0.736SS**  trans-134.1125160.549.20000107.6V223V223-S225 PolarHBondContact O-N 2.88Å
226K44.4Very low58.3Low200 Ų200136.3 Ų136.387%0.8772%0.717SS**  trans-31.5125.6172.7-96.4165.8164.7171.10110.3A228K226-A228 PolarHBondContact O-N 2.86Å; K226-A228 VanDerWaalsContact O-N 3.15Å
227P49.3Very low60Low118 Ų118131.4 Ų131.477%0.76670%0.7SS**  trans-57.6128.5163.226.1-29.7000106.1D229P227-D229 PolarHBondContact O-N 3.17Å
228A51.1Low62.1Low87 Ų87128.2 Ų128.272%0.71969%0.686SS**  trans-43.7120.6167.300000107.2K226 I230K226-A228 PolarHBondContact O-N 2.86Å; K226-A228 VanDerWaalsContact O-N 3.15Å; A228-I230 PolarHBondContact O-N 2.94Å
229D60.4Low64.3Low157 Ų157125.3 Ų125.384%0.8467%0.67SS**  trans-63.976.9-171.3-161.911.6000108.6P227 P231P227-D229 PolarHBondContact O-N 3.17Å; D229-P231 VanDerWaalsContact O-CD 3.26Å; D229-P231 WeakPolarHBondContact O-CD 3.43Å
230I64.3Low66.8Low147 Ų147120.7 Ų120.775%0.75465%0.651SS**  trans-75.8111.4166.1-61.5169.1000103.5A228 S232A228-I230 PolarHBondContact O-N 2.94Å; I230-S232 PolarHBondContact O-N 3.06Å
231P74.8Confident68.7Low75 Ų75119.1 Ų119.149%0.48765%0.649SS.*  trans-55129.9178.2-20.531.8000108.1D229 M233 I236D229-P231 VanDerWaalsContact O-CD 3.26Å; D229-P231 WeakPolarHBondContact O-CD 3.43Å; P231-M233 PolarHBondContact O-N 3.12Å; P231-I236 HydrophobicContact CB-CD1 4.26Å; P231-I236 HydrophobicContact CB-CG1 4.01Å
232S86.8Confident71.1Confident57 Ų57120.1 Ų120.140%0.39964%0.642SS.*  trans-51.1134.6176.8176.90000109.5I230 L234 D235 I236I230-S232 PolarHBondContact O-N 3.06Å; S232-L234 PolarHBondContact O-N 3.04Å; S232-L234 PolarHBondContact OG-N 3Å; S232-D235 WeakPolarHBondContact CB-OD2 3.47Å; S232-D235 WeakPolarHBondContact O-CA 3.32Å; S232-D235 PolarHBondContact O-N 2.72Å; S232-I236 PolarHBondContact O-N 3Å
233M87.4Confident72.6Confident141 Ų141119.1 Ų119.170%0.69563%0.634SS**Hα-helixtrans-52.9-29.8176.5-88.9-104.4-66.400112.2P231 D235 I236 L237P231-M233 PolarHBondContact O-N 3.12Å; M233-D235 VanDerWaalsContact C-N 3.35Å; M233-I236 PolarHBondContact O-N 3.14Å; M233-L237 WeakPolarHBondContact O-CB 3.37Å; M233-L237 WeakPolarHBondContact O-CD1 3.46Å; M233-L237 WeakPolarHBondContact O-CG 3.28Å; M233-L237 PolarHBondContact O-N 3.21Å
234L89.9Confident75.1Confident114 Ų114122.3 Ų122.360%0.59764%0.637SS**Hα-helixtrans-66.7-36.3174.8-64.4175.7000112.5S232 K238S232-L234 PolarHBondContact O-N 3.04Å; S232-L234 PolarHBondContact OG-N 3Å; L234-K238 WeakPolarHBondContact O-CG 3.26Å; L234-K238 PolarHBondContact O-N 3.18Å
235D88.3Confident76.9Confident73 Ų73118.2 Ų118.239%0.3963%0.63SS.*Hα-helixtrans-77.7-34.8178.9-61-30.3000110.7S232 M233 K238 D239S232-D235 WeakPolarHBondContact CB-OD2 3.47Å; S232-D235 WeakPolarHBondContact O-CA 3.32Å; S232-D235 PolarHBondContact O-N 2.72Å; M233-D235 VanDerWaalsContact C-N 3.35Å; D235-K238 PolarHBondContact O-N 3.42Å; D235-K238 IonicContact OD1-NZ 3.57Å; D235-K238 PolarHBondContact OD1-NZ 3.03Å; D235-D239 WeakPolarHBondContact O-CB 3.23Å; D235-D239 PolarHBondContact O-N 3.41Å; D235-D239 VanDerWaalsContact O-N 3.08Å
236I89.8Confident78.8Confident78 Ų78124.1 Ų124.140%0.464%0.637SS.*Hα-helixtrans-60.7-46.6169.1-60.2174.1000110.7P231 S232 M233 K238 D239 I240P231-I236 HydrophobicContact CB-CD1 4.26Å; P231-I236 HydrophobicContact CB-CG1 4.01Å; S232-I236 PolarHBondContact O-N 3Å; M233-I236 PolarHBondContact O-N 3.14Å; I236-K238 PolarHBondContact O-N 3.19Å; I236-D239 PolarHBondContact O-N 3.43Å; I236-I240 HydrophobicContact CG2-CD1 4.45Å; I236-I240 WeakPolarHBondContact O-CG1 3.25Å; I236-I240 PolarHBondContact O-N 3.28Å; I236-I240 VanDerWaalsContact O-N 3.1Å
