VGLL1_MOUSE Loading...

Transcription cofactor vestigial-like protein 1

May act as a specific coactivator for the mammalian TEFs.

AlphaFold DB , UniProt , Accession Q99NC0, Species MOUSE (Mus musculus, Mouse), Gene Vgll1, Length 307 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
1M47.5Very low50.2Low245 Ų245166.7 Ų166.7100%1.20782%0.818SS**  0126.60-174.9171.5-80.600106.2
2E44.8Very low50.5Low166 Ų166159 Ų15978%0.77679%0.79SS**  trans-128.2110.4-156.3-175.9177174.600109.7
3E52.8Low51.1Low158 Ų158160.5 Ų160.574%0.73879%0.794SS**  trans-94.5108-177.4-73.9-149.9138.400112.3K5E3-K5 PolarHBondContact O-N 3.36Å; E3-K5 IonicContact OE2-NZ 3.77Å
4M49.6Very low51.4Low163 Ų163155.2 Ų155.280%0.80378%0.78SS**  trans-76.678.7177.4-58.9171.3-175.900111.2K6M4-K6 PolarHBondContact O-N 3.49Å; M4-K6 VanDerWaalsContact O-N 3.12Å
5K56.8Low51.8Low179 Ų179149 Ų14978%0.77876%0.757SS**  trans-70.2108.3178-81.9-177.8177.2171.50111.5E3E3-K5 PolarHBondContact O-N 3.36Å; E3-K5 IonicContact OE2-NZ 3.77Å
6K59.5Low52.8Low196 Ų196150.3 Ų150.385%0.85276%0.759SS**  trans-63.2147.2-170.8-68.9175.6179.5173.20113.7M4 G8M4-K6 PolarHBondContact O-N 3.49Å; M4-K6 VanDerWaalsContact O-N 3.12Å; K6-G8 VanDerWaalsContact C-N 3.28Å; K6-G8 PolarHBondContact O-N 3.22Å
7N46.5Very low54.7Low168 Ų168150.8 Ų150.890%0.89876%0.755SS**  trans-63.369.3-177.1-45.931000113.2
8G41.5Very low56.4Low54 Ų54145.2 Ų145.256%0.55773%0.731SS**  trans-69.5135.2163.100000110.3K6 W10K6-G8 VanDerWaalsContact C-N 3.28Å; K6-G8 PolarHBondContact O-N 3.22Å; G8-W10 PolarHBondContact O-N 3.01Å; G8-W10 VanDerWaalsContact O-N 3.11Å
9V54.2Low58.2Low137 Ų137141.9 Ų141.983%0.8372%0.719SS**  trans-67.7109.9170.5175.60000107.9I11V9-I11 HydrophobicContact CG1-CG1 4.47Å; V9-I11 PolarHBondContact O-N 3.4Å
10W44.3Very low59.8Low244 Ų244139.9 Ų139.992%0.92471%0.705SS**  trans-67.694.8170.6-84.757.9000109.2G8 P12G8-W10 PolarHBondContact O-N 3.01Å; G8-W10 VanDerWaalsContact O-N 3.11Å; W10-P12 WeakPolarHBondContact O-CD 3.25Å
11I55Low61.3Low124 Ų124137 Ų13764%0.63669%0.694SS**  trans-74.8118155.9-57.3178.3000105.4V9 E13V9-I11 HydrophobicContact CG1-CG1 4.47Å; V9-I11 PolarHBondContact O-N 3.4Å; I11-E13 PolarHBondContact O-N 3.08Å
12P54Low63.4Low74 Ų74129.4 Ų129.448%0.48166%0.656SS.*  trans-68.3130.9-179.528.6-34.2000109.9W10 S14 S15W10-P12 WeakPolarHBondContact O-CD 3.25Å; P12-S14 PolarHBondContact O-N 3.05Å; P12-S15 WeakPolarHBondContact O-CB 3.26Å; P12-S15 PolarHBondContact O-N 3.09Å; P12-S15 PolarHBondContact O-OG 3.06Å
13E57.7Low65.8Low179 Ų179130.1 Ų130.184%0.83665%0.652SS**G310 helixtrans-60.6-15.8-175.5-62-174134.500113.9I11 S15 Q16I11-E13 PolarHBondContact O-N 3.08Å; E13-S15 PolarHBondContact O-N 3.07Å; E13-Q16 PolarHBondContact O-N 3.42Å
14S55.8Low67.5Low86 Ų86126.9 Ų126.960%0.60164%0.64SS**G310 helixtrans-56.1-27.1169.653.20000113.2P12 Q16 K17P12-S14 PolarHBondContact O-N 3.05Å; S14-Q16 PolarHBondContact O-N 2.74Å; S14-K17 PolarHBondContact O-N 3.41Å
15S57.5Low69.3Low62 Ų62124 Ų12443%0.43464%0.642SS.*G310 helixtrans-66.3-10.3-177.277.30000114.8P12 E13P12-S15 WeakPolarHBondContact O-CB 3.26Å; P12-S15 PolarHBondContact O-N 3.09Å; P12-S15 PolarHBondContact O-OG 3.06Å; E13-S15 PolarHBondContact O-N 3.07Å
16Q67.7Low71Confident169 Ų169118.2 Ų118.279%0.7963%0.633SS**G310 helixtrans-84.6-10.1178.4-70-167-17.300114.3E13 S14E13-Q16 PolarHBondContact O-N 3.42Å; S14-Q16 PolarHBondContact O-N 2.74Å
17K84.4Confident72.4Confident159 Ų159111.7 Ų111.769%0.69161%0.612SS**SBendtrans-126.4142-178.1-66.6177.4-177172.20110.4S14 V19S14-K17 PolarHBondContact O-N 3.41Å; K17-V19 PolarHBondContact O-N 2.93Å
18P86.7Confident74.7Confident50 Ų50107.1 Ų107.133%0.32559%0.59SS.*  trans-66.4129172.528.9-33.8000109.8F30 T31 Y32P18-F30 HydrophobicContact CB-CB 4.09Å; P18-F30 HydrophobicContact CB-CD1 3.86Å; P18-F30 HydrophobicContact CB-CG 4.44Å; P18-F30 HydrophobicContact CG-CD1 3.84Å; P18-F30 HydrophobicContact CG-CE1 4.43Å; P18-T31 CarbonylContact C-O 3.58Å; P18-T31 WeakPolarHBondContact CA-O 3.36Å; P18-Y32 HydrophobicContact CB-CE1 4.21Å
19V89Confident77.2Confident83 Ų83107.8 Ų107.850%0.50358%0.58SS.*SBendtrans-67.7-37.9175.3-178.10000110.5K17 T31 E34K17-V19 PolarHBondContact O-N 2.93Å; V19-T31 PolarHBondContact N-O 3.31Å; V19-E34 HydrophobicContact CG1-CB 4.43Å
20K91.3Very high79.2Confident101 Ų101106.3 Ų106.344%0.43956%0.563SS.*EExtended strand (participates in β ladder)trans-133.1143.8173.6-164.6-169.5179.2-163.30109.9E22 T31K20-E22 WeakPolarHBondContact CE-OE2 3.5Å; K20-E22 IonicContact NZ-OE1 2.73Å; K20-E22 PolarHBondContact NZ-OE1 2.84Å; K20-E22 IonicContact NZ-OE2 3.89Å; K20-E22 PolarHBondContact NZ-OE2 3.01Å; K20-T31 PolarHBondContact N-O 2.8Å; K20-T31 PolarHBondContact O-N 3.06Å
21T91.4Very high81.5Confident79 Ų7996 Ų9649%0.48553%0.527SS..EExtended strand (participates in β ladder)trans-123.6133.3166.5-56.60000108.3V28 I29 F30T21-V28 HydrophobicContact CG2-CG1 3.54Å; T21-I29 WeakPolarHBondContact CA-O 2.97Å; T21-F30 HydrophobicContact CG2-CD1 3.81Å; T21-F30 HydrophobicContact CG2-CE1 3.5Å; T21-F30 HydrophobicContact CG2-CZ 4.3Å; T21-F30 WeakPolarHBondContact OG1-CD1 3.13Å
22E91.7Very high83.4Confident86 Ų8696.6 Ų96.640%0.40252%0.522SS..EExtended strand (participates in β ladder)trans-142.3144.2-172.7-178.2161.2-138.400111.1K20 V28 I29K20-E22 WeakPolarHBondContact CE-OE2 3.5Å; K20-E22 IonicContact NZ-OE1 2.73Å; K20-E22 PolarHBondContact NZ-OE1 2.84Å; K20-E22 IonicContact NZ-OE2 3.89Å; K20-E22 PolarHBondContact NZ-OE2 3.01Å; E22-V28 CarbonylContact O-C 3.48Å; E22-V28 WeakPolarHBondContact O-CA 3.28Å; E22-I29 PolarHBondContact N-O 2.99Å; E22-I29 PolarHBondContact O-N 2.97Å
23W94.9Very high85.2Confident181 Ų18196.2 Ų96.269%0.68651%0.513SS*.EExtended strand (participates in β ladder)trans-101.9124.8176.2175-102.7000110.1G26 S27 V28W23-G26 WeakPolarHBondContact CH2-O 3.44Å; W23-G26 VanDerWaalsContact CZ2-CA 3.48Å; W23-S27 WeakPolarHBondContact CA-O 3.39Å; W23-V28 HydrophobicContact CE3-CG2 3.77Å; W23-V28 HydrophobicContact CZ3-CG2 3.99Å
24N88.5Confident86.9Confident91 Ų9196.1 Ų96.149%0.48751%0.512SS..EExtended strand (participates in β ladder)trans-141.7125.3-178.9-173.89.6000111G26 S27 I29N24-G26 PolarHBondContact O-N 3.35Å; N24-S27 PolarHBondContact N-O 2.95Å; N24-S27 WeakPolarHBondContact O-CA 3.32Å; N24-S27 PolarHBondContact O-N 3.49Å; N24-S27 PolarHBondContact O-OG 2.73Å; N24-I29 HydrophobicContact CB-CD1 3.78Å; N24-I29 HydrophobicContact CB-CG1 4.47Å
25A86.9Confident88.6Confident102 Ų10294.9 Ų94.984%0.84351%0.513SS*.THydrogen-bonded Turntrans48.133.4170.100000116.6
26G93.5Very high90.4Very high57 Ų5797.5 Ų97.559%0.58852%0.522SS*.THydrogen-bonded Turntrans95.15.1-177.500000115.2W23 N24W23-G26 WeakPolarHBondContact CH2-O 3.44Å; W23-G26 VanDerWaalsContact CZ2-CA 3.48Å; N24-G26 PolarHBondContact O-N 3.35Å
27S88.5Confident91.6Very high59 Ų5995.1 Ų95.141%0.41351%0.514SS..EExtended strand (participates in β ladder)trans-125.8155.5-178.471.40000112.5W23 N24W23-S27 WeakPolarHBondContact CA-O 3.39Å; N24-S27 PolarHBondContact N-O 2.95Å; N24-S27 WeakPolarHBondContact O-CA 3.32Å; N24-S27 PolarHBondContact O-N 3.49Å; N24-S27 PolarHBondContact O-OG 2.73Å
28V94.7Very high92.2Very high73 Ų7393.4 Ų93.444%0.44251%0.512SS..EExtended strand (participates in β ladder)trans-102.3124.7169.5-175.80000108.7T21 E22 W23 F30T21-V28 HydrophobicContact CG2-CG1 3.54Å; E22-V28 CarbonylContact O-C 3.48Å; E22-V28 WeakPolarHBondContact O-CA 3.28Å; W23-V28 HydrophobicContact CE3-CG2 3.77Å; W23-V28 HydrophobicContact CZ3-CG2 3.99Å; V28-F30 HydrophobicContact CB-CE2 4.17Å; V28-F30 HydrophobicContact CB-CZ 4.35Å; V28-F30 HydrophobicContact CG1-CD1 4.44Å; V28-F30 HydrophobicContact CG1-CD2 4.23Å; V28-F30 HydrophobicContact CG1-CE1 3.91Å; V28-F30 HydrophobicContact CG1-CE2 3.66Å; V28-F30 HydrophobicContact CG1-CZ 3.49Å; V28-F30 VanDerWaalsContact CG1-CZ 3.49Å
