A0A096ML12_PAPAN Loading...

Cdc42 effector protein 2

Probably involved in the organization of the actin cytoskeleton.

AlphaFold DB , UniProt , Accession A0A096ML12, Species PAPAN (Papio anubis, Olive baboon), Gene CDC42EP2, Length 210 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
1M56.3Low73.6Confident241 Ų241139.7 Ų139.7100%1.18769%0.691SS**  0113.90-67.1-73.8178.200107.7
2S62.4Low73.2Confident122 Ų122133.7 Ų133.785%0.85369%0.691SS**  trans-77.9120.7175.8-176.70000108.7K4S2-K4 PolarHBondContact O-N 3.12Å; S2-K4 VanDerWaalsContact O-N 3.17Å
3T66.5Low72.8Confident122 Ų122128.8 Ų128.875%0.74868%0.675SS**  trans-68.4111.2178.952.10000108.8V5T3-V5 PolarHBondContact O-N 3.24Å; T3-V5 VanDerWaalsContact O-N 3.08Å
4K77.9Confident72.8Confident207 Ų207135.7 Ų135.790%0.969%0.688SS**  trans-63.2112.2176.1-89.2178.8174.6173.40109.1S2S2-K4 PolarHBondContact O-N 3.12Å; S2-K4 VanDerWaalsContact O-N 3.17Å
5V78.6Confident72.3Confident93 Ų93141.3 Ų141.356%0.56471%0.706SS**  trans-71.4132.3171.7179.60000108.5T3 L9T3-V5 PolarHBondContact O-N 3.24Å; T3-V5 VanDerWaalsContact O-N 3.08Å; V5-L9 HydrophobicContact CG1-CB 3.77Å; V5-L9 HydrophobicContact CG1-CD1 4.19Å
6P80.6Confident72.3Confident50 Ų50137.8 Ų137.833%0.32572%0.716SS.*  trans-55141.4176-21.927.5000112.8Y8 L9 K10P6-Y8 HydrophobicContact CB-CD1 3.63Å; P6-Y8 HydrophobicContact CB-CD2 4.35Å; P6-Y8 HydrophobicContact CB-CE1 3.13Å; P6-Y8 HydrophobicContact CB-CE2 3.93Å; P6-Y8 HydrophobicContact CB-CG 4.21Å; P6-Y8 HydrophobicContact CG-CE1 3.98Å; P6-Y8 HydrophobicContact CG-CE2 4.38Å; P6-Y8 WeakPolarHBondContact CG-OH 3.44Å; P6-Y8 PolarHBondContact O-N 3.47Å; P6-L9 HydrophobicContact CG-CD1 4.26Å; P6-L9 WeakPolarHBondContact O-CB 3.23Å; P6-L9 PolarHBondContact O-N 3.35Å; P6-K10 PolarHBondContact O-N 3.06Å
7I80.7Confident72.4Confident150 Ų150139.5 Ų139.577%0.76972%0.717SS**G310 helixtrans-60.8-33.4-173.8-60.5170.5000111.7L9 K10I7-L9 PolarHBondContact O-N 3.13Å; I7-K10 WeakPolarHBondContact O-CB 3.37Å; I7-K10 PolarHBondContact O-N 3.27Å
8Y77Confident72.6Confident181 Ų181142.3 Ų142.371%0.7172%0.723SS**G310 helixtrans-66.2-21.1177.458.8-99.6000113.6P6P6-Y8 HydrophobicContact CB-CD1 3.63Å; P6-Y8 HydrophobicContact CB-CD2 4.35Å; P6-Y8 HydrophobicContact CB-CE1 3.13Å; P6-Y8 HydrophobicContact CB-CE2 3.93Å; P6-Y8 HydrophobicContact CB-CG 4.21Å; P6-Y8 HydrophobicContact CG-CE1 3.98Å; P6-Y8 HydrophobicContact CG-CE2 4.38Å; P6-Y8 WeakPolarHBondContact CG-OH 3.44Å; P6-Y8 PolarHBondContact O-N 3.47Å
9L80.8Confident72.8Confident30 Ų30138.1 Ų138.116%0.15770%0.7CS.*G310 helixtrans-87.7-12.7171.5-63.4-177.7000112.7V5 P6 I7 R11 L25V5-L9 HydrophobicContact CG1-CB 3.77Å; V5-L9 HydrophobicContact CG1-CD1 4.19Å; P6-L9 HydrophobicContact CG-CD1 4.26Å; P6-L9 WeakPolarHBondContact O-CB 3.23Å; P6-L9 PolarHBondContact O-N 3.35Å; I7-L9 PolarHBondContact O-N 3.13Å; L9-R11 VanDerWaalsContact C-N 3.35Å; L9-R11 PolarHBondContact O-N 2.97Å; L9-R11 VanDerWaalsContact O-N 3.09Å; L9-L25 HydrophobicContact CD2-CD1 4.09Å; L9-L25 HydrophobicContact CD2-CD2 3.46Å; L9-L25 VanDerWaalsContact CD2-CD2 3.46Å; L9-L25 HydrophobicContact CD2-CG 3.68Å