237L90.4Very high80.4Confident99 Ų99120.2 Ų120.252%0.51864%0.635SS.*Hα-helixtrans-63.8-37.2178-73.2166.3000112.7M233 D239 I240M233-L237 WeakPolarHBondContact O-CB 3.37Å; M233-L237 WeakPolarHBondContact O-CD1 3.46Å; M233-L237 WeakPolarHBondContact O-CG 3.28Å; M233-L237 PolarHBondContact O-N 3.21Å; L237-D239 VanDerWaalsContact C-N 3.28Å; L237-D239 PolarHBondContact O-N 2.88Å; L237-I240 HydrophobicContact CD2-CD1 4.09Å
238K90.7Very high81Confident123 Ų123120.5 Ų120.554%0.53563%0.634SS.*Hα-helixtrans-67.2-28.3174-73.3168.1-164.2161.30113.5L234 D235 I236L234-K238 WeakPolarHBondContact O-CG 3.26Å; L234-K238 PolarHBondContact O-N 3.18Å; D235-K238 PolarHBondContact O-N 3.42Å; D235-K238 IonicContact OD1-NZ 3.57Å; D235-K238 PolarHBondContact OD1-NZ 3.03Å; I236-K238 PolarHBondContact O-N 3.19Å
239D87.6Confident81.4Confident76 Ų76121.9 Ų121.941%0.40662%0.624SS.*Hα-helixtrans-90-17-176.8-73.1-12.1000112.6D235 I236 L237 D241 K242 V243D235-D239 WeakPolarHBondContact O-CB 3.23Å; D235-D239 PolarHBondContact O-N 3.41Å; D235-D239 VanDerWaalsContact O-N 3.08Å; I236-D239 PolarHBondContact O-N 3.43Å; L237-D239 VanDerWaalsContact C-N 3.28Å; L237-D239 PolarHBondContact O-N 2.88Å; D239-D241 VanDerWaalsContact C-N 3.28Å; D239-D241 PolarHBondContact O-N 3.14Å; D239-K242 WeakPolarHBondContact O-CA 3.19Å; D239-K242 WeakPolarHBondContact O-CB 3.4Å; D239-K242 PolarHBondContact O-N 2.86Å; D239-K242 WeakPolarHBondContact OD1-CD 3.35Å; D239-K242 WeakPolarHBondContact OD1-CE 3.15Å; D239-K242 IonicContact OD1-NZ 2.64Å; D239-K242 PolarHBondContact OD1-NZ 3Å; D239-V243 WeakPolarHBondContact O-CG2 2.92Å; D239-V243 PolarHBondContact O-N 3.19Å
240I89.6Confident80.8Confident97 Ų97117.7 Ų117.750%0.49761%0.607SS.*Hα-helixtrans-56.9-40.5174.5-78.1164.6000111.6I236 L237 K242 V243I236-I240 HydrophobicContact CG2-CD1 4.45Å; I236-I240 WeakPolarHBondContact O-CG1 3.25Å; I236-I240 PolarHBondContact O-N 3.28Å; I236-I240 VanDerWaalsContact O-N 3.1Å; L237-I240 HydrophobicContact CD2-CD1 4.09Å; I240-K242 PolarHBondContact O-N 2.82Å; I240-V243 PolarHBondContact O-N 3.34Å; I240-V243 VanDerWaalsContact O-N 3.15Å
241D83.8Confident80.1Confident145 Ų145122.6 Ų122.678%0.77562%0.616SS**THydrogen-bonded Turntrans-68.6-18.9177.7-67.1-26.2000113.3D239D239-D241 VanDerWaalsContact C-N 3.28Å; D239-D241 PolarHBondContact O-N 3.14Å
242K87.8Confident78.9Confident149 Ų149125.5 Ų125.565%0.64863%0.626SS**THydrogen-bonded Turntrans-87.4-19.6177.3-54.6176.3-169.2162.80111.8D239 I240 K244D239-K242 WeakPolarHBondContact O-CA 3.19Å; D239-K242 WeakPolarHBondContact O-CB 3.4Å; D239-K242 PolarHBondContact O-N 2.86Å; D239-K242 WeakPolarHBondContact OD1-CD 3.35Å; D239-K242 WeakPolarHBondContact OD1-CE 3.15Å; D239-K242 IonicContact OD1-NZ 2.64Å; D239-K242 PolarHBondContact OD1-NZ 3Å; I240-K242 PolarHBondContact O-N 2.82Å; K242-K244 PolarHBondContact O-N 3.38Å; K242-K244 VanDerWaalsContact O-N 3.17Å
243V86.7Confident76.6Confident92 Ų92126.5 Ų126.556%0.55863%0.625SS**  trans-78.997.9177.5179.30000109.6D239 I240 L245D239-V243 WeakPolarHBondContact O-CG2 2.92Å; D239-V243 PolarHBondContact O-N 3.19Å; I240-V243 PolarHBondContact O-N 3.34Å; I240-V243 VanDerWaalsContact O-N 3.15Å; V243-L245 HydrophobicContact CG1-CD2 3.82Å; V243-L245 HydrophobicContact CG1-CG 4.25Å; V243-L245 PolarHBondContact O-N 3.23Å
244K86.1Confident74.2Confident195 Ų195126.4 Ų126.485%0.84863%0.627SS**  trans-86.198.8168-68.5-177.6-178.6177.70109.4K242 R246K242-K244 PolarHBondContact O-N 3.38Å; K242-K244 VanDerWaalsContact O-N 3.17Å; K244-R246 PolarHBondContact O-N 3.42Å
245L84.7Confident72.1Confident155 Ų155126.2 Ų126.281%0.81263%0.63SS**  trans-64.6131.8169.6-62.4-178.9000109V243 S247V243-L245 HydrophobicContact CG1-CD2 3.82Å; V243-L245 HydrophobicContact CG1-CG 4.25Å; V243-L245 PolarHBondContact O-N 3.23Å; L245-S247 PolarHBondContact O-N 3.38Å