29I94.4Very high92.6Very high67 Ų6794.5 Ų94.534%0.34452%0.521SS..EExtended strand (participates in β ladder)trans-100.9130.4175.7-59.2176.5000108.4T21 E22 N24T21-I29 WeakPolarHBondContact CA-O 2.97Å; E22-I29 PolarHBondContact N-O 2.99Å; E22-I29 PolarHBondContact O-N 2.97Å; N24-I29 HydrophobicContact CB-CD1 3.78Å; N24-I29 HydrophobicContact CB-CG1 4.47Å
30F94.7Very high92.9Very high107 Ų10793.6 Ų93.647%0.46951%0.512SS..EExtended strand (participates in β ladder)trans-115.3117.3176.8-65.5-74.7000109.9P18 T21 V28 Y32P18-F30 HydrophobicContact CB-CB 4.09Å; P18-F30 HydrophobicContact CB-CD1 3.86Å; P18-F30 HydrophobicContact CB-CG 4.44Å; P18-F30 HydrophobicContact CG-CD1 3.84Å; P18-F30 HydrophobicContact CG-CE1 4.43Å; T21-F30 HydrophobicContact CG2-CD1 3.81Å; T21-F30 HydrophobicContact CG2-CE1 3.5Å; T21-F30 HydrophobicContact CG2-CZ 4.3Å; T21-F30 WeakPolarHBondContact OG1-CD1 3.13Å; V28-F30 HydrophobicContact CB-CE2 4.17Å; V28-F30 HydrophobicContact CB-CZ 4.35Å; V28-F30 HydrophobicContact CG1-CD1 4.44Å; V28-F30 HydrophobicContact CG1-CD2 4.23Å; V28-F30 HydrophobicContact CG1-CE1 3.91Å; V28-F30 HydrophobicContact CG1-CE2 3.66Å; V28-F30 HydrophobicContact CG1-CZ 3.49Å; V28-F30 VanDerWaalsContact CG1-CZ 3.49Å; F30-Y32 HydrophobicContact CB-CE2 3.7Å
31T93.8Very high93.1Very high27 Ų2791.8 Ų91.817%0.16651%0.509CS..EExtended strand (participates in β ladder)trans-99.6127.2179.1-48.70000109.8P18 V19 K20 F33P18-T31 CarbonylContact C-O 3.58Å; P18-T31 WeakPolarHBondContact CA-O 3.36Å; V19-T31 PolarHBondContact N-O 3.31Å; K20-T31 PolarHBondContact N-O 2.8Å; K20-T31 PolarHBondContact O-N 3.06Å; T31-F33 HydrophobicContact CG2-CD1 3.8Å; T31-F33 HydrophobicContact CG2-CD2 4.21Å; T31-F33 HydrophobicContact CG2-CE1 3.64Å; T31-F33 HydrophobicContact CG2-CE2 4.06Å; T31-F33 HydrophobicContact CG2-CG 4.09Å; T31-F33 HydrophobicContact CG2-CZ 3.77Å
32Y94.5Very high93.3Very high136 Ų13693 Ų9353%0.53351%0.513SS..  trans-108.76-177.1-65.6-90.6000114P18 F30P18-Y32 HydrophobicContact CB-CE1 4.21Å; F30-Y32 HydrophobicContact CB-CE2 3.7Å
33F92.5Very high93.5Very high67 Ų6793.6 Ų93.629%0.29452%0.516SS..SBendtrans-118.2162.7173.362.7-93.8000110.5T31 I37 M40T31-F33 HydrophobicContact CG2-CD1 3.8Å; T31-F33 HydrophobicContact CG2-CD2 4.21Å; T31-F33 HydrophobicContact CG2-CE1 3.64Å; T31-F33 HydrophobicContact CG2-CE2 4.06Å; T31-F33 HydrophobicContact CG2-CG 4.09Å; T31-F33 HydrophobicContact CG2-CZ 3.77Å; F33-I37 HydrophobicContact CZ-CG1 4.2Å; F33-M40 HydrophobicContact CB-CG 4.46Å; F33-M40 HydrophobicContact CB-SD 3.8Å; F33-M40 HydrophobicContact CD1-CG 4.01Å; F33-M40 HydrophobicContact CD1-SD 4.29Å; F33-M40 HydrophobicContact CD2-CB 4.02Å; F33-M40 HydrophobicContact CD2-CG 4.16Å; F33-M40 HydrophobicContact CE1-CG 4.27Å; F33-M40 HydrophobicContact CE2-CB 4.08Å; F33-M40 HydrophobicContact CE2-CG 4.41Å; F33-M40 HydrophobicContact CG-CB 4.34Å; F33-M40 HydrophobicContact CG-CG 3.96Å; F33-M40 HydrophobicContact CG-SD 3.97Å; F33-M40 HydrophobicContact CZ-CB 4.43Å; F33-M40 HydrophobicContact CZ-CG 4.46Å
34E92.3Very high93.5Very high177 Ų17790.1 Ų90.183%0.82751%0.507SS*.  trans-109.3150.2174.7-172.5172.2-171.700109.7V19V19-E34 HydrophobicContact CG1-CB 4.43Å
35G91.9Very high93.8Very high60 Ų6091.8 Ų91.862%0.61951%0.51SS*.SBendtrans85.9-169.4-176.300000114.6
36D94.6Very high94.2Very high116 Ų11690.8 Ų90.862%0.6250%0.497SS*.  trans-75.2144.1-171.6-63.9-55000113.8N38 S39 M40D36-N38 VanDerWaalsContact C-N 3.25Å; D36-N38 PolarHBondContact O-N 3.2Å; D36-S39 PolarHBondContact O-N 3.1Å; D36-S39 VanDerWaalsContact O-N 3.12Å; D36-M40 PolarHBondContact O-N 3.17Å; D36-M40 VanDerWaalsContact O-N 3.12Å
37I94Very high94.3Very high120 Ų12094.4 Ų94.462%0.61549%0.492SS*.Hα-helixtrans-54-44.1175-54.5175.7000110.8F33 S39 M40 V41F33-I37 HydrophobicContact CZ-CG1 4.2Å; I37-S39 PolarHBondContact O-N 2.89Å; I37-M40 PolarHBondContact O-N 2.96Å; I37-V41 HydrophobicContact CG2-CG2 4.43Å; I37-V41 WeakPolarHBondContact O-CG2 3.38Å; I37-V41 PolarHBondContact O-N 2.88Å
38N95.9Very high94.6Very high122 Ų12294.5 Ų94.565%0.65250%0.497SS*.Hα-helixtrans-60.3-44.2179.9-63.5-19.8000111.6D36 M40 V41 D42D36-N38 VanDerWaalsContact C-N 3.25Å; D36-N38 PolarHBondContact O-N 3.2Å; N38-M40 PolarHBondContact O-N 3.25Å; N38-V41 PolarHBondContact O-N 3.47Å; N38-D42 WeakPolarHBondContact O-CB 3.31Å; N38-D42 PolarHBondContact O-N 2.95Å
39S95.2Very high94.5Very high73 Ų7396.1 Ų96.151%0.5150%0.503SS..Hα-helixtrans-64.7-40.4179.3-56.30000112.2D36 I37 D42 E43D36-S39 PolarHBondContact O-N 3.1Å; D36-S39 VanDerWaalsContact O-N 3.12Å; I37-S39 PolarHBondContact O-N 2.89Å; S39-D42 PolarHBondContact O-N 2.93Å; S39-E43 PolarHBondContact O-N 2.95Å
40M95.1Very high94.2Very high64 Ų64101.6 Ų101.632%0.31552%0.519SS..Hα-helixtrans-66.6-37.8175.3179.478.1-73.800111.9F33 D36 I37 N38 E43 H44F33-M40 HydrophobicContact CB-CG 4.46Å; F33-M40 HydrophobicContact CB-SD 3.8Å; F33-M40 HydrophobicContact CD1-CG 4.01Å; F33-M40 HydrophobicContact CD1-SD 4.29Å; F33-M40 HydrophobicContact CD2-CB 4.02Å; F33-M40 HydrophobicContact CD2-CG 4.16Å; F33-M40 HydrophobicContact CE1-CG 4.27Å; F33-M40 HydrophobicContact CE2-CB 4.08Å; F33-M40 HydrophobicContact CE2-CG 4.41Å; F33-M40 HydrophobicContact CG-CB 4.34Å; F33-M40 HydrophobicContact CG-CG 3.96Å; F33-M40 HydrophobicContact CG-SD 3.97Å; F33-M40 HydrophobicContact CZ-CB 4.43Å; F33-M40 HydrophobicContact CZ-CG 4.46Å; D36-M40 PolarHBondContact O-N 3.17Å; D36-M40 VanDerWaalsContact O-N 3.12Å; I37-M40 PolarHBondContact O-N 2.96Å; N38-M40 PolarHBondContact O-N 3.25Å; M40-E43 HydrophobicContact CE-CB 4.2Å; M40-E43 VanDerWaalsContact CE-OE2 3.31Å; M40-E43 WeakPolarHBondContact CE-OE2 3.46Å; M40-H44 WeakPolarHBondContact O-CB 3.42Å; M40-H44 PolarHBondContact O-N 2.65Å; M40-H44 VanDerWaalsContact O-N 3.12Å
41V96.1Very high93.3Very high64 Ų64102 Ų10239%0.38853%0.526SS..Hα-helixtrans-66-48.6173.61700000110.8I37 N38 E43 H44 F45I37-V41 HydrophobicContact CG2-CG2 4.43Å; I37-V41 WeakPolarHBondContact O-CG2 3.38Å; I37-V41 PolarHBondContact O-N 2.88Å; N38-V41 PolarHBondContact O-N 3.47Å; V41-E43 VanDerWaalsContact C-N 3.34Å; V41-E43 PolarHBondContact O-N 3.01Å; V41-H44 WeakPolarHBondContact O-CB 3.2Å; V41-H44 PolarHBondContact O-N 3.23Å; V41-H44 VanDerWaalsContact O-N 3.11Å; V41-F45 HydrophobicContact CG1-CD2 3.81Å; V41-F45 HydrophobicContact CG1-CE2 3.9Å; V41-F45 WeakPolarHBondContact O-CD2 3.38Å; V41-F45 PolarHBondContact O-N 2.62Å
42D96Very high92.6Very high105 Ų105106.7 Ų106.756%0.56155%0.55SS*.Hα-helixtrans-64.6-35.2-179.4-77.9-18.4000112.3N38 S39 S46N38-D42 WeakPolarHBondContact O-CB 3.31Å; N38-D42 PolarHBondContact O-N 2.95Å; S39-D42 PolarHBondContact O-N 2.93Å; D42-S46 WeakPolarHBondContact O-CB 3.43Å; D42-S46 PolarHBondContact O-N 3.05Å; D42-S46 PolarHBondContact O-OG 3.05Å
43E95.1Very high91.7Very high98 Ų98109 Ų10946%0.45856%0.562SS.*Hα-helixtrans-62.9-46.7170.3-165.6-138.7122.400111.1S39 M40 V41 F45 S46 R47S39-E43 PolarHBondContact O-N 2.95Å; M40-E43 HydrophobicContact CE-CB 4.2Å; M40-E43 VanDerWaalsContact CE-OE2 3.31Å; M40-E43 WeakPolarHBondContact CE-OE2 3.46Å; V41-E43 VanDerWaalsContact C-N 3.34Å; V41-E43 PolarHBondContact O-N 3.01Å; E43-F45 PolarHBondContact O-N 3Å; E43-S46 PolarHBondContact O-N 2.93Å; E43-R47 WeakPolarHBondContact O-CB 3.47Å; E43-R47 PolarHBondContact O-N 2.89Å; E43-R47 IonicContact OE1-NH1 2.96Å; E43-R47 PolarHBondContact OE1-NH1 3.04Å
44H95.5Very high90.3Very high107 Ų107116.5 Ų116.550%0.49559%0.589SS.*Hα-helixtrans-58-50.1178.7-178111.4000111.6M40 V41 R47 A48M40-H44 WeakPolarHBondContact O-CB 3.42Å; M40-H44 PolarHBondContact O-N 2.65Å; M40-H44 VanDerWaalsContact O-N 3.12Å; V41-H44 WeakPolarHBondContact O-CB 3.2Å; V41-H44 PolarHBondContact O-N 3.23Å; V41-H44 VanDerWaalsContact O-N 3.11Å; H44-R47 PolarHBondContact O-N 2.83Å; H44-A48 WeakPolarHBondContact O-CB 3.41Å; H44-A48 PolarHBondContact O-N 2.95Å