10K75.4Confident73.4Confident168 Ų168136.5 Ų136.573%0.7369%0.688SS**  trans-87.676.3-176.4-169.6175.7177.9177.50109.4P6 I7P6-K10 PolarHBondContact O-N 3.06Å; I7-K10 WeakPolarHBondContact O-CB 3.37Å; I7-K10 PolarHBondContact O-N 3.27Å
11R73.4Confident73.9Confident173 Ų173135.2 Ų135.265%0.65368%0.683SS**  trans-84.1146.7167.7-170.3177.7-158.9169.77.3109.2L9 S13 E19 L24L9-R11 VanDerWaalsContact C-N 3.35Å; L9-R11 PolarHBondContact O-N 2.97Å; L9-R11 VanDerWaalsContact O-N 3.09Å; R11-S13 PolarHBondContact O-N 3.26Å; R11-E19 WeakPolarHBondContact CB-OE1 3.48Å; R11-E19 WeakPolarHBondContact CB-OE2 3.38Å; R11-L24 HydrophobicContact CB-CD2 3.85Å
12G68.9Low75.4Confident67 Ų67132.5 Ų132.569%0.69166%0.659SS**  trans-66.899.8178.700000110.4R14G12-R14 PolarHBondContact O-N 3.16Å
13S67.5Low76.5Confident70 Ų70131.8 Ų131.849%0.4965%0.646SS.*  trans-59.1103.1172.6172.30000109.4R11 K15 K17R11-S13 PolarHBondContact O-N 3.26Å; S13-K15 PolarHBondContact O-N 3.02Å; S13-K17 PolarHBondContact OG-O 2.63Å
14R72.7Confident77.4Confident226 Ų226127.5 Ų127.585%0.85362%0.618SS**  trans-60.7126.1169.6-76.2-172.8-88.8179.7-5.6108G12 G16 K17G12-R14 PolarHBondContact O-N 3.16Å; R14-G16 PolarHBondContact O-N 3.2Å; R14-G16 VanDerWaalsContact O-N 3.16Å; R14-K17 PolarHBondContact O-N 3.03Å
15K65.3Low77.9Confident220 Ų220120.2 Ų120.296%0.95759%0.589SS**THydrogen-bonded Turntrans-35112.9-170.3-161.6168.1-178.5175.60112.3S13S13-K15 PolarHBondContact O-N 3.02Å
16G72.1Confident78.4Confident85 Ų85118.2 Ų118.288%0.87658%0.579SS**THydrogen-bonded Turntrans108.7-12.1170.200000117.3R14R14-G16 PolarHBondContact O-N 3.2Å; R14-G16 VanDerWaalsContact O-N 3.16Å
17K74.4Confident78.8Confident166 Ų166120.9 Ų120.972%0.72260%0.599SS**  trans-120.2105.4179.8-162.1172.4-179179.80111.7S13 R14 E19S13-K17 PolarHBondContact OG-O 2.63Å; R14-K17 PolarHBondContact O-N 3.03Å; K17-E19 PolarHBondContact O-N 3.31Å; K17-E19 VanDerWaalsContact O-N 3.08Å
18K75.8Confident79.4Confident191 Ų191120.2 Ų120.283%0.8360%0.597SS**  trans-61.9108.8166.453.4-178.8177.5178.50108.6K20K18-K20 PolarHBondContact O-N 3.06Å
19E77.6Confident80.2Confident61 Ų61116.7 Ų116.729%0.28559%0.588SS.*  trans-65.6126.817054.3-169.9177.300108.5R11 K17 L24R11-E19 WeakPolarHBondContact CB-OE1 3.48Å; R11-E19 WeakPolarHBondContact CB-OE2 3.38Å; K17-E19 PolarHBondContact O-N 3.31Å; K17-E19 VanDerWaalsContact O-N 3.08Å; E19-L24 HydrophobicContact CB-CD1 4.43Å; E19-L24 HydrophobicContact CB-CG 4.23Å; E19-L24 VanDerWaalsContact CD-CD2 3.47Å; E19-L24 HydrophobicContact CG-CD1 3.68Å; E19-L24 HydrophobicContact CG-CD2 4.19Å; E19-L24 HydrophobicContact CG-CG 3.96Å; E19-L24 WeakPolarHBondContact OE2-CD2 3.49Å