246R82Confident70.1Confident229 Ų229128.6 Ų128.686%0.86464%0.639SS**  trans-65.8131.4168.7-71-175.6-75.2163.6-3.8107.3K244 V248K244-R246 PolarHBondContact O-N 3.42Å; R246-V248 PolarHBondContact O-N 3.47Å
247S76.9Confident68Low118 Ų118130.8 Ų130.883%0.82565%0.652SS**  trans-54.7103.7165.5166.60000107.7L245 K249L245-S247 PolarHBondContact O-N 3.38Å; S247-K249 PolarHBondContact O-N 2.85Å
248V62.6Low65.8Low124 Ų124135.3 Ų135.375%0.75267%0.667SS**  trans-76116.4165.7177.50000104.1R246 S250R246-V248 PolarHBondContact O-N 3.47Å; V248-S250 PolarHBondContact O-N 3.23Å
249K58.6Low63.7Low116 Ų116134.7 Ų134.750%0.50467%0.674SS.*  trans-5592.6166.8-177.7142.7179.9141.50106.7S247 R251 E253S247-K249 PolarHBondContact O-N 2.85Å; K249-R251 PolarHBondContact O-N 2.89Å; K249-E253 HydrophobicContact CG-CB 4.37Å; K249-E253 WeakPolarHBondContact CG-OE2 3.25Å; K249-E253 VanDerWaalsContact NZ-CD 3.26Å; K249-E253 IonicContact NZ-OE1 2.61Å; K249-E253 PolarHBondContact NZ-OE1 3.16Å; K249-E253 IonicContact NZ-OE2 2.71Å
250S47.2Very low61.7Low68 Ų68139.5 Ų139.548%0.47669%0.691SS.*  trans-53132.4175.8720000105.2V248 L252 E253V248-S250 PolarHBondContact O-N 3.23Å; S250-L252 PolarHBondContact O-N 2.96Å; S250-E253 PolarHBondContact O-N 3.23Å; S250-E253 VanDerWaalsContact O-N 3.14Å
251R51.5Low59.7Low250 Ų250140.5 Ų140.594%0.94371%0.707SS**THydrogen-bonded Turntrans-70.651.1177.3-167.9-173.9179.2-173.10109.8K249K249-R251 PolarHBondContact O-N 2.89Å
252L48.3Very low58.2Low136 Ų136140.4 Ų140.471%0.71271%0.706SS**THydrogen-bonded Turntrans-135.5-16.4179.9-115.7154.5000109.6S250S250-L252 PolarHBondContact O-N 2.96Å
253E38.8Very low56.9Low78 Ų78138.4 Ų138.436%0.36470%0.699SS.*G310 helixtrans-80.6-16.1176.1-157.7-174.4138.800113.5K249 S250 V255K249-E253 HydrophobicContact CG-CB 4.37Å; K249-E253 WeakPolarHBondContact CG-OE2 3.25Å; K249-E253 VanDerWaalsContact NZ-CD 3.26Å; K249-E253 IonicContact NZ-OE1 2.61Å; K249-E253 PolarHBondContact NZ-OE1 3.16Å; K249-E253 IonicContact NZ-OE2 2.71Å; S250-E253 PolarHBondContact O-N 3.23Å; S250-E253 VanDerWaalsContact O-N 3.14Å; E253-V255 VanDerWaalsContact C-N 3.26Å; E253-V255 PolarHBondContact O-N 2.86Å
254N37.9Very low55.6Low140 Ų140135.7 Ų135.775%0.74968%0.684SS**G310 helixtrans-84.913.9-179.5-89.5-24.9000114.9
255V45.4Very low54.7Low109 Ų109130.8 Ų130.866%0.66168%0.679SS**G310 helixtrans-116-13.4170-175.50000112.4E253E253-V255 VanDerWaalsContact C-N 3.26Å; E253-V255 PolarHBondContact O-N 2.86Å
256E46Very low54.8Low123 Ų123127.9 Ų127.958%0.57566%0.664SS**THydrogen-bonded Turntrans-100.8-16.6-170.1-60.8-135.8139.300116K276E256-K276 IonicContact OE1-NZ 2.87Å; E256-K276 PolarHBondContact OE1-NZ 3.07Å
257D46.4Very low55.1Low125 Ų125118.4 Ų118.467%0.66863%0.632SS**SBendtrans-108.75.5-173.2-74.7-24.3000116.7
258K43.4Very low55.7Low194 Ų194115.5 Ų115.584%0.84362%0.616SS**  trans-141.315.3179.9-74.9-81.3173.1155.10114.8K260K258-K260 PolarHBondContact O-N 3.28Å
259T45.7Very low57Low109 Ų109110.5 Ų110.567%0.66959%0.59SS**  trans-7883.6166.4400000108.1S261T259-S261 PolarHBondContact O-N 3.26Å; T259-S261 VanDerWaalsContact O-N 3.1Å
260K45.6Very low58.4Low178 Ų178105.3 Ų105.377%0.77457%0.567SS**  trans-34.4122.6147.6-67.2175.4178.2179.30106.3K258 N262K258-K260 PolarHBondContact O-N 3.28Å; K260-N262 PolarHBondContact O-N 2.81Å
261S48.3Very low60.4Low118 Ų118105.9 Ų105.983%0.82556%0.564SS**  trans-62.365.8-176.7560000110.8T259 E263T259-S261 PolarHBondContact O-N 3.26Å; T259-S261 VanDerWaalsContact O-N 3.1Å; S261-E263 PolarHBondContact O-N 3.08Å