45F95.9Very high88.7Confident127 Ų127113.9 Ų113.956%0.55759%0.587SS**Hα-helixtrans-64.7-43.4178.9-86.9-102.9000111.5V41 E43 R47 A48 L49V41-F45 HydrophobicContact CG1-CD2 3.81Å; V41-F45 HydrophobicContact CG1-CE2 3.9Å; V41-F45 WeakPolarHBondContact O-CD2 3.38Å; V41-F45 PolarHBondContact O-N 2.62Å; E43-F45 PolarHBondContact O-N 3Å; F45-R47 VanDerWaalsContact C-N 3.33Å; F45-R47 PolarHBondContact O-N 3.26Å; F45-A48 PolarHBondContact O-N 3.27Å; F45-L49 WeakPolarHBondContact O-CB 3.39Å; F45-L49 WeakPolarHBondContact O-CG 3.43Å; F45-L49 PolarHBondContact O-N 2.96Å
46S94.9Very high86.6Confident80 Ų80118.9 Ų118.956%0.55959%0.594SS**Hα-helixtrans-59.9-42.8175.3-63.10000111.8D42 E43 L49 R50D42-S46 WeakPolarHBondContact O-CB 3.43Å; D42-S46 PolarHBondContact O-N 3.05Å; D42-S46 PolarHBondContact O-OG 3.05Å; E43-S46 PolarHBondContact O-N 2.93Å; S46-L49 PolarHBondContact O-N 3.2Å; S46-R50 VanDerWaalsContact O-CB 3.3Å; S46-R50 WeakPolarHBondContact O-CB 3.45Å; S46-R50 PolarHBondContact O-N 2.75Å
47R94.8Very high84.2Confident133 Ų133122.5 Ų122.550%0.50260%0.604SS.*Hα-helixtrans-67.1-38.6179-169.4174.677.6-166.410.2112.5E43 H44 F45E43-R47 WeakPolarHBondContact O-CB 3.47Å; E43-R47 PolarHBondContact O-N 2.89Å; E43-R47 IonicContact OE1-NH1 2.96Å; E43-R47 PolarHBondContact OE1-NH1 3.04Å; H44-R47 PolarHBondContact O-N 2.83Å; F45-R47 VanDerWaalsContact C-N 3.33Å; F45-R47 PolarHBondContact O-N 3.26Å
48A94.4Very high81.2Confident62 Ų62123.2 Ų123.251%0.51262%0.618SS.*Hα-helixtrans-66.4-46.1174.500000111.7H44 F45H44-A48 WeakPolarHBondContact O-CB 3.41Å; H44-A48 PolarHBondContact O-N 2.95Å; F45-A48 PolarHBondContact O-N 3.27Å
49L93.2Very high78.4Confident107 Ų107121.9 Ų121.956%0.5662%0.618SS**Hα-helixtrans-75.9-26.6-177.2-66175.1000113.7F45 S46 N51 L52F45-L49 WeakPolarHBondContact O-CB 3.39Å; F45-L49 WeakPolarHBondContact O-CG 3.43Å; F45-L49 PolarHBondContact O-N 2.96Å; S46-L49 PolarHBondContact O-N 3.2Å; L49-N51 PolarHBondContact O-N 3.27Å; L49-N51 VanDerWaalsContact O-N 3.13Å; L49-L52 HydrophobicContact CD2-CD2 3.85Å; L49-L52 VanDerWaalsContact O-CB 3.31Å; L49-L52 WeakPolarHBondContact O-CB 3.29Å; L49-L52 PolarHBondContact O-N 2.74Å
50R87.2Confident75.6Confident182 Ų182124.4 Ų124.469%0.68764%0.636SS**Hα-helixtrans-52.8-35.3177-174-173.670.8-1591.9113.2S46S46-R50 VanDerWaalsContact O-CB 3.3Å; S46-R50 WeakPolarHBondContact O-CB 3.45Å; S46-R50 PolarHBondContact O-N 2.75Å
51N77.1Confident73.1Confident115 Ų115126.8 Ų126.862%0.61566%0.659SS**THydrogen-bonded Turntrans-94.7-1-178.8-70.412.7000113.1L49 K53L49-N51 PolarHBondContact O-N 3.27Å; L49-N51 VanDerWaalsContact O-N 3.13Å; N51-K53 PolarHBondContact O-N 3.47Å
52L78.7Confident70.3Confident126 Ų126128.9 Ų128.966%0.6668%0.676SS**  trans-75.371.6176.4-171.863000110.3L49 R54L49-L52 HydrophobicContact CD2-CD2 3.85Å; L49-L52 VanDerWaalsContact O-CB 3.31Å; L49-L52 WeakPolarHBondContact O-CB 3.29Å; L49-L52 PolarHBondContact O-N 2.74Å; L52-R54 PolarHBondContact O-N 3.44Å
53K75.5Confident67.6Low184 Ų184131.3 Ų131.380%0.868%0.684SS**PPolyproline II helixtrans-51.9129.1160.2-69.7-175.5177.5-177.50107.2N51N51-K53 PolarHBondContact O-N 3.47Å
54R62.3Low65.2Low224 Ų224132.6 Ų132.685%0.84570%0.704SS**PPolyproline II helixtrans-48.8135.3162.9-65177.3-176.5159.41.6106.7L52 H56L52-R54 PolarHBondContact O-N 3.44Å; R54-H56 PolarHBondContact O-N 3Å
55P59Low63.3Low122 Ų122132.1 Ų132.179%0.79271%0.705SS**PPolyproline II helixtrans-55.3118168.924.4-32.1000106.3K57P55-K57 PolarHBondContact O-N 2.89Å; P55-K57 VanDerWaalsContact O-N 3.17Å
56H49.1Very low61Low166 Ų166131.9 Ų131.977%0.76971%0.71SS**PPolyproline II helixtrans-52.1129.1161.8-92.3-116.2000105.1R54 C58R54-H56 PolarHBondContact O-N 3Å; H56-C58 PolarHBondContact O-N 2.66Å
57K42.9Very low59.1Low192 Ų192135.8 Ų135.884%0.83572%0.723SS**PPolyproline II helixtrans-46.1137.4165.8-75.9-176.8174.5-178.80106.3P55 S59P55-K57 PolarHBondContact O-N 2.89Å; P55-K57 VanDerWaalsContact O-N 3.17Å; K57-S59 PolarHBondContact O-N 2.73Å
58C32.3Very low56.7Low135 Ų135135.4 Ų135.491%0.91274%0.736SS**  trans-6872.8171.1-65.50000109H56 S60H56-C58 PolarHBondContact O-N 2.66Å; C58-S60 VanDerWaalsContact C-N 3.26Å; C58-S60 PolarHBondContact O-N 3Å
59S35.7Very low55Low93 Ų93140.1 Ų140.165%0.6575%0.752SS**  trans-63.494.7164.949.80000106K57 S61K57-S59 PolarHBondContact O-N 2.73Å; S59-S61 PolarHBondContact O-N 2.89Å
60S37.1Very low53Low127 Ų127144.2 Ų144.289%0.88877%0.765SS**  trans-4097.7170.81720000110.3C58C58-S60 VanDerWaalsContact C-N 3.26Å; C58-S60 PolarHBondContact O-N 3Å
61S43Very low51.4Low113 Ų113143.3 Ų143.379%0.7977%0.774SS**  trans-131.9105.3175.4-171.50000106.5S59 H63S59-S61 PolarHBondContact O-N 2.89Å; S61-H63 PolarHBondContact O-N 3.24Å
62S35.7Very low49.8Very low108 Ų108141 Ų14176%0.75578%0.778SS**  trans-79109-171.149.60000111.1
63H40.8Very low48.4Very low157 Ų157141.9 Ų141.973%0.72779%0.788SS**  trans-142.286.5151-127.4-68.2000109.1S61 D65S61-H63 PolarHBondContact O-N 3.24Å; H63-D65 IonicContact CE1-OD1 2.69Å; H63-D65 PolarHBondContact CE1-OD1 3.49Å; H63-D65 VanDerWaalsContact CE1-OD1 3.28Å; H63-D65 IonicContact CG-OD1 2.6Å; H63-D65 VanDerWaalsContact ND1-CG 3.33Å; H63-D65 IonicContact ND1-OD1 3.92Å; H63-D65 PolarHBondContact ND1-OD1 3.26Å; H63-D65 IonicContact ND1-OD2 3.28Å; H63-D65 PolarHBondContact O-N 3.11Å
64S44.1Very low47.2Very low125 Ų125140.4 Ų140.487%0.87479%0.789SS**  trans-80.365.817955.20000110.5N66S64-N66 PolarHBondContact O-N 3.47Å
65D55.5Low46.7Very low97 Ų97139 Ų13952%0.51979%0.789SS.*  trans-83.5114.8-171.8-99.532.6000113.2H63H63-D65 IonicContact CE1-OD1 2.69Å; H63-D65 PolarHBondContact CE1-OD1 3.49Å; H63-D65 VanDerWaalsContact CE1-OD1 3.28Å; H63-D65 IonicContact CG-OD1 2.6Å; H63-D65 VanDerWaalsContact ND1-CG 3.33Å; H63-D65 IonicContact ND1-OD1 3.92Å; H63-D65 PolarHBondContact ND1-OD1 3.26Å; H63-D65 IonicContact ND1-OD2 3.28Å; H63-D65 PolarHBondContact O-N 3.11Å
66N47.9Very low46.1Very low122 Ų122138.5 Ų138.565%0.65278%0.783SS**  trans69.444138.2-49.8-38000118.1S64S64-N66 PolarHBondContact O-N 3.47Å
67L55.6Low45.8Very low161 Ų161139.7 Ų139.784%0.84378%0.781SS**  trans-116.574.6156.6-71179.6000111.4L69L67-L69 VanDerWaalsContact C-N 3.29Å; L67-L69 PolarHBondContact O-N 3.41Å
68T43Very low46Very low126 Ų126137.1 Ų137.177%0.77378%0.782SS**  trans-7371.3-176.6-47.40000112.7K70T68-K70 PolarHBondContact O-N 3.24Å
69L59.4Low46.4Very low160 Ų160135.9 Ų135.984%0.83877%0.766SS**  trans-75.186.4173.5-69.2179.6000111.2L67 N71L67-L69 VanDerWaalsContact C-N 3.29Å; L67-L69 PolarHBondContact O-N 3.41Å; L69-N71 PolarHBondContact O-N 2.8Å
70K50.7Low47.5Very low193 Ų193138.2 Ų138.284%0.83978%0.777SS**  trans-7375.7-176.6-175.9-175.4168.1-175.50113T68T68-K70 PolarHBondContact O-N 3.24Å
71N53.9Low47.9Very low163 Ų163137.4 Ų137.487%0.87277%0.771SS**  trans-144.5143.3166.4-74.7-39.1000108.4L69L69-N71 PolarHBondContact O-N 2.8Å
72G42.9Very low48Very low68 Ų68139.6 Ų139.670%0.70177%0.768SS**  cis169.6100.5-7.700000112.7
73V50.9Low48.9Very low144 Ų144140.4 Ų140.487%0.87377%0.769SS**  trans64.694.2163.8-169.90000119.5
74N48.9Very low49.2Very low152 Ų152138.3 Ų138.381%0.81376%0.763SS**  trans169.3133.6138.249.621000108.6
75K52Low49.6Very low195 Ų195143.3 Ų143.385%0.84876%0.763SS**  cis66.4116.422.6-111.7-173.3177.41790113.1
76T46.1Very low49.2Very low111 Ų111147 Ų14768%0.68178%0.777SS**  cis-153.9161.321.3-41.60000112.3
77R44Very low49.6Very low191 Ų191152.7 Ų152.772%0.72179%0.789SS**  trans-18.8143.9168.3-58.6157.570.2151.68.5117.7D79R77-D79 IonicContact CZ-OD1 2.66Å; R77-D79 IonicContact CZ-OD2 2.65Å; R77-D79 IonicContact NE-OD1 3Å; R77-D79 PolarHBondContact NE-OD1 2.97Å; R77-D79 IonicContact NE-OD2 3.2Å; R77-D79 PolarHBondContact NE-OD2 3.22Å; R77-D79 VanDerWaalsContact NH2-CG 3.28Å; R77-D79 IonicContact NH2-OD1 3.96Å; R77-D79 PolarHBondContact NH2-OD1 3.08Å; R77-D79 IonicContact NH2-OD2 2.71Å; R77-D79 PolarHBondContact NH2-OD2 2.82Å
78T46.5Very low49.2Very low139 Ų139153 Ų15385%0.85378%0.784SS**  trans-119.9109.7145.6-34.70000107.9