20K83.9Confident80.6Confident106 Ų106120.2 Ų120.246%0.46161%0.606SS.*  trans-75.8144.2177.6-64177.5-179.9173.20107.1K18 R22 D23 L24K18-K20 PolarHBondContact O-N 3.06Å; K20-R22 HydrophobicContact CB-CG 3.86Å; K20-R22 PolarHBondContact O-N 3.3Å; K20-R22 VanDerWaalsContact O-N 3.08Å; K20-D23 WeakPolarHBondContact O-CA 3.01Å; K20-D23 WeakPolarHBondContact O-CB 3.41Å; K20-D23 PolarHBondContact O-N 2.72Å; K20-L24 PolarHBondContact O-N 3.14Å
21L84.7Confident81.5Confident111 Ų111115.6 Ų115.658%0.58160%0.595SS**Hα-helixtrans-53.6-33.5176.8-71.5174.2000112.5D23 L24 L25L21-D23 PolarHBondContact O-N 2.76Å; L21-L24 HydrophobicContact CD2-CD1 4.43Å; L21-L24 PolarHBondContact O-N 3.21Å; L21-L24 VanDerWaalsContact O-N 3.09Å; L21-L25 WeakPolarHBondContact O-CB 3.19Å; L21-L25 PolarHBondContact O-N 2.97Å
22R86.6Confident82.5Confident184 Ų184112.2 Ų112.269%0.69460%0.595SS**Hα-helixtrans-61.2-27.5174.577.6-178.885.3161.3-3.9114.4K20K20-R22 HydrophobicContact CB-CG 3.86Å; K20-R22 PolarHBondContact O-N 3.3Å; K20-R22 VanDerWaalsContact O-N 3.08Å
23D85.3Confident83.7Confident106 Ų106115 Ų11557%0.56760%0.601SS**Hα-helixtrans-88-16178.9-56.1-22.9000110.9K20 L21K20-D23 WeakPolarHBondContact O-CA 3.01Å; K20-D23 WeakPolarHBondContact O-CB 3.41Å; K20-D23 PolarHBondContact O-N 2.72Å; L21-D23 PolarHBondContact O-N 2.76Å
24L86.1Confident84.8Confident32 Ų32117.9 Ų117.917%0.16861%0.611CS.*Hα-helixtrans-96.8-37.8179.1-76.6179.4000113R11 E19 K20 L21 M29R11-L24 HydrophobicContact CB-CD2 3.85Å; E19-L24 HydrophobicContact CB-CD1 4.43Å; E19-L24 HydrophobicContact CB-CG 4.23Å; E19-L24 VanDerWaalsContact CD-CD2 3.47Å; E19-L24 HydrophobicContact CG-CD1 3.68Å; E19-L24 HydrophobicContact CG-CD2 4.19Å; E19-L24 HydrophobicContact CG-CG 3.96Å; E19-L24 WeakPolarHBondContact OE2-CD2 3.49Å; K20-L24 PolarHBondContact O-N 3.14Å; L21-L24 HydrophobicContact CD2-CD1 4.43Å; L21-L24 PolarHBondContact O-N 3.21Å; L21-L24 VanDerWaalsContact O-N 3.09Å; L24-M29 WeakPolarHBondContact O-CE 3.4Å
25L88.1Confident85.8Confident54 Ų54109.5 Ų109.528%0.28359%0.594SS.*  trans-101.6108.2-178.7-73.5175.2000109.7L9 L21 M29L9-L25 HydrophobicContact CD2-CD1 4.09Å; L9-L25 HydrophobicContact CD2-CD2 3.46Å; L9-L25 VanDerWaalsContact CD2-CD2 3.46Å; L9-L25 HydrophobicContact CD2-CG 3.68Å; L21-L25 WeakPolarHBondContact O-CB 3.19Å; L21-L25 PolarHBondContact O-N 2.97Å; L25-M29 HydrophobicContact CD2-CE 4.09Å
26S89.6Confident87.2Confident52 Ų52104.2 Ų104.236%0.36458%0.577SS.*  trans-80154.8167.6550000110.6D28 M29S26-D28 VanDerWaalsContact C-N 3.27Å; S26-D28 WeakPolarHBondContact CB-OD1 3.47Å; S26-D28 PolarHBondContact O-N 3.28Å; S26-D28 PolarHBondContact OG-OD1 3.05Å; S26-M29 PolarHBondContact O-N 2.83Å; S26-M29 VanDerWaalsContact O-N 3.11Å; S26-M29 WeakPolarHBondContact OG-CE 3.21Å; S26-M29 WeakPolarHBondContact OG-CG 3.43Å