262N52.4Low62.4Low142 Ų14296.7 Ų96.776%0.75954%0.541SS*.  trans-73.694156.1-70.5-37.7000103K260 P264K260-N262 PolarHBondContact O-N 2.81Å; N262-P264 VanDerWaalsContact O-N 3.08Å
263E59.9Low64.4Low108 Ų10895 Ų9551%0.50553%0.53SS..  trans-37.6120.3162.5177.3170.515700106.8R29 S261 A265 L270R29-E263 IonicContact CZ-OE1 3.11Å; R29-E263 IonicContact CZ-OE2 3.83Å; R29-E263 IonicContact NE-OE1 3.04Å; R29-E263 PolarHBondContact NE-OE1 3.39Å; R29-E263 IonicContact NH2-OE1 2.61Å; R29-E263 PolarHBondContact NH2-OE1 3.04Å; R29-E263 IonicContact NH2-OE2 3.37Å; R29-E263 PolarHBondContact NH2-OE2 3.2Å; S261-E263 PolarHBondContact O-N 3.08Å; E263-A265 PolarHBondContact O-N 3.46Å; E263-L270 HydrophobicContact CG-CD2 3.66Å
264P60.6Low66.9Low35 Ų3592.9 Ų92.923%0.22753%0.526CS..  trans-59.8109.5-178.721.5-30000106.7N262 D266 L270N262-P264 VanDerWaalsContact O-N 3.08Å; P264-D266 PolarHBondContact O-N 3.46Å; P264-D266 VanDerWaalsContact O-N 3.11Å; P264-L270 HydrophobicContact CG-CD2 4.01Å; P264-L270 HydrophobicContact CG-CG 4.26Å; P264-L270 VanDerWaalsContact O-CG 3.31Å; P264-L270 WeakPolarHBondContact O-CG 3.44Å
265A67.1Low69.5Low91 Ų9190.2 Ų90.275%0.75251%0.511SS*.SBendtrans-60.2-21175.100000110.9E263E263-A265 PolarHBondContact O-N 3.46Å
266D85.8Confident71.7Confident94 Ų9490.9 Ų90.950%0.50351%0.505SS..SBendtrans-72.8124.4173176.330.3000112P264 A268 G269 L270P264-D266 PolarHBondContact O-N 3.46Å; P264-D266 VanDerWaalsContact O-N 3.11Å; D266-A268 PolarHBondContact O-N 3.39Å; D266-A268 PolarHBondContact OD1-N 2.95Å; D266-G269 PolarHBondContact O-N 3.14Å; D266-G269 VanDerWaalsContact O-N 3.1Å; D266-L270 PolarHBondContact O-N 3.03Å
267P87.8Confident73.8Confident30 Ų3093.9 Ų93.920%0.19551%0.511CS..Hα-helixtrans-54.1-32.917722.5-36.4000114.1I30 L34 L270 I271I30-P267 HydrophobicContact CG2-CB 3.88Å; L34-P267 HydrophobicContact CD2-CB 4.24Å; L34-P267 HydrophobicContact CD2-CG 4.12Å; P267-L270 PolarHBondContact O-N 3.45Å; P267-I271 WeakPolarHBondContact O-CG1 3.45Å; P267-I271 PolarHBondContact O-N 3.04Å
268A90.3Very high75.9Confident58 Ų5894.8 Ų94.848%0.47951%0.509SS..Hα-helixtrans-69.1-39.9178.800000111.8D266 L270 I271 A272D266-A268 PolarHBondContact O-N 3.39Å; D266-A268 PolarHBondContact OD1-N 2.95Å; A268-L270 VanDerWaalsContact C-N 3.34Å; A268-L270 PolarHBondContact O-N 3.37Å; A268-I271 PolarHBondContact O-N 2.81Å; A268-A272 PolarHBondContact O-N 3.15Å
269G89.8Confident78.3Confident19 Ų1988.3 Ų88.320%0.19648%0.481CS..Hα-helixtrans-62.2-39.6174.100000112.8D266 I271 A272 E273D266-G269 PolarHBondContact O-N 3.14Å; D266-G269 VanDerWaalsContact O-N 3.1Å; G269-I271 VanDerWaalsContact C-N 3.3Å; G269-I271 PolarHBondContact O-N 3.33Å; G269-A272 PolarHBondContact O-N 3.26Å; G269-E273 PolarHBondContact O-N 3.47Å
270L87.6Confident80.4Confident7 Ų785.5 Ų85.54%0.03747%0.469CS..Hα-helixtrans-60.9-40176.1-71.4177.3000112.1L26 I30 E263 P264 D266 P267 A268 A274L26-L270 HydrophobicContact CD1-CB 4.3Å; I30-L270 HydrophobicContact CD1-CB 4.4Å; I30-L270 HydrophobicContact CG1-CB 4.01Å; I30-L270 HydrophobicContact CG1-CD1 3.93Å; E263-L270 HydrophobicContact CG-CD2 3.66Å; P264-L270 HydrophobicContact CG-CD2 4.01Å; P264-L270 HydrophobicContact CG-CG 4.26Å; P264-L270 VanDerWaalsContact O-CG 3.31Å; P264-L270 WeakPolarHBondContact O-CG 3.44Å; D266-L270 PolarHBondContact O-N 3.03Å; P267-L270 PolarHBondContact O-N 3.45Å; A268-L270 VanDerWaalsContact C-N 3.34Å; A268-L270 PolarHBondContact O-N 3.37Å; L270-A274 VanDerWaalsContact O-CB 3.28Å; L270-A274 WeakPolarHBondContact O-CB 3.25Å; L270-A274 PolarHBondContact O-N 3.15Å; L270-A274 VanDerWaalsContact O-N 3.12Å