79D40.5Very low49.7Very low109 Ų109153.7 Ų153.758%0.58379%0.787SS**  trans-85.1136.5175.2-62.8-95.4000110.2R77R77-D79 IonicContact CZ-OD1 2.66Å; R77-D79 IonicContact CZ-OD2 2.65Å; R77-D79 IonicContact NE-OD1 3Å; R77-D79 PolarHBondContact NE-OD1 2.97Å; R77-D79 IonicContact NE-OD2 3.2Å; R77-D79 PolarHBondContact NE-OD2 3.22Å; R77-D79 VanDerWaalsContact NH2-CG 3.28Å; R77-D79 IonicContact NH2-OD1 3.96Å; R77-D79 PolarHBondContact NH2-OD1 3.08Å; R77-D79 IonicContact NH2-OD2 2.71Å; R77-D79 PolarHBondContact NH2-OD2 2.82Å
80T58.1Low49.2Very low142 Ų142152.6 Ų152.687%0.87178%0.778SS**  trans-123.5122.4169.3-41.60000108.8
81S45.9Very low49.2Very low109 Ų109148.5 Ų148.576%0.76277%0.774SS**  trans-104.9156.6-164.755.70000114.4
82H45.1Very low49.1Very low160 Ų160145.3 Ų145.374%0.74176%0.764SS**  trans62.6106.2146.6176.2-75.6000117.7
83T54.3Low49.1Very low124 Ų124150.3 Ų150.376%0.76177%0.769SS**  -138139.9103.143.20000109.9
84D47Very low48.7Very low114 Ų114149.1 Ų149.161%0.6176%0.763SS**  trans-85.7149.8177.2-166.7-6.5000111.3
85R52.9Low48.6Very low229 Ų229150.4 Ų150.486%0.86476%0.764SS**  trans-176.684.3158.3-107.7173.3-163.587.8-3.1111.4
86E48.4Very low48.5Very low175 Ų175148.4 Ų148.482%0.81876%0.763SS**  trans-57.5134.9161.9-58.2-175.1110.500111.7
87R55Low48.4Very low241 Ų241149.5 Ų149.591%0.90977%0.774SS**  trans-150.4106143.8-96.3-150.6-71.3-101.63.6111.4V89R87-V89 PolarHBondContact O-N 3.39Å
88K48.3Very low48.8Very low168 Ų168143.8 Ų143.873%0.7378%0.775SS**  trans-62.7122.8171.4-178.9-179.4-169.7-108.60111.2E90K88-E90 WeakPolarHBondContact CE-OE2 3.26Å; K88-E90 IonicContact NZ-OE2 3.68Å; K88-E90 PolarHBondContact NZ-OE2 3.27Å
89V53.7Low48.5Very low140 Ų140145.3 Ų145.385%0.84877%0.773SS**  trans-131.8131.1150.8-179.20000107.3R87R87-V89 PolarHBondContact O-N 3.39Å
90E48Very low49.2Very low137 Ų137145.7 Ų145.764%0.6477%0.774SS**  trans-123.1120.6-169.1173.5-178.9-175.200107.5K88K88-E90 WeakPolarHBondContact CE-OE2 3.26Å; K88-E90 IonicContact NZ-OE2 3.68Å; K88-E90 PolarHBondContact NZ-OE2 3.27Å
91S49.9Very low49.1Very low107 Ų107147.3 Ų147.375%0.74877%0.769SS**  trans-158.689.7174.1-75.40000110.9
92S52Low49Very low97 Ų97149.8 Ų149.868%0.67877%0.774SS**  trans30.6129.4135.6-46.10000121.2
93Q43Very low49.7Very low172 Ų172148 Ų14880%0.80477%0.774SS**  30.7132.7120-53.6172.5-81.200117.6
94T42.3Very low49.4Very low120 Ų120148 Ų14874%0.73678%0.776SS**  -150.3176.560.7280000115.4
95E47.9Very low50.2Low178 Ų178149 Ų14983%0.83279%0.786SS**  trans-86.6137.1-177.1-59.515196.300113.2
96N49Very low49.7Very low154 Ų154146.9 Ų146.982%0.82479%0.786SS**  trans-140.578.5168-68.7103.4000110.3G98N96-G98 PolarHBondContact O-N 3.07Å
97S43.8Very low49.9Very low133 Ų133147.5 Ų147.593%0.9379%0.789SS**  trans-67.5129.9165.9-170.70000109.4
98G53Low49.3Very low72 Ų72145.2 Ų145.274%0.74279%0.785SS**  trans-152.168.8-167.400000112.1N96N96-G98 PolarHBondContact O-N 3.07Å
99E41.2Very low49.1Very low170 Ų170139.9 Ų139.979%0.79478%0.779SS**  trans-54.2142.5166.3-174.5-172.4113.500110.9
100L54.6Low48.6Very low118 Ų118139.1 Ų139.162%0.61877%0.774SS**  161.5115.5128-82.4167.1000114.1
101K55.1Low48.6Very low176 Ų176139.6 Ų139.677%0.76578%0.781SS**  trans65.3116.8140.4-63.6169.3-178.7153.20120.6
102D44.5Very low48.4Very low161 Ų161143.9 Ų143.986%0.86179%0.786SS**  trans-57145.2160.6-56.5-101.9000113.8
103V60.5Low48Very low122 Ų122144.9 Ų144.974%0.73979%0.793SS**  trans-138.2121.9159.41800000108.2
104P48Very low48.7Very low125 Ų125144.4 Ų144.481%0.81279%0.793SS**PPolyproline II helixtrans-78.7122.8176.930.9-32.4000110.8
105V62.8Low49.6Very low134 Ų134143.9 Ų143.981%0.81279%0.792SS**PPolyproline II helixtrans-92.9127.9169168.70000109.3
106E43.8Very low50Low185 Ų185141 Ų14186%0.86479%0.788SS**PPolyproline II helixtrans-68.2133.4169.5-74.2-136129.400111.6
107E51.5Low50Low187 Ų187139.3 Ų139.387%0.87478%0.779SS**  trans-121.7126.7165.3-162.8-175.9150.600111.5G109E107-G109 PolarHBondContact O-N 3.38Å
108K42.1Very low50Low193 Ų193141.5 Ų141.584%0.83978%0.775SS**  trans-76.879.8-176.6-74.4-177.9173.11770113.2T110K108-T110 PolarHBondContact O-N 3.46Å
109G45.1Very low50.2Low57 Ų57147.9 Ų147.959%0.58878%0.777SS**  trans-74.3105169.500000113.3E107 N111E107-G109 PolarHBondContact O-N 3.38Å; G109-N111 PolarHBondContact O-N 2.82Å
110T42.1Very low50.2Low123 Ų123147 Ų14776%0.75577%0.772SS**  trans-80.573.2-172.5-56.90000113.3K108K108-T110 PolarHBondContact O-N 3.46Å
111N48.1Very low49.8Very low148 Ų148149.8 Ų149.879%0.79179%0.787SS**  trans-99.789.6-176.5-65.2-20.2000112G109 S113G109-N111 PolarHBondContact O-N 2.82Å; N111-S113 PolarHBondContact O-N 3.26Å
112K45.9Very low49.2Very low197 Ų197144.9 Ų144.986%0.85778%0.775SS**  trans-69.486.9174.8-69.7-175.3179.2-1800111.3M114K112-M114 PolarHBondContact O-N 2.97Å; K112-M114 VanDerWaalsContact O-N 3.14Å
113S44.7Very low49Very low118 Ų118142.2 Ų142.283%0.82577%0.768SS**  trans-64.6111.8172.7-169.50000110.3N111N111-S113 PolarHBondContact O-N 3.26Å
114M57.7Low48Very low161 Ų161147.6 Ų147.679%0.79378%0.776SS**PPolyproline II helixtrans-65145.6164.2-66.3-176.970.200109.4K112K112-M114 PolarHBondContact O-N 2.97Å; K112-M114 VanDerWaalsContact O-N 3.14Å
115P60.6Low47.8Very low109 Ų109147.5 Ų147.571%0.70877%0.773SS**PPolyproline II helixtrans-67.8148.4173.629.3-34.4000110.3N117P115-N117 PolarHBondContact O-N 3.5Å
116P55.9Low47.7Very low118 Ų118147.1 Ų147.177%0.76677%0.765SS**PPolyproline II helixtrans-60.6133.9170.127.1-33.3000109.5Q118P116-Q118 PolarHBondContact O-N 3.32Å
117N49.2Very low47.8Very low118 Ų118142.5 Ų142.563%0.63176%0.758SS**PPolyproline II helixtrans-55.4118.4-177.246.8-9000112.8P115 R119P115-N117 PolarHBondContact O-N 3.5Å; N117-R119 PolarHBondContact O-N 3.44Å
118Q44.8Very low47.6Very low180 Ų180141.7 Ų141.784%0.84176%0.755SS**  trans-6197.6162.7-72.5-177.4-11.300108.9P116 H120P116-Q118 PolarHBondContact O-N 3.32Å; Q118-H120 VanDerWaalsContact C-N 3.32Å; Q118-H120 PolarHBondContact O-N 3.12Å
119R55.6Low48.5Very low205 Ų205138.3 Ų138.377%0.77475%0.752SS**  trans-75.889.6171.8-75.9-172.4171.1-168.8-3.7108.7N117 L121N117-R119 PolarHBondContact O-N 3.44Å; R119-L121 PolarHBondContact O-N 2.94Å
120H42.7Very low48.6Very low152 Ų152140 Ų14070%0.70476%0.76SS**  trans-6594179.8-150.4-97.9000110Q118 S122Q118-H120 VanDerWaalsContact C-N 3.32Å; Q118-H120 PolarHBondContact O-N 3.12Å; H120-S122 WeakPolarHBondContact ND1-CB 3.47Å; H120-S122 PolarHBondContact ND1-OG 2.88Å; H120-S122 PolarHBondContact O-N 3.12Å; H120-S122 PolarHBondContact O-OG 3.28Å
121L44.9Very low48.4Very low177 Ų177139 Ų13993%0.92777%0.765SS**  trans-75.952.4174.4-76.7171.6000111.2R119 S123R119-L121 PolarHBondContact O-N 2.94Å; L121-S123 PolarHBondContact O-N 2.99Å
122S42.6Very low48Very low73 Ų73137.4 Ų137.451%0.5177%0.765SS.*  trans-74.6122.1174.136.40000111.1H120H120-S122 WeakPolarHBondContact ND1-CB 3.47Å; H120-S122 PolarHBondContact ND1-OG 2.88Å; H120-S122 PolarHBondContact O-N 3.12Å; H120-S122 PolarHBondContact O-OG 3.28Å
123S40.2Very low47.7Very low104 Ų104133.1 Ų133.173%0.72776%0.757SS**  trans7466.9154.6-460000117.9L121L121-S123 PolarHBondContact O-N 2.99Å
124W39.6Very low47.2Very low236 Ų236135.7 Ų135.789%0.89476%0.757SS**  trans-92.574.8145.8-166.8-82.8000109.9I126W124-I126 PolarHBondContact O-N 3.28Å
125T45Very low46.4Very low122 Ų122136.5 Ų136.575%0.74876%0.764SS**  trans-75.7107.5172.7-54.90000108.7A127T125-A127 PolarHBondContact O-N 2.97Å
126I60Low45.4Very low127 Ų127134.3 Ų134.365%0.65176%0.762SS**  trans-60.5120.9171.3-62.6176.4000108.1W124 Q128W124-I126 PolarHBondContact O-N 3.28Å; I126-Q128 PolarHBondContact O-N 3.2Å; I126-Q128 VanDerWaalsContact O-N 3.1Å
127A45Very low44.8Very low87 Ų87133.8 Ų133.872%0.71977%0.767SS**  trans-63.4112.6-179.400000110.3T125 P129T125-A127 PolarHBondContact O-N 2.97Å; A127-P129 VanDerWaalsContact O-CD 3.32Å; A127-P129 WeakPolarHBondContact O-CD 3.38Å
128Q48.7Very low44.4Very low171 Ų171139.5 Ų139.580%0.79978%0.78SS**PPolyproline II helixtrans-63.4121170.5-68.8-77.3-7300109I126 A130I126-Q128 PolarHBondContact O-N 3.2Å; I126-Q128 VanDerWaalsContact O-N 3.1Å; Q128-A130 PolarHBondContact O-N 2.98Å
129P59.3Low44.3Very low122 Ų122136.6 Ų136.679%0.79278%0.78SS**PPolyproline II helixtrans-63127.2167.5-18.833.1000108.9A127 A131A127-P129 VanDerWaalsContact O-CD 3.32Å; A127-P129 WeakPolarHBondContact O-CD 3.38Å; P129-A131 PolarHBondContact O-N 3.28Å
130A47.5Very low44Very low91 Ų91132 Ų13275%0.75278%0.779SS**PPolyproline II helixtrans-65.1135.5-172.700000112Q128 S132Q128-A130 PolarHBondContact O-N 2.98Å; A130-S132 PolarHBondContact O-N 3.44Å
131A38.2Very low44.2Very low104 Ų104129.5 Ų129.586%0.8678%0.778SS**PPolyproline II helixtrans-68.4124.6163.400000109.2P129P129-A131 PolarHBondContact O-N 3.28Å
132S39.1Very low44.4Very low113 Ų113127.8 Ų127.879%0.7977%0.769SS**  trans-145.9152.6168.6-91.40000109.7A130A130-S132 PolarHBondContact O-N 3.44Å
133P40.5Very low44.7Very low107 Ų107130.8 Ų130.870%0.69578%0.78SS**  trans-114177-141.141.7-35000114.9
134E35Very low44.9Very low173 Ų173132.7 Ų132.781%0.80878%0.777SS**  trans57.795.4141.9-164.8171.8-179.400118.3
135N40Very low45.4Very low177 Ų177130.8 Ų130.895%0.94777%0.771SS**  trans-119.560.6158.5-100.5-50000110.4A137N135-A137 PolarHBondContact O-N 2.96Å
136G38.9Very low45.1Very low64 Ų64128.7 Ų128.766%0.6677%0.774SS**  trans-86.698.2171.900000111.1
137A44.7Very low44.5Very low106 Ų106131.2 Ų131.288%0.87679%0.788SS**  trans-65.6134.5-177.800000112.4N135N135-A137 PolarHBondContact O-N 2.96Å
138R39.8Very low44.7Very low238 Ų238136.3 Ų136.390%0.89879%0.794SS**  trans-94.1171.3-178.5-102.3179.3168.8178.5-3.2112.8
139S44Very low44.6Very low120 Ų120132.3 Ų132.384%0.83979%0.79SS**  trans80.9144.7-179.978.60000114.8
140S48.2Very low44.2Very low109 Ų109134.9 Ų134.976%0.76279%0.793SS**  cis-130.7179.910.857.30000114.6
141S46Very low44.2Very low99 Ų99136.3 Ų136.369%0.69279%0.788SS**  trans-45162.8173.652.20000115.6
142L50.1Low44.4Very low141 Ų141139.4 Ų139.474%0.73879%0.785SS**  cis-160.7150.539.6-163.8117.4000113.7
143D48.6Very low44.6Very low136 Ų136142.4 Ų142.473%0.72779%0.786SS**  trans2.1149.1147.3-47-22.7000119.1
144E45.2Very low44.5Very low143 Ų143142.9 Ų142.967%0.66879%0.792SS**  cis-164.8-170.4-4.4174.9175-152.400107.1
145Y49.1Very low45.3Very low197 Ų197142.7 Ų142.777%0.77380%0.796SS**  trans72.787.6168.1-55.7-80.1000117
146G40.1Very low45.3Very low78 Ų78139.2 Ų139.280%0.80479%0.785SS**  trans-84.1155165.600000113.4
147L46.8Very low45.7Very low180 Ų180144.6 Ų144.694%0.94280%0.795SS**  trans-128.3158.4165.4-144.579.5000111
148K48.9Very low45.7Very low194 Ų194144.7 Ų144.784%0.84379%0.787SS**  trans-91.3131.2-173.7-74-80.9-170.2173.80112.5
149A47Very low45.9Very low87 Ų87142 Ų14272%0.71978%0.782SS**  trans53.3176.3132.600000120.8
150M50Low45.6Very low176 Ų176142.9 Ų142.987%0.86778%0.782SS**  trans75.3140.5177-54.6-163.678.900115.9
151D47.8Very low45.5Very low120 Ų120143.1 Ų143.164%0.64278%0.781SS**  cis-153.8170.1-25.3-162.114.2000110.7
152Q43.3Very low45.3Very low169 Ų169144.4 Ų144.479%0.7979%0.79SS**  trans-61.8142.1-178.6-57.5176.5-11.700113.6
153H42.1Very low45Very low177 Ų177142.4 Ų142.482%0.81979%0.794SS**  trans-15796.5147.428.8-75.8000110.4
154S39.3Very low44.7Very low117 Ų117143 Ų14382%0.81880%0.797SS**  trans-82.6116.5-179.6-59.30000111.9
155L52Low44.4Very low169 Ų169142.5 Ų142.589%0.88581%0.806SS**  trans-140.7136.6161.3-64.8173000107.4
156S39.6Very low44.2Very low104 Ų104140 Ų14073%0.72781%0.805SS**  cis180102.2-10.8176.60000103.1
157M48.1Very low44.5Very low176 Ų176143 Ų14387%0.86780%0.798SS**  trans-77.8146.7170-71.4-63.3-66.300108.6
158P43.7Very low44.5Very low109 Ų109138.9 Ų138.971%0.70878%0.782SS**  -149.8176.2104.838.6-23.2000116
159K43.1Very low45Very low180 Ų180141.1 Ų141.178%0.78379%0.785SS**  trans96.570141.1-149.4153.8-171167.50119.2
160T38.8Very low45.1Very low139 Ų139143.8 Ų143.885%0.85378%0.783SS**  trans-64.6146.7141.735.30000111.3
161P45.7Very low44.7Very low114 Ų114144.5 Ų144.574%0.7478%0.781SS**  trans-136.4133.2138.934.9-22.3000113.5
162S41.4Very low44.5Very low126 Ų126143.9 Ų143.988%0.88179%0.786SS**  trans10117154.3-171.50000119.6
163A44.2Very low44.1Very low100 Ų100141.8 Ų141.883%0.82679%0.79SS**  trans-135.9131.5152.700000110.6
164L43.2Very low44.3Very low148 Ų148141.2 Ų141.278%0.77579%0.793SS**  trans-32.9137.5-174.3-66154.3000118.1L166L164-L166 PolarHBondContact O-N 3.34Å
165P38.9Very low44.3Very low132 Ų132140 Ų14086%0.85779%0.789SS**  trans-84.8105.8169.233.2-30.2000110.9
166L44.4Very low43.6Very low145 Ų145143.4 Ų143.476%0.75979%0.79SS**  trans-152.968.2-172.1-131.1170.4000115.6L164L164-L166 PolarHBondContact O-N 3.34Å
167E45.3Very low43.8Very low141 Ų141143.2 Ų143.266%0.65979%0.787SS**  trans-173.2150.2132-97.3-112.399.800110H170E167-H170 IonicContact OE2-CD2 3.8Å; E167-H170 IonicContact OE2-CE1 3.59Å; E167-H170 IonicContact OE2-NE2 2.74Å; E167-H170 PolarHBondContact OE2-NE2 2.81Å
168P48.3Very low43.3Very low93 Ų93137.4 Ų137.460%0.60477%0.772SS**  trans-77.6166.917833.9-34.6000112.2H170P168-H170 PolarHBondContact O-CD2 3.11Å; P168-H170 PolarHBondContact O-N 3.12Å
169W59.7Low42.9Very low241 Ų241142.8 Ų142.891%0.91379%0.785SS**  trans-61.9109.3175.3-71.483.6000111.4F171W169-F171 PolarHBondContact O-N 3.34Å
170H47.3Very low42.8Very low143 Ų143140.9 Ų140.966%0.66278%0.782SS**  trans-6692.7175.1-82.4-100.6000111.1E167 P168 S172E167-H170 IonicContact OE2-CD2 3.8Å; E167-H170 IonicContact OE2-CE1 3.59Å; E167-H170 IonicContact OE2-NE2 2.74Å; E167-H170 PolarHBondContact OE2-NE2 2.81Å; P168-H170 PolarHBondContact O-CD2 3.11Å; P168-H170 PolarHBondContact O-N 3.12Å; H170-S172 PolarHBondContact O-N 3.47Å
171F41.5Very low42.9Very low192 Ų192138 Ų13884%0.84277%0.771SS**  trans-70.896.8166.1-94.4-89.8000109.8W169 S173W169-F171 PolarHBondContact O-N 3.34Å; F171-S173 PolarHBondContact O-N 2.89Å; F171-S173 VanDerWaalsContact O-N 3.09Å
172S44.1Very low43Very low106 Ų106138.8 Ų138.874%0.74178%0.777SS**  trans-52.7114175.5-63.90000111.4H170 L174H170-S172 PolarHBondContact O-N 3.47Å; S172-L174 PolarHBondContact O-N 2.92Å; S172-L174 VanDerWaalsContact O-N 3.08Å
173S36.4Very low42.9Very low125 Ų125137 Ų13787%0.87477%0.77SS**  trans-67.4104.5179.8-690000111.6F171F171-S173 PolarHBondContact O-N 2.89Å; F171-S173 VanDerWaalsContact O-N 3.09Å
174L44.4Very low42.6Very low166 Ų166141.8 Ų141.887%0.86977%0.768SS**PPolyproline II helixtrans-86.9136.1160-96.570.7000110.3S172S172-L174 PolarHBondContact O-N 2.92Å; S172-L174 VanDerWaalsContact O-N 3.08Å
175A39.7Very low42.3Very low91 Ų91144.2 Ų144.275%0.75277%0.772SS**PPolyproline II helixtrans-47.7147.6-166.400000116.8P177A175-P177 VanDerWaalsContact O-CD 3.25Å; A175-P177 WeakPolarHBondContact O-CD 3.48Å
176R38.2Very low42.4Very low240 Ų240143 Ų14391%0.90676%0.764SS**PPolyproline II helixtrans-47.1121.6170.2-67.5163.762.8-153.94.1112.6
177P43.5Very low42.3Very low101 Ų101142.1 Ų142.166%0.65677%0.765SS**PPolyproline II helixtrans-81.5128.3144.4-3.123.6000108.1A175 I180A175-P177 VanDerWaalsContact O-CD 3.25Å; A175-P177 WeakPolarHBondContact O-CD 3.48Å; P177-I180 HydrophobicContact CB-CD1 3.91Å; P177-I180 HydrophobicContact CB-CG1 4.35Å
178G36.5Very low41.9Very low53 Ų53144.6 Ų144.655%0.54677%0.774SS.*PPolyproline II helixtrans-77.1144.416700000110.8I180G178-I180 PolarHBondContact O-N 3.4Å
179F35.3Very low41.7Very low223 Ų223146.1 Ų146.198%0.97878%0.784SS**  trans33.568.4162.5-71.7-86.9000116.6
180I43Very low40.8Very low140 Ų140142.1 Ų142.172%0.71878%0.78SS**  trans-84.9114162.7-61.4-178.5000107.8P177 G178P177-I180 HydrophobicContact CB-CD1 3.91Å; P177-I180 HydrophobicContact CB-CG1 4.35Å; G178-I180 PolarHBondContact O-N 3.4Å
181A40.3Very low40.6Very low77 Ų77145 Ų14564%0.63679%0.786SS**  trans-66.2159.4175.600000111.4A183A181-A183 PolarHBondContact O-N 2.95Å