271I90.7Very high82.1Confident79 Ų7982.5 Ų82.541%0.40546%0.457SS..Hα-helixtrans-67.1-46.9176.6-65.5166.1000109.9I30 P267 A268 G269 E273 A274 L275I30-I271 HydrophobicContact CD1-CD1 4.29Å; I30-I271 HydrophobicContact CD1-CG1 3.58Å; P267-I271 WeakPolarHBondContact O-CG1 3.45Å; P267-I271 PolarHBondContact O-N 3.04Å; A268-I271 PolarHBondContact O-N 2.81Å; G269-I271 VanDerWaalsContact C-N 3.3Å; G269-I271 PolarHBondContact O-N 3.33Å; I271-E273 PolarHBondContact O-N 3.28Å; I271-A274 PolarHBondContact O-N 3.26Å; I271-L275 HydrophobicContact CG2-CD1 3.74Å; I271-L275 HydrophobicContact CG2-CG 4.2Å; I271-L275 WeakPolarHBondContact O-CB 3.43Å; I271-L275 VanDerWaalsContact O-CG 3.26Å; I271-L275 WeakPolarHBondContact O-CG 3.48Å; I271-L275 PolarHBondContact O-N 2.94Å
272A92.3Very high83.8Confident57 Ų5784.4 Ų84.447%0.47145%0.446SS..Hα-helixtrans-59.4-46.8-179.600000112.1A268 G269 A274 L275 K276A268-A272 PolarHBondContact O-N 3.15Å; G269-A272 PolarHBondContact O-N 3.26Å; A272-A274 PolarHBondContact O-N 2.84Å; A272-L275 PolarHBondContact O-N 2.87Å; A272-K276 VanDerWaalsContact O-CB 3.32Å; A272-K276 WeakPolarHBondContact O-CB 3.41Å; A272-K276 PolarHBondContact O-N 3.46Å
273E90.2Very high84.5Confident102 Ų10284.6 Ų84.648%0.47744%0.441SS..Hα-helixtrans-62.7-43.7177.6-168.5-169.5153.900111.5G269 I271 L275 K276 R277G269-E273 PolarHBondContact O-N 3.47Å; I271-E273 PolarHBondContact O-N 3.28Å; E273-L275 PolarHBondContact O-N 2.88Å; E273-K276 PolarHBondContact O-N 3.02Å; E273-R277 WeakPolarHBondContact O-CB 3.23Å; E273-R277 PolarHBondContact O-N 3.07Å
274A91.7Very high84.9Confident33 Ų3387.9 Ų87.927%0.27345%0.449SS..Hα-helixtrans-64.6-40.6178.500000112.6L26 L270 I271 A272 R277 K278L26-A274 HydrophobicContact CD2-CB 3.26Å; L270-A274 VanDerWaalsContact O-CB 3.28Å; L270-A274 WeakPolarHBondContact O-CB 3.25Å; L270-A274 PolarHBondContact O-N 3.15Å; L270-A274 VanDerWaalsContact O-N 3.12Å; I271-A274 PolarHBondContact O-N 3.26Å; A272-A274 PolarHBondContact O-N 2.84Å; A274-R277 PolarHBondContact O-N 3.28Å; A274-K278 VanDerWaalsContact O-CB 3.25Å; A274-K278 WeakPolarHBondContact O-CB 3.38Å; A274-K278 PolarHBondContact O-N 2.92Å
275L92.8Very high84.9Confident84 Ų8491.4 Ų91.444%0.4446%0.462SS..Hα-helixtrans-66.4-44.9174.7-68.1173.7000110.9I271 A272 E273 R277 K278 F279I271-L275 HydrophobicContact CG2-CD1 3.74Å; I271-L275 HydrophobicContact CG2-CG 4.2Å; I271-L275 WeakPolarHBondContact O-CB 3.43Å; I271-L275 VanDerWaalsContact O-CG 3.26Å; I271-L275 WeakPolarHBondContact O-CG 3.48Å; I271-L275 PolarHBondContact O-N 2.94Å; A272-L275 PolarHBondContact O-N 2.87Å; E273-L275 PolarHBondContact O-N 2.88Å; L275-R277 VanDerWaalsContact C-N 3.3Å; L275-R277 PolarHBondContact O-N 3.33Å; L275-K278 PolarHBondContact O-N 3.32Å; L275-K278 VanDerWaalsContact O-N 3.17Å; L275-F279 HydrophobicContact CB-CD2 4.43Å; L275-F279 HydrophobicContact CD2-CE2 3.93Å; L275-F279 VanDerWaalsContact O-CD2 3.23Å; L275-F279 WeakPolarHBondContact O-CD2 3.46Å; L275-F279 PolarHBondContact O-N 3.17Å
276K91.5Very high84.3Confident123 Ų12393.4 Ų93.454%0.53546%0.46SS..Hα-helixtrans-54.3-48.2174.7-174.1179.3-177.1-179.50110.6E256 A272 E273 F279 A280E256-K276 IonicContact OE1-NZ 2.87Å; E256-K276 PolarHBondContact OE1-NZ 3.07Å; A272-K276 VanDerWaalsContact O-CB 3.32Å; A272-K276 WeakPolarHBondContact O-CB 3.41Å; A272-K276 PolarHBondContact O-N 3.46Å; E273-K276 PolarHBondContact O-N 3.02Å; K276-F279 PolarHBondContact O-N 3.19Å; K276-A280 WeakPolarHBondContact O-CB 3.5Å; K276-A280 PolarHBondContact O-N 3.35Å