182P46.9Very low40.4Very low132 Ų132144.4 Ų144.486%0.85779%0.785SS**  trans-57.8111.6-176-25.335.3000112.7
183A40Very low40.4Very low89 Ų89147.3 Ų147.374%0.73679%0.791SS**  trans-71.8142.6172.500000110.6A181A181-A183 PolarHBondContact O-N 2.95Å
184Y37.3Very low40.5Very low199 Ų199147.6 Ų147.678%0.7879%0.788SS**  trans-63.6141.7-176-97-115.8000113.7P186Y184-P186 HydrophobicContact CD1-CB 4.39Å; Y184-P186 HydrophobicContact CD1-CG 4.42Å
185F38.2Very low40.7Very low199 Ų199145.1 Ų145.187%0.87378%0.782SS**  trans-132.9110.3139.3-79.3-73.5000109.3
186P40.7Very low40.9Very low106 Ų106147.8 Ų147.869%0.68878%0.778SS**  trans-88.3108.4178.432.6-29.2000110.5Y184Y184-P186 HydrophobicContact CD1-CB 4.39Å; Y184-P186 HydrophobicContact CD1-CG 4.42Å
187V40.9Very low41.2Very low128 Ų128141.8 Ų141.878%0.77677%0.769SS**  trans-127.2145.2170.4-1760000109.2
188F38.6Very low41.2Very low192 Ų192145.2 Ų145.284%0.84277%0.769SS**  trans-58143.3-158.6-62-93.7000115.8D190F188-D190 PolarHBondContact O-N 2.71Å
189P43.7Very low41.4Very low125 Ų125152 Ų15281%0.81278%0.779SS**  trans-83.678178.435.1-35.3000111.3
190D41.2Very low42Very low158 Ų158147 Ų14785%0.84577%0.766SS**  trans-81.8136.7168.8-131.6-22.5000111.8F188F188-D190 PolarHBondContact O-N 2.71Å
191R42.5Very low42Very low204 Ų204148 Ų14877%0.7777%0.765SS**SBendtrans-76.7147.3-149.2-55.6170.3173.4-175.9-3.8114.4
192H37.1Very low42.2Very low179 Ų179149.2 Ų149.283%0.82977%0.767SS**SBendtrans74.931.8155.8-58.2-61.7000120.3
193L44Very low41.8Very low167 Ų167149.9 Ų149.987%0.87476%0.763SS**  trans-126.9110.8156.9-69.8174.6000111
194T39.2Very low42Very low131 Ų131156.6 Ų156.680%0.80477%0.77SS**  trans-78.1123.6172.641.40000110.3E196T194-E196 PolarHBondContact O-N 3.26Å
195P47Very low42.1Very low114 Ų114155.8 Ų155.874%0.7477%0.773SS**  trans-68.7119.7173.8-18.131.9000111V197P195-V197 HydrophobicContact CB-CG2 4.23Å; P195-V197 PolarHBondContact O-N 3.38Å
196E45.3Very low42.4Very low146 Ų146153.8 Ų153.868%0.68277%0.77SS**  trans-74.487.6170.5-66.2-163.6150.300110.2T194 Y198T194-E196 PolarHBondContact O-N 3.26Å; E196-Y198 VanDerWaalsContact C-N 3.34Å; E196-Y198 HydrophobicContact CB-CD2 4.04Å; E196-Y198 HydrophobicContact CB-CE2 3.56Å; E196-Y198 HydrophobicContact CG-CE2 4.41Å; E196-Y198 WeakPolarHBondContact O-CD2 3.37Å; E196-Y198 PolarHBondContact O-N 2.94Å; E196-Y198 WeakPolarHBondContact OE2-CE2 3.33Å; E196-Y198 PolarHBondContact OE2-OH 3.32Å
197V45Very low42.1Very low115 Ų115153.4 Ų153.470%0.69777%0.766SS**  trans-80.181.1178.3-1740000110.2P195 R199P195-V197 HydrophobicContact CB-CG2 4.23Å; P195-V197 PolarHBondContact O-N 3.38Å; V197-R199 PolarHBondContact O-N 3.44Å
198Y42.7Very low42.4Very low172 Ų172153.1 Ų153.168%0.67577%0.767SS**  trans-64.297.3172.9-71.4-83.4000111.4E196 V200E196-Y198 VanDerWaalsContact C-N 3.34Å; E196-Y198 HydrophobicContact CB-CD2 4.04Å; E196-Y198 HydrophobicContact CB-CE2 3.56Å; E196-Y198 HydrophobicContact CG-CE2 4.41Å; E196-Y198 WeakPolarHBondContact O-CD2 3.37Å; E196-Y198 PolarHBondContact O-N 2.94Å; E196-Y198 WeakPolarHBondContact OE2-CE2 3.33Å; E196-Y198 PolarHBondContact OE2-OH 3.32Å; Y198-V200 VanDerWaalsContact C-N 3.31Å; Y198-V200 PolarHBondContact O-N 2.88Å
199R41.3Very low42.4Very low197 Ų197149.3 Ų149.374%0.74375%0.751SS**  trans-74.286.4163.4-72.8-172.1177.8-85.6-0.3109.4V197 F201V197-R199 PolarHBondContact O-N 3.44Å; R199-F201 VanDerWaalsContact C-N 3.35Å; R199-F201 HydrophobicContact CB-CD2 4.35Å; R199-F201 HydrophobicContact CB-CE2 4.01Å; R199-F201 WeakPolarHBondContact O-CD2 3.46Å; R199-F201 PolarHBondContact O-N 3.42Å
200V47.9Very low42.1Very low118 Ų118149 Ų14972%0.71575%0.747SS**  trans-68.194.6169.6-176.80000108.6Y198Y198-V200 VanDerWaalsContact C-N 3.31Å; Y198-V200 PolarHBondContact O-N 2.88Å
201F41.7Very low42Very low159 Ų159150 Ų15070%0.69774%0.74SS**  trans-75128.5159.8-69.4-87000108.1R199R199-F201 VanDerWaalsContact C-N 3.35Å; R199-F201 HydrophobicContact CB-CD2 4.35Å; R199-F201 HydrophobicContact CB-CE2 4.01Å; R199-F201 WeakPolarHBondContact O-CD2 3.46Å; R199-F201 PolarHBondContact O-N 3.42Å
202P44.9Very low42Very low103 Ų103147.3 Ų147.367%0.66974%0.736SS**SBendtrans-62154.2159.529.4-33000109.3
203D38.6Very low42.1Very low146 Ų146145 Ų14578%0.78173%0.734SS**SBendtrans63.254.7167.2-50.3-29.9000118
204R44.7Very low42Very low231 Ų231145.1 Ų145.187%0.87273%0.728SS**SBendtrans-160.4157139.9-97.9128.5-151.3-113.62112.9L206R204-L206 PolarHBondContact O-N 2.96Å
205H40.1Very low42.2Very low182 Ų182143.9 Ų143.984%0.84372%0.722SS**  trans-59.9116.1-175.6-60.4-87.1000112.1T207H205-T207 VanDerWaalsContact C-N 3.35Å; H205-T207 PolarHBondContact O-N 3.14Å
206L42.8Very low41.8Very low156 Ų156146.2 Ų146.282%0.81773%0.729SS**  trans-76.580.9176.6-72.1167.4000111.4R204R204-L206 PolarHBondContact O-N 2.96Å
207T35.2Very low41.7Very low99 Ų99149 Ų14961%0.60773%0.733SS**  trans-65.1130.2148.6400000108.4H205 E209H205-T207 VanDerWaalsContact C-N 3.35Å; H205-T207 PolarHBondContact O-N 3.14Å; T207-E209 PolarHBondContact O-N 3.11Å
208P46.7Very low41.3Very low121 Ų121152.9 Ų152.979%0.78674%0.743SS**  trans-74.777.1179.230.6-34.8000110.6V210P208-V210 PolarHBondContact O-N 2.82Å
209E39.9Very low41.6Very low112 Ų112151.5 Ų151.552%0.52375%0.746SS.*  trans-74.3103.4170.9-66.7-163.914600109.2T207 Y211T207-E209 PolarHBondContact O-N 3.11Å; E209-Y211 VanDerWaalsContact C-N 3.33Å; E209-Y211 HydrophobicContact CB-CD2 3.93Å; E209-Y211 HydrophobicContact CB-CE2 3.46Å; E209-Y211 VanDerWaalsContact CB-CE2 3.46Å; E209-Y211 HydrophobicContact CG-CE2 4.42Å; E209-Y211 VanDerWaalsContact O-CD2 3.26Å; E209-Y211 WeakPolarHBondContact O-CD2 3.48Å; E209-Y211 PolarHBondContact O-N 2.94Å; E209-Y211 VanDerWaalsContact OE2-CE2 3.29Å; E209-Y211 WeakPolarHBondContact OE2-CE2 3.47Å; E209-Y211 VanDerWaalsContact OE2-CZ 3.3Å; E209-Y211 PolarHBondContact OE2-OH 3.13Å
210V36.6Very low41.5Very low119 Ų119148.2 Ų148.272%0.72175%0.749SS**  trans-74.687.1176.1-178.40000109.1P208 H212P208-V210 PolarHBondContact O-N 2.82Å; V210-H212 PolarHBondContact O-N 3.17Å
211Y39.8Very low41.6Very low178 Ų178147.9 Ų147.970%0.69875%0.749SS**  trans-69.597.7174.1-78.2-87.9000110.7E209 V213E209-Y211 VanDerWaalsContact C-N 3.33Å; E209-Y211 HydrophobicContact CB-CD2 3.93Å; E209-Y211 HydrophobicContact CB-CE2 3.46Å; E209-Y211 VanDerWaalsContact CB-CE2 3.46Å; E209-Y211 HydrophobicContact CG-CE2 4.42Å; E209-Y211 VanDerWaalsContact O-CD2 3.26Å; E209-Y211 WeakPolarHBondContact O-CD2 3.48Å; E209-Y211 PolarHBondContact O-N 2.94Å; E209-Y211 VanDerWaalsContact OE2-CE2 3.29Å; E209-Y211 WeakPolarHBondContact OE2-CE2 3.47Å; E209-Y211 VanDerWaalsContact OE2-CZ 3.3Å; E209-Y211 PolarHBondContact OE2-OH 3.13Å; Y211-V213 PolarHBondContact O-N 3.25Å
212H41.3Very low41.5Very low148 Ų148147.9 Ų147.969%0.68575%0.751SS**  trans-6694.6165.9-81.8-64.6000110.2V210 F214V210-H212 PolarHBondContact O-N 3.17Å; H212-F214 VanDerWaalsContact C-N 3.35Å; H212-F214 HydrophobicContact CB-CD2 4.32Å; H212-F214 HydrophobicContact CB-CE2 3.99Å; H212-F214 WeakPolarHBondContact O-CD2 3.4Å; H212-F214 PolarHBondContact O-N 2.91Å
213V39.6Very low41.5Very low131 Ų131148.7 Ų148.779%0.79475%0.754SS**  trans-71.391.4170-177.80000108.7Y211Y211-V213 PolarHBondContact O-N 3.25Å
214F41Very low41.6Very low170 Ų170149.1 Ų149.175%0.74675%0.746SS**  trans-67.8125.6166.1-73-88.4000109.3H212H212-F214 VanDerWaalsContact C-N 3.35Å; H212-F214 HydrophobicContact CB-CD2 4.32Å; H212-F214 HydrophobicContact CB-CE2 3.99Å; H212-F214 WeakPolarHBondContact O-CD2 3.4Å; H212-F214 PolarHBondContact O-N 2.91Å
215P43.9Very low42.1Very low104 Ų104144.7 Ų144.768%0.67575%0.747SS**SBendtrans-63.7153.4162.828.6-32.9000110.1
216D39.6Very low42.9Very low164 Ų164140.5 Ų140.588%0.87773%0.731SS**SBendtrans64.240.4164.8-51.3-22.9000117.9
217R42.1Very low43.4Very low203 Ų203136.5 Ų136.577%0.76673%0.727SS**  trans-134.5118.6152.3-64.8-167.6-178.3-141.7-1.6112.6L219R217-L219 VanDerWaalsContact C-N 3.32Å; R217-L219 HydrophobicContact CB-CD1 4.43Å; R217-L219 HydrophobicContact CB-CG 4.08Å; R217-L219 PolarHBondContact O-N 2.96Å
218H37.3Very low44.4Very low198 Ų198140.1 Ų140.192%0.91773%0.729SS**  trans-69.988.3165.3-75.1-87.6000109.7
219L48.7Very low44.5Very low142 Ų142140.6 Ų140.674%0.74373%0.734SS**  trans-105.796.1169.7-63.4179000108.7R217R217-L219 VanDerWaalsContact C-N 3.32Å; R217-L219 HydrophobicContact CB-CD1 4.43Å; R217-L219 HydrophobicContact CB-CG 4.08Å; R217-L219 PolarHBondContact O-N 2.96Å
220T40.4Very low45.2Very low129 Ų129138 Ų13879%0.79174%0.737SS**  trans-54.9127.9161.8300000108.9E222T220-E222 PolarHBondContact O-N 2.8Å
221P50Low46.3Very low110 Ų110137.1 Ų137.171%0.71473%0.734SS**  trans-58.1121.5168.4-21.432.9000108.8V223P221-V223 HydrophobicContact CB-CG2 4.4Å; P221-V223 PolarHBondContact O-N 2.66Å
222E39.2Very low47.1Very low159 Ų159134.9 Ų134.974%0.74373%0.733SS**  trans-75.184.8174.7-168.3174.5-119.300108.6T220 Y224T220-E222 PolarHBondContact O-N 2.8Å; E222-Y224 VanDerWaalsContact C-N 3.35Å; E222-Y224 HydrophobicContact CG-CD2 4.42Å; E222-Y224 HydrophobicContact CG-CE2 4.27Å; E222-Y224 PolarHBondContact O-N 2.92Å; E222-Y224 WeakPolarHBondContact OE2-CE2 3.49Å
223V45.2Very low47.9Very low121 Ų121134.4 Ų134.473%0.73373%0.732SS**  trans-70.893.6176.2-178.80000108.2P221P221-V223 HydrophobicContact CB-CG2 4.4Å; P221-V223 PolarHBondContact O-N 2.66Å
224Y40.4Very low48.6Very low155 Ų155135.2 Ų135.261%0.60873%0.726SS**  trans-52.9135.1163.5-86.6-107.2000108.8E222 D226 G227E222-Y224 VanDerWaalsContact C-N 3.35Å; E222-Y224 HydrophobicContact CG-CD2 4.42Å; E222-Y224 HydrophobicContact CG-CE2 4.27Å; E222-Y224 PolarHBondContact O-N 2.92Å; E222-Y224 WeakPolarHBondContact OE2-CE2 3.49Å; Y224-D226 PolarHBondContact O-N 3.27Å; Y224-G227 PolarHBondContact O-N 2.94Å
225P53.7Low49.3Very low138 Ų138132.2 Ų132.290%0.89672%0.718SS**THydrogen-bonded Turntrans-67.66.6-176.228.6-36.4000114.4
226D56.8Low50Low94 Ų94132.2 Ų132.250%0.50372%0.715SS.*THydrogen-bonded Turntrans-108.36.7-175.7-158.8-0.2000112.1Y224 R228Y224-D226 PolarHBondContact O-N 3.27Å; D226-R228 PolarHBondContact O-N 3.31Å; D226-R228 IonicContact OD1-CZ 2.76Å; D226-R228 IonicContact OD1-NH1 3.37Å; D226-R228 PolarHBondContact OD1-NH1 2.93Å; D226-R228 IonicContact OD1-NH2 3.19Å; D226-R228 IonicContact OD2-CZ 3.34Å; D226-R228 IonicContact OD2-NH1 3.46Å; D226-R228 PolarHBondContact OD2-NH1 2.76Å; D226-R228 IonicContact OD2-NH2 3.28Å; D226-R228 PolarHBondContact OD2-NH2 3.37Å
227G54.7Low50.9Low71 Ų71129.9 Ų129.973%0.73270%0.699SS**  trans66.20.2166.200000117.6Y224Y224-G227 PolarHBondContact O-N 2.94Å
228R55.5Low51.5Low176 Ų176126.6 Ų126.666%0.66469%0.692SS**  trans-96.5115.8179.9-65.1-169.3-59.6-73.6-2.3111.4D226 G230D226-R228 PolarHBondContact O-N 3.31Å; D226-R228 IonicContact OD1-CZ 2.76Å; D226-R228 IonicContact OD1-NH1 3.37Å; D226-R228 PolarHBondContact OD1-NH1 2.93Å; D226-R228 IonicContact OD1-NH2 3.19Å; D226-R228 IonicContact OD2-CZ 3.34Å; D226-R228 IonicContact OD2-NH1 3.46Å; D226-R228 PolarHBondContact OD2-NH1 2.76Å; D226-R228 IonicContact OD2-NH2 3.28Å; D226-R228 PolarHBondContact OD2-NH2 3.37Å; R228-G230 PolarHBondContact O-N 2.98Å
229C49.1Very low52.2Low130 Ų130123.1 Ų123.188%0.87868%0.681SS**PPolyproline II helixtrans-62.6118.2165.8-610000109.6
230G54.9Low52.4Low58 Ų58124.9 Ų124.960%0.59868%0.678SS**PPolyproline II helixtrans-68.3142.717600000111.8R228 L232R228-G230 PolarHBondContact O-N 2.98Å; G230-L232 PolarHBondContact O-N 2.86Å
231P58.6Low53Low101 Ų101127.3 Ų127.366%0.65667%0.674SS**PPolyproline II helixtrans-59.2136.4176-2434.1000112.2Q233P231-Q233 HydrophobicContact CB-CG 4.19Å; P231-Q233 PolarHBondContact O-N 3.19Å
232L58.2Low53.3Low130 Ų130129.8 Ų129.868%0.68168%0.675SS**G310 helixtrans-66.714.2-178.1-62.6174.8000115.1G230 H234 L235G230-L232 PolarHBondContact O-N 2.86Å; L232-H234 VanDerWaalsContact C-N 3.25Å; L232-H234 PolarHBondContact O-N 2.71Å; L232-L235 WeakPolarHBondContact O-CB 3.2Å; L232-L235 PolarHBondContact O-N 3Å; L232-L235 VanDerWaalsContact O-N 3.11Å
233Q57.5Low53.6Low139 Ų139128.6 Ų128.665%0.6567%0.674SS**G310 helixtrans-63.8-26.3-174.7-66.3-172.3-800113.6P231P231-Q233 HydrophobicContact CB-CG 4.19Å; P231-Q233 PolarHBondContact O-N 3.19Å
234H54.3Low53.8Low148 Ų148129.4 Ų129.469%0.68567%0.67SS**G310 helixtrans-67.5-35.4174.2-63.1154.2000112.8L232 V236 Q237 Q238L232-H234 VanDerWaalsContact C-N 3.25Å; L232-H234 PolarHBondContact O-N 2.71Å; H234-V236 PolarHBondContact O-N 3.12Å; H234-Q237 PolarHBondContact O-N 2.97Å; H234-Q238 PolarHBondContact O-N 2.83Å
235L54.6Low54.2Low107 Ų107126.4 Ų126.456%0.5667%0.669SS**Hα-helixtrans-64.9-44.1-175.9-17058.4000111.5L232 Q237 Q238L232-L235 WeakPolarHBondContact O-CB 3.2Å; L232-L235 PolarHBondContact O-N 3Å; L232-L235 VanDerWaalsContact O-N 3.11Å; L235-Q237 PolarHBondContact O-N 3.44Å; L235-Q238 PolarHBondContact O-N 3.28Å
236V58.2Low54.2Low103 Ų103123.9 Ų123.962%0.62465%0.648SS**Hα-helixtrans-68.9-4.4-178.9-172.10000113.4H234 R240H234-V236 PolarHBondContact O-N 3.12Å; V236-R240 PolarHBondContact O-NH2 2.69Å; V236-R240 VanDerWaalsContact O-NH2 3.08Å
237Q59.4Low53.7Low115 Ų115125.6 Ų125.654%0.53765%0.653SS.*Hα-helixtrans-108.3-24.1178.6-63.4-177.41400113.2H234 L235H234-Q237 PolarHBondContact O-N 2.97Å; L235-Q237 PolarHBondContact O-N 3.44Å
238Q55.7Low53.2Low134 Ų134124.8 Ų124.863%0.62663%0.634SS**Hα-helixtrans-73.8-40.2-176.4-74.4-173.8-17.700113.9H234 L235 R240 Y241H234-Q238 PolarHBondContact O-N 2.83Å; L235-Q238 PolarHBondContact O-N 3.28Å; Q238-R240 PolarHBondContact O-N 2.98Å; Q238-Y241 PolarHBondContact O-N 3.35Å
239D50.7Low52.8Low126 Ų126121.3 Ų121.367%0.67464%0.643SS**G310 helixtrans-59.6-23.4-176.8-78.1-32000114.5
240R54.1Low53.1Low179 Ų179119 Ų11968%0.67563%0.634SS**G310 helixtrans-84-4.2-175.5-77.5-176.3-77.9153.8-4.3115.1V236 Q238V236-R240 PolarHBondContact O-NH2 2.69Å; V236-R240 VanDerWaalsContact O-NH2 3.08Å; Q238-R240 PolarHBondContact O-N 2.98Å
241Y52Low53Low180 Ų180126.1 Ų126.171%0.70664%0.643SS**G310 helixtrans-121.311.6-174-80-75.8000115.5Q238Q238-Y241 PolarHBondContact O-N 3.35Å
242Q56.6Low52.6Low161 Ų161127.5 Ų127.575%0.75264%0.64SS**SBendtrans-119.27.4-175.1-68.1-63.8-59.500115.1
243N45.1Very low52Low135 Ų135128.8 Ų128.872%0.72265%0.648SS**  trans-129.677-172.3-70.9-73.2000113.1
244H49.2Very low51.1Low137 Ų137128.2 Ų128.263%0.63466%0.658SS**  trans-153.4112.6159.220.7-84.3000109.6
245P49.5Very low50.8Low93 Ų93126.9 Ų126.960%0.60467%0.665SS**  trans-80.6165.4179.9-9.727000113.6Y272P245-Y272 HydrophobicContact CB-CD1 4.41Å; P245-Y272 HydrophobicContact CB-CD2 3.52Å; P245-Y272 HydrophobicContact CB-CE1 4.31Å; P245-Y272 HydrophobicContact CB-CE2 3.42Å; P245-Y272 VanDerWaalsContact CB-CE2 3.42Å; P245-Y272 HydrophobicContact CB-CG 4.06Å; P245-Y272 HydrophobicContact CG-CE2 4.05Å
246L53.3Low50.5Low84 Ų84127.8 Ų127.844%0.4468%0.677SS.*  trans-120-175.1-176.6-75.836.8000109.4P270 P271 Y272L246-P270 HydrophobicContact CD2-CB 3.59Å; L246-P270 HydrophobicContact CG-CB 4.47Å; L246-P271 HydrophobicContact CB-CB 3.84Å; L246-Y272 WeakPolarHBondContact O-CB 3.15Å; L246-Y272 WeakPolarHBondContact O-CD2 3.31Å
247E46.4Very low50.3Low131 Ų131127.1 Ų127.161%0.61268%0.683SS**  trans-143.1136.7173.8-80.8-60.2157.100113.4P271 P273E247-P271 VanDerWaalsContact O-CB 3.28Å; E247-P271 WeakPolarHBondContact O-CB 3.32Å; E247-P271 WeakPolarHBondContact O-CG 3.42Å; E247-P273 VanDerWaalsContact OE1-CB 3.31Å; E247-P273 WeakPolarHBondContact OE1-CB 3.31Å; E247-P273 WeakPolarHBondContact OE2-CB 3.3Å; E247-P273 WeakPolarHBondContact OE2-CG 3.18Å
248P44.2Very low50.1Low53 Ų53131.1 Ų131.134%0.34470%0.698SS.*  trans-120115.5178.331-13.7000114.7P271 Y272 P273P248-P271 HydrophobicContact CB-CB 3.6Å; P248-P271 HydrophobicContact CB-CG 3.67Å; P248-P271 HydrophobicContact CG-CB 3.78Å; P248-P271 HydrophobicContact CG-CG 4.41Å; P248-Y272 VanDerWaalsContact CG-O 3.26Å; P248-Y272 WeakPolarHBondContact CG-O 3.5Å; P248-P273 HydrophobicContact CG-CG 4.28Å