277R89.8Confident82.8Confident186 Ų18693.8 Ų93.870%0.70247%0.47SS*.Hα-helixtrans-65.7-41.5177.1-171175.2176.5176.20.6112.8E273 A274 L275 F279E273-R277 WeakPolarHBondContact O-CB 3.23Å; E273-R277 PolarHBondContact O-N 3.07Å; A274-R277 PolarHBondContact O-N 3.28Å; L275-R277 VanDerWaalsContact C-N 3.3Å; L275-R277 PolarHBondContact O-N 3.33Å; R277-F279 VanDerWaalsContact C-N 3.3Å; R277-F279 PolarHBondContact O-N 3.41Å
278K91.8Very high80.9Confident143 Ų14395.3 Ų95.362%0.62249%0.492SS*.Hα-helixtrans-63.5-35.5179.3179.9171.2-177.8-78.20112.4A274 L275A274-K278 VanDerWaalsContact O-CB 3.25Å; A274-K278 WeakPolarHBondContact O-CB 3.38Å; A274-K278 PolarHBondContact O-N 2.92Å; L275-K278 PolarHBondContact O-N 3.32Å; L275-K278 VanDerWaalsContact O-N 3.17Å
279F93.1Very high78.6Confident58 Ų58100.7 Ų100.725%0.25451%0.507SS..Hα-helixtrans-104.3-3.7-175-65.4-66.1000114.4L275 K276 R277 H281 R282 F283L275-F279 HydrophobicContact CB-CD2 4.43Å; L275-F279 HydrophobicContact CD2-CE2 3.93Å; L275-F279 VanDerWaalsContact O-CD2 3.23Å; L275-F279 WeakPolarHBondContact O-CD2 3.46Å; L275-F279 PolarHBondContact O-N 3.17Å; K276-F279 PolarHBondContact O-N 3.19Å; R277-F279 VanDerWaalsContact C-N 3.3Å; R277-F279 PolarHBondContact O-N 3.41Å; F279-H281 PolarHBondContact O-N 2.94Å; F279-R282 HydrophobicContact CD1-CG 4.4Å; F279-R282 WeakPolarHBondContact O-CB 3.23Å; F279-R282 PolarHBondContact O-N 2.87Å; F279-F283 HydrophobicContact CB-CD2 4.27Å; F279-F283 HydrophobicContact CB-CE2 3.8Å; F279-F283 WeakPolarHBondContact O-CD2 3.48Å; F279-F283 PolarHBondContact O-N 2.9Å
280A89.1Confident76.4Confident50 Ų50109 Ų10941%0.41354%0.54SS..Hα-helixtrans-47.3-36.7177.800000113.5K276K276-A280 WeakPolarHBondContact O-CB 3.5Å; K276-A280 PolarHBondContact O-N 3.35Å
281H82.6Confident74.4Confident115 Ų115112.4 Ų112.453%0.53258%0.577SS.*Hα-helixtrans-72.4-28178.1-156.4-75.4000114.1F279 Q285F279-H281 PolarHBondContact O-N 2.94Å; H281-Q285 PolarHBondContact CE1-NE2 2.81Å; H281-Q285 VanDerWaalsContact CE1-NE2 3.28Å; H281-Q285 PolarHBondContact ND1-NE2 2.9Å; H281-Q285 PolarHBondContact O-N 3.09Å
282R83.6Confident71.8Confident158 Ų158114.2 Ų114.260%0.59660%0.597SS**Hα-helixtrans-76.1-35.2177.4-63.3-162.5-176.7-177.7-6112.1F279 R284 Q285 N286F279-R282 HydrophobicContact CD1-CG 4.4Å; F279-R282 WeakPolarHBondContact O-CB 3.23Å; F279-R282 PolarHBondContact O-N 2.87Å; R282-R284 VanDerWaalsContact C-N 3.25Å; R282-R284 PolarHBondContact O-N 3.38Å; R282-Q285 PolarHBondContact O-N 3.41Å; R282-N286 PolarHBondContact O-N 3.07Å
283F66.3Low69.5Low146 Ų146119.3 Ų119.364%0.6462%0.616SS**Hα-helixtrans-61.6-35.9173.8-69.5-74.4000111.9F279 S287F279-F283 HydrophobicContact CB-CD2 4.27Å; F279-F283 HydrophobicContact CB-CE2 3.8Å; F279-F283 WeakPolarHBondContact O-CD2 3.48Å; F279-F283 PolarHBondContact O-N 2.9Å; F283-S287 WeakPolarHBondContact O-CB 3.38Å; F283-S287 PolarHBondContact O-N 2.76Å; F283-S287 PolarHBondContact O-OG 2.99Å
284R68.1Low67.2Low178 Ų178124.9 Ų124.967%0.67263%0.633SS**Hα-helixtrans-71.2-30.7174.6-66.5-174.969.5-109.4-1.8114.2R282 S287R282-R284 VanDerWaalsContact C-N 3.25Å; R282-R284 PolarHBondContact O-N 3.38Å; R284-S287 PolarHBondContact O-OG 3.26Å; R284-S287 VanDerWaalsContact O-OG 3.14Å
285Q61.6Low65Low108 Ų108130.9 Ų130.951%0.50566%0.655SS.*Hα-helixtrans-78.3-39.4178.9-74.5-177.4-1.800111.7H281 R282 S287 G288H281-Q285 PolarHBondContact CE1-NE2 2.81Å; H281-Q285 VanDerWaalsContact CE1-NE2 3.28Å; H281-Q285 PolarHBondContact ND1-NE2 2.9Å; H281-Q285 PolarHBondContact O-N 3.09Å; R282-Q285 PolarHBondContact O-N 3.41Å; Q285-S287 VanDerWaalsContact C-N 3.32Å; Q285-S287 PolarHBondContact O-N 3.05Å; Q285-G288 PolarHBondContact O-N 2.84Å
286N54.8Low62.4Low133 Ų133134.2 Ų134.271%0.71167%0.673SS**Hα-helixtrans-72.4-25.4176.8-73.419.4000112.8R282 G288R282-N286 PolarHBondContact O-N 3.07Å; N286-G288 VanDerWaalsContact C-N 3.26Å; N286-G288 PolarHBondContact O-N 3.22Å