249A47.4Very low49.9Very low103 Ų103132.3 Ų132.385%0.85171%0.707SS**  trans-163.9156.114600000109.9
250A54.3Low50.1Low82 Ų82130.7 Ų130.768%0.67871%0.712SS**  cis-178.8137.3-34.800000105.7
251R54.5Low49.8Very low208 Ų208126.1 Ų126.179%0.78572%0.72SS**  trans68.4152.9175.8-45176.869.7-166.3-8113.3
252E48.6Very low49.5Very low129 Ų129122.7 Ų122.760%0.60372%0.722SS**  cis-160-178.9-13.3-122.4152-137.900110.2
253N47.6Very low49.3Very low158 Ų158121.8 Ų121.885%0.84573%0.728SS**  trans79.9107.3170.5-56-44000118
254C38.1Very low49.4Very low126 Ų126118.6 Ų118.685%0.85173%0.727SS**  trans-94.8151.9169.7-51.30000111.3
255S46.5Very low49.5Very low121 Ų121117.6 Ų117.685%0.84674%0.735SS**  trans-137.2104.6156.754.70000110.3
256P49.8Very low49.4Very low125 Ų125119.8 Ų119.881%0.81274%0.741SS**  trans-96.4134.5-174.934.5-31.7000112.6
257A52.9Low49.2Very low89 Ų89122.5 Ų122.574%0.73675%0.753SS**  trans-150.8115.8165.900000112.4
258K56.2Low49.3Very low200 Ų200122.6 Ų122.687%0.8776%0.758SS**  trans60127.3136.7-65.1-173.2-179.6-176.30117.2
259I50.7Low49.6Very low158 Ų158127.2 Ų127.281%0.8178%0.779SS**  cis-150.9143.422.9-62.7-175.1000112
260A54.8Low49.2Very low93 Ų93126.5 Ų126.577%0.76977%0.766SS**  trans35.2123.4155.600000124.3
261G49.2Very low48.9Very low82 Ų82125.6 Ų125.685%0.84575%0.753SS**  trans90.1143.1137.200000118.2
262S44.2Very low48.3Very low108 Ų108122.7 Ų122.776%0.75574%0.743SS**  cis-161133.6-15.3-170.90000111.7
263T54.3Low48.3Very low142 Ų142119.1 Ų119.187%0.87173%0.731SS**  trans64.7117.4156.9-48.20000120.3
264G46Very low48.3Very low69 Ų69117 Ų11771%0.71172%0.724SS**  trans105.697.7169.300000113.5
265S50.6Low48.7Very low115 Ų115120.2 Ų120.280%0.80473%0.726SS**  61.2123.669.3-1510000112.4
266L48Very low48.8Very low139 Ų139124 Ų12473%0.72872%0.723SS**  cis-155.6131.426.4-175.373.6000112.8
267M50.2Low49.3Very low141 Ų141127.7 Ų127.770%0.69573%0.726SS**  trans40120.8152.8-49.6-47.2168.700121.3
268N47Very low50Low133 Ų133131 Ų13171%0.71172%0.724SS**  67.3149.886.4-57.6-23.7000115.9
269L50.2Low50.6Low150 Ų150130.5 Ų130.579%0.78572%0.722SS**  cis-165.8169.9-17.6-100.4175000106.4
270P40.1Very low51Low88 Ų88129.5 Ų129.557%0.57172%0.717SS**  trans-79.3-71.6-164.4-2.315000122.4L246L246-P270 HydrophobicContact CD2-CB 3.59Å; L246-P270 HydrophobicContact CG-CB 4.47Å
271P48.3Very low50.9Low64 Ų64130.5 Ų130.542%0.41672%0.717SS.*  -99-164.6-123.9-2.922.2000121.8L246 E247 P248L246-P271 HydrophobicContact CB-CB 3.84Å; E247-P271 VanDerWaalsContact O-CB 3.28Å; E247-P271 WeakPolarHBondContact O-CB 3.32Å; E247-P271 WeakPolarHBondContact O-CG 3.42Å; P248-P271 HydrophobicContact CB-CB 3.6Å; P248-P271 HydrophobicContact CB-CG 3.67Å; P248-P271 HydrophobicContact CG-CB 3.78Å; P248-P271 HydrophobicContact CG-CG 4.41Å
272Y40.7Very low50.9Low146 Ų146131.7 Ų131.757%0.57372%0.719SS**  trans-95.4-133.4-161.6-156.834.6000113.4P245 L246 P248P245-Y272 HydrophobicContact CB-CD1 4.41Å; P245-Y272 HydrophobicContact CB-CD2 3.52Å; P245-Y272 HydrophobicContact CB-CE1 4.31Å; P245-Y272 HydrophobicContact CB-CE2 3.42Å; P245-Y272 VanDerWaalsContact CB-CE2 3.42Å; P245-Y272 HydrophobicContact CB-CG 4.06Å; P245-Y272 HydrophobicContact CG-CE2 4.05Å; L246-Y272 WeakPolarHBondContact O-CB 3.15Å; L246-Y272 WeakPolarHBondContact O-CD2 3.31Å; P248-Y272 VanDerWaalsContact CG-O 3.26Å; P248-Y272 WeakPolarHBondContact CG-O 3.5Å
273P48.7Very low51.2Low54 Ų54138 Ų13835%0.35173%0.726SS.*  cis-139.9-168.9-7.745-23.4000118.6E247 P248E247-P273 VanDerWaalsContact OE1-CB 3.31Å; E247-P273 WeakPolarHBondContact OE1-CB 3.31Å; E247-P273 WeakPolarHBondContact OE2-CB 3.3Å; E247-P273 WeakPolarHBondContact OE2-CG 3.18Å; P248-P273 HydrophobicContact CG-CG 4.28Å
274V47.7Very low50.5Low114 Ų114135.1 Ų135.169%0.69172%0.724SS**  trans62.9152.4164.2-68.20000123.1
275H45.8Very low50.6Low193 Ų193136.3 Ų136.389%0.89473%0.728SS**  trans-50.9142.4-175.7-65.1-91.4000117.1
276Y49.1Very low50.3Low201 Ų201135.4 Ų135.479%0.78873%0.727SS**  trans-129.2128151.764.3-94.8000112K278Y276-K278 HydrophobicContact CD2-CB 4.03Å; Y276-K278 HydrophobicContact CE2-CB 4.23Å; Y276-K278 PolarHBondContact O-N 2.6Å
277K59.9Low50.1Low203 Ų203135 Ų13588%0.88374%0.736SS**  trans-9777.3179.4-169.7173.8-175.9171.90110.5K279K277-K279 PolarHBondContact O-N 3.48Å
278K67.8Low50.3Low159 Ų159132.5 Ų132.569%0.69174%0.737SS**  trans-69.1100.5-174.6-166.2172.6-175.41760112Y276 I280Y276-K278 HydrophobicContact CD2-CB 4.03Å; Y276-K278 HydrophobicContact CE2-CB 4.23Å; Y276-K278 PolarHBondContact O-N 2.6Å; K278-I280 HydrophobicContact CD-CG1 4.38Å; K278-I280 HydrophobicContact CG-CG1 4.09Å
279K70.1Confident50.4Low188 Ų188131.5 Ų131.582%0.81774%0.741SS**  trans-73.1133.3157.7-70.5-175.1177.4-177.70108.5K277K277-K279 PolarHBondContact O-N 3.48Å
280I58.4Low50.7Low137 Ų137131 Ų13170%0.70374%0.739SS**  trans-111.5111.8169.3-59178.9000107.3K278K278-I280 HydrophobicContact CD-CG1 4.38Å; K278-I280 HydrophobicContact CG-CG1 4.09Å
281C52.2Low51.4Low115 Ų115133.7 Ų133.778%0.77775%0.748SS**  trans-95.5123.1167.3-670000108.1R283C281-R283 PolarHBondContact O-N 3.5Å
282A50Low51.6Low106 Ų106138.6 Ų138.688%0.87677%0.771SS**  trans-69121.9172.600000109.6
283R49Very low52.2Low241 Ų241139.1 Ų139.191%0.90978%0.778SS**  trans-116.594.3175.8-172.1-177-174.7-146.40.6109.1C281C281-R283 PolarHBondContact O-N 3.5Å
284G41.1Very low52.4Low81 Ų81146.7 Ų146.784%0.83580%0.8SS**  trans-83.8120.3175.900000112.2
285A46.8Very low52.7Low95 Ų95145.6 Ų145.679%0.78580%0.797SS**  trans-177.9143.3163.100000107.6
286A45.9Very low53Low96 Ų96142 Ų14279%0.79379%0.791SS**  cis-152.7158.2-18.600000107.4
287S43.6Very low53.1Low131 Ų131137.8 Ų137.892%0.91679%0.791SS**  trans-73150.3175.338.30000111.8
288A54.6Low52.9Low87 Ų87133 Ų13372%0.71978%0.781SS**  trans-144.9126.7-17800000112.7
289S47.8Very low52.4Low113 Ų113134.1 Ų134.179%0.7979%0.786SS**  trans72.4148.6149.7108.80000115.8
290L56.9Low51.7Low140 Ų140136.1 Ų136.173%0.73379%0.788SS**  cis-143.9155.30.6-101.3151.8000109.7
291D55Low51.8Low144 Ų144140.9 Ų140.977%0.7780%0.797SS**  trans16.4131147.4-48.9-10.1000121.2
292D52.3Low52.1Low166 Ų166145.4 Ų145.489%0.88880%0.798SS**  -141.7156.2100.9-161.79.8000109.7
293E52.9Low52.7Low158 Ų158146.6 Ų146.674%0.73879%0.789SS**  trans-113.4172.1-173.5-145.5-79.8102.200110.8
294R52.5Low53.4Low213 Ų213139 Ų13980%0.80478%0.779SS**  trans132.2104141.8-164168.1-169.6153.84.5116.1
295S54.2Low54.4Low90 Ų90145.6 Ų145.663%0.62978%0.78SS**  trans71.4102.2144.1-59.50000120.4
296P52.2Low54.9Low119 Ų119150.4 Ų150.477%0.77378%0.779SS**  trans-91.5177.9156.537.4-33.7000112.5
297S52.4Low55.7Low111 Ų111159.2 Ų159.278%0.77679%0.793SS**  trans100.8158.6163.3-53.80000117.8
298P54.6Low56.3Low103 Ų103160.6 Ų160.667%0.66979%0.787SS**  cis-145.8-169.1-42.342.2-25.6000114.8
299K57.3Low56.4Low183 Ų183164.5 Ų164.580%0.79679%0.791SS**  trans72.6103.1151.5-75.3171.9-176.1171.90119.6
300R55.3Low56.8Low229 Ų229167.3 Ų167.386%0.86479%0.791SS**  40.6112.9114.1-63.617164.8114-4.5117.7
301R62.3Low56.8Low237 Ų237168.9 Ų168.989%0.89479%0.794SS**  trans-144.8142.9133.8-131.4171.8171.2154.5-2.7111
302R57Low57Low211 Ų211170.5 Ų170.580%0.79680%0.796SS**  trans-92.2172.3158.7-62.2175.1-174164-1.9107
303D63.7Low57.3Low130 Ų130170.8 Ų170.870%0.69579%0.79SS**  148.3117.9128.5-68.1-23.8000112
304A63.9Low57.6Low83 Ų83171.7 Ų171.769%0.68679%0.793SS**  trans59.3165.8173.600000116
305Y60.7Low58Low218 Ų218168.5 Ų168.586%0.85579%0.793SS**  cis-143.6155.916-77.7-90000109.4
306Y58.6Low58.3Low196 Ų196175.1 Ų175.177%0.76981%0.806SS**  cis-152.5-52.6-11.7-177.1-107.7000113.1
307Y61.4Low58.8Low281 Ų281180.2 Ų180.2100%1.10281%0.809SS**  trans-148.50179.6-109.2-94.5000109.6

Retrieved 307 of 307 residues in 438.3 ms (Link to these results)