287S53.3Low60.2Low102 Ų102135 Ų13571%0.71369%0.688SS**THydrogen-bonded Turntrans-79.6-3.2176.867.20000114.3F283 R284 Q285F283-S287 WeakPolarHBondContact O-CB 3.38Å; F283-S287 PolarHBondContact O-N 2.76Å; F283-S287 PolarHBondContact O-OG 2.99Å; R284-S287 PolarHBondContact O-OG 3.26Å; R284-S287 VanDerWaalsContact O-OG 3.14Å; Q285-S287 VanDerWaalsContact C-N 3.32Å; Q285-S287 PolarHBondContact O-N 3.05Å
288G47.9Very low57.6Low63 Ų63135.4 Ų135.465%0.64970%0.695SS**THydrogen-bonded Turntrans-1211.3-178.900000114.5Q285 N286Q285-G288 PolarHBondContact O-N 2.84Å; N286-G288 VanDerWaalsContact C-N 3.26Å; N286-G288 PolarHBondContact O-N 3.22Å
289Q42.5Very low55.2Low171 Ų171135 Ų13580%0.79970%0.704SS**SBendtrans-114.142-174.7-162.3107.510.900111.5
290E43.6Very low52.4Low193 Ų193137 Ų13790%0.90273%0.731SS**SBendtrans-14181.7168.2-159161.6-159.600107.1
291G44.2Very low49.8Very low79 Ų79141.6 Ų141.681%0.81475%0.749SS**SBendtrans141.751177.600000115.9
292S36Very low48.6Very low116 Ų116140.7 Ų140.781%0.81175%0.753SS**  trans-164.949.8165.3179.30000112.3
293D44.8Very low46.2Very low164 Ų164142 Ų14288%0.87777%0.766SS**  trans-89.5103.7153.6-78-28.9000107.1
294R41.6Very low44.7Very low219 Ų219141.3 Ų141.383%0.82677%0.769SS**  trans176.9100.1142.3-96.6178.5175.4178.81.6111.5
295E46.7Very low43.2Very low159 Ų159142.2 Ų142.274%0.74378%0.778SS**  trans67.2113.6134-32-155.4-15600119.2
296D37.7Very low42.2Very low154 Ų154142.8 Ų142.882%0.82479%0.791SS**  -167111.6115.5-93.1-30.6000110.8K298D296-K298 PolarHBondContact O-N 3.03Å
297V45.5Very low41.4Very low139 Ų139145.8 Ų145.884%0.84280%0.801SS**  trans-73.6106.5161.11740000106.9
298K35.4Very low41.2Very low196 Ų196146.5 Ų146.585%0.85281%0.806SS**  trans-130.4107.1158.5-94.9-173.8178.6179.80110.5D296D296-K298 PolarHBondContact O-N 3.03Å
299V41.4Very low41.4Very low134 Ų134150.7 Ų150.781%0.81281%0.809SS**  trans-69.2125.8160.7174.10000108.1
300A32.6Very low42.1Very low99 Ų99146.5 Ų146.582%0.81880%0.803SS**  trans-153.8123.5152.200000108.3
301D35.1Very low42.9Very low148 Ų148141.6 Ų141.679%0.79179%0.788SS**  trans-91.6-174.7-178.4-152.316.3000110.1
302P58.8Low44.2Very low96 Ų96144.5 Ų144.562%0.62378%0.784SS**  -118148.2-105.436.6-20.2000113.3
303E31.7Very low45.9Very low185 Ų185145 Ų14586%0.86477%0.772SS**  trans-157.1122.6152.3-81.2-146.9159.800113.3
304D34.3Very low47.5Very low132 Ų132139 Ų13971%0.70675%0.749SS**  trans60100.1136.9-71.3-4.7000123.7
305K36.9Very low49.1Very low196 Ų196136.6 Ų136.685%0.85275%0.747SS**  149.9157.9118.8-82.5166.4-174172.90114.5
306P42.2Very low50.5Low121 Ų121136.9 Ų136.979%0.78675%0.748SS**  -86.5147.8-86.235.2-20.7000112.4S308P306-S308 PolarHBondContact O-N 2.9Å
307Q37.4Very low52.1Low195 Ų195134.5 Ų134.591%0.91173%0.733SS**  trans-60.9108.6173.5-67.3178.2-40.300110.5E309Q307-E309 PolarHBondContact O-N 3.19Å
308S48.7Very low53.5Low117 Ų117133 Ų13382%0.81872%0.72SS**  trans-70.791149.8169.90000105.9P306 A310P306-S308 PolarHBondContact O-N 2.9Å; S308-A310 PolarHBondContact O-N 2.95Å
309E51.3Low55.4Low152 Ų152132.5 Ų132.571%0.7172%0.718SS**  trans-42.5111.6173.7-163.1178.7-166.700109Q307 P311Q307-E309 PolarHBondContact O-N 3.19Å; E309-P311 WeakPolarHBondContact O-CD 3.38Å
310A58.3Low56.8Low82 Ų82132.3 Ų132.368%0.67872%0.719SS**  trans-58.6123.5173.600000106.4S308 L312S308-A310 PolarHBondContact O-N 2.95Å; A310-L312 PolarHBondContact O-N 3.45Å
311P61.1Low58.3Low91 Ų91133.9 Ų133.959%0.59172%0.719SS**  trans-55.7122.6-176.5-24.832.8000109.3E309 F313E309-P311 WeakPolarHBondContact O-CD 3.38Å; P311-F313 WeakPolarHBondContact CB-O 3.33Å; P311-F313 PolarHBondContact O-N 3.34Å
312L69.9Low59.6Low139 Ų139130.4 Ų130.473%0.72872%0.718SS**SBendtrans-54.5-10175.1-87.3130.2000113.3A310A310-L312 PolarHBondContact O-N 3.45Å
313F71.4Confident59.9Low126 Ų126137.4 Ų137.455%0.55373%0.732SS**SBendtrans-135.5138.9-176.3-57-65.8000110.9P311 M317P311-F313 WeakPolarHBondContact CB-O 3.33Å; P311-F313 PolarHBondContact O-N 3.34Å; F313-M317 HydrophobicContact CB-CB 4.2Å; F313-M317 HydrophobicContact CB-CE 3.47Å; F313-M317 VanDerWaalsContact CB-CE 3.47Å; F313-M317 HydrophobicContact CD1-CE 3.09Å; F313-M317 HydrophobicContact CE1-CE 3.95Å; F313-M317 HydrophobicContact CG-CE 3.43Å; F313-M317 VanDerWaalsContact CG-CE 3.43Å
314G79.2Confident61.2Low38 Ų38138.3 Ų138.339%0.39273%0.733SS.*  trans-60.7150.3179.500000112.4H316 M317G314-H316 PolarHBondContact O-N 3.04Å; G314-M317 WeakPolarHBondContact O-CB 3.06Å; G314-M317 PolarHBondContact O-N 2.91Å
315Q75Confident62.3Low170 Ų170141.6 Ų141.679%0.79474%0.741SS**G310 helixtrans-52.2-25.4-175.3-72.2178.5-2.700114.8M317 L318Q315-M317 PolarHBondContact O-N 3.05Å; Q315-L318 PolarHBondContact O-N 3.1Å; Q315-L318 VanDerWaalsContact O-N 3.15Å
316H76.3Confident63Low165 Ų165140.5 Ų140.576%0.76474%0.743SS**G310 helixtrans-66.6-15.5175.266.7-86.1000114G314G314-H316 PolarHBondContact O-N 3.04Å
317M71.1Confident63.5Low104 Ų104146.3 Ų146.351%0.51277%0.767SS.*G310 helixtrans-92.9-10.2175.2-61.6-129-63.500112.9F313 G314 Q315 K319F313-M317 HydrophobicContact CB-CB 4.2Å; F313-M317 HydrophobicContact CB-CE 3.47Å; F313-M317 VanDerWaalsContact CB-CE 3.47Å; F313-M317 HydrophobicContact CD1-CE 3.09Å; F313-M317 HydrophobicContact CE1-CE 3.95Å; F313-M317 HydrophobicContact CG-CE 3.43Å; F313-M317 VanDerWaalsContact CG-CE 3.43Å; G314-M317 WeakPolarHBondContact O-CB 3.06Å; G314-M317 PolarHBondContact O-N 2.91Å; Q315-M317 PolarHBondContact O-N 3.05Å; M317-K319 PolarHBondContact O-N 3.09Å
318L74.8Confident64.8Low107 Ų107143.9 Ų143.956%0.5676%0.759SS**SBendtrans-81114.8176.5-60177.9000109Q315Q315-L318 PolarHBondContact O-N 3.1Å; Q315-L318 VanDerWaalsContact O-N 3.15Å
319K76.2Confident65.6Low185 Ų185145.3 Ų145.380%0.80476%0.756SS**  trans-74.2134.3174.5-65.2-175.3179.4178.90109.2M317 T321M317-K319 PolarHBondContact O-N 3.09Å; K319-T321 PolarHBondContact O-N 2.79Å; K319-T321 VanDerWaalsContact O-N 3.09Å
320P69.6Low66.4Low131 Ų131144.9 Ų144.985%0.85176%0.759SS**  trans-66.4112.9176.726.4-32000109.3
321T65.5Low66.9Low131 Ų131148.6 Ų148.680%0.80476%0.764SS**  trans-83.1123.6171520000108.7K319 R323K319-T321 PolarHBondContact O-N 2.79Å; K319-T321 VanDerWaalsContact O-N 3.09Å; T321-R323 PolarHBondContact O-N 3.19Å
322G62.1Low67.2Low75 Ų75152.2 Ų152.277%0.77377%0.774SS**  trans-62127.7-178.500000111.5K324G322-K324 PolarHBondContact O-N 3.18Å
323R64.7Low67.1Low244 Ų244153.1 Ų153.192%0.92178%0.777SS**  trans-67.7115.3173.5-72.1-177.2150.1-161.8-8.5109.3T321 K325T321-R323 PolarHBondContact O-N 3.19Å; R323-K325 PolarHBondContact O-N 2.79Å
324K59.7Low66.7Low203 Ų203155 Ų15588%0.88379%0.794SS**PPolyproline II helixtrans-67.7119.6165.8-64.8-176.6-179.6-179.70107.6G322 L326G322-K324 PolarHBondContact O-N 3.18Å; K324-L326 PolarHBondContact O-N 3.44Å
325K56.5Low65.8Low201 Ų201164 Ų16487%0.87482%0.824SS**PPolyproline II helixtrans-73.6119167.9-66.2-177.3179.6-177.20106.9R323R323-K325 PolarHBondContact O-N 2.79Å
326L51.5Low65Low173 Ų173163.5 Ų163.591%0.90683%0.827SS**PPolyproline II helixtrans-75.9125163-88.3154.2000106.9K324K324-L326 PolarHBondContact O-N 3.44Å
327L52.3Low64Low243 Ų243163.4 Ų163.4100%1.27283%0.833SS**  trans-66.20169.1-85.3153.8000110.1

Retrieved 327 of 327 residues in 229.9 ms (Link to these results)