27S89.5Confident88.1Confident106 Ų106108.5 Ų108.574%0.74157%0.572SS**G310 helixtrans-63.4-29.6-174.3-550000113.7M29 I30S27-M29 VanDerWaalsContact C-N 3.28Å; S27-M29 PolarHBondContact O-N 3.32Å; S27-I30 PolarHBondContact O-N 3.18Å; S27-I30 VanDerWaalsContact O-N 3.15Å; S27-I30 VanDerWaalsContact O-O 3.14Å
28D92.6Very high88.9Confident136 Ų136109.8 Ų109.873%0.72757%0.572SS**G310 helixtrans-69.8-23176.163.7-44.6000113.3S26 I30S26-D28 VanDerWaalsContact C-N 3.27Å; S26-D28 WeakPolarHBondContact CB-OD1 3.47Å; S26-D28 PolarHBondContact O-N 3.28Å; S26-D28 PolarHBondContact OG-OD1 3.05Å; D28-I30 VanDerWaalsContact C-N 3.27Å
29M93.1Very high89.6Confident107 Ų107108.8 Ų108.853%0.52757%0.57SS.*G310 helixtrans-81.9-7.1172.2-63.8-164.2-65.600112.9L24 L25 S26 S27L24-M29 WeakPolarHBondContact O-CE 3.4Å; L25-M29 HydrophobicContact CD2-CE 4.09Å; S26-M29 PolarHBondContact O-N 2.83Å; S26-M29 VanDerWaalsContact O-N 3.11Å; S26-M29 WeakPolarHBondContact OG-CE 3.21Å; S26-M29 WeakPolarHBondContact OG-CG 3.43Å; S27-M29 VanDerWaalsContact C-N 3.28Å; S27-M29 PolarHBondContact O-N 3.32Å
30I91Very high90.3Very high103 Ų103109.6 Ų109.653%0.52858%0.579SS.*SBendtrans-101.1112.3176.8-57173.4000107.2S27 D28S27-I30 PolarHBondContact O-N 3.18Å; S27-I30 VanDerWaalsContact O-N 3.15Å; S27-I30 VanDerWaalsContact O-O 3.14Å; D28-I30 VanDerWaalsContact C-N 3.27Å
31S92.7Very high90.6Very high72 Ų72107.4 Ų107.450%0.50357%0.571SS.*PPolyproline II helixtrans-62.5156.2176.760.70000111.4
32P94.9Very high90.9Very high101 Ų101104.5 Ų104.566%0.65656%0.555SS**PPolyproline II helixtrans-52.5158.8163.8-23.634.1000111.6L34P32-L34 WeakPolarHBondContact O-CD2 3.49Å; P32-L34 PolarHBondContact O-N 3.15Å
33P93.5Very high91Very high126 Ų12698.4 Ų98.482%0.81854%0.536SS*.PPolyproline II helixtrans-57.3124.2176.324.8-33.7000110G35P33-G35 PolarHBondContact O-N 3.11Å
34L92.3Very high90.8Very high131 Ų13194.1 Ų94.169%0.68652%0.516SS*.  trans-84.64-171.6-60.9-179.3000113.4P32 D36P32-L34 WeakPolarHBondContact O-CD2 3.49Å; P32-L34 PolarHBondContact O-N 3.15Å; L34-D36 PolarHBondContact O-N 3.47Å
35G93.1Very high90.5Very high49 Ų4996.2 Ų96.251%0.50553%0.534SS..SBendtrans70.911.7-174.800000113.7P33 F37P33-G35 PolarHBondContact O-N 3.11Å; G35-F37 WeakPolarHBondContact O-CD2 3.45Å; G35-F37 PolarHBondContact O-N 3.3Å
36D93.4Very high89.8Confident110 Ų11095.8 Ų95.859%0.58854%0.542SS*.  trans-77.359172.268.7-39.3000110.7L34 R38L34-D36 PolarHBondContact O-N 3.47Å; D36-R38 WeakPolarHBondContact O-CG 3.46Å; D36-R38 PolarHBondContact O-N 2.52Å; D36-R38 VanDerWaalsContact O-N 3.1Å
37F92.3Very high89Confident175 Ų17594.3 Ų94.377%0.76854%0.535SS*.  trans-63.3117179.6-72.7-81.5000110.3G35G35-F37 WeakPolarHBondContact O-CD2 3.45Å; G35-F37 PolarHBondContact O-N 3.3Å
38R91.9Very high88.2Confident193 Ų19392.5 Ų92.573%0.72853%0.533SS*.  trans-112.5114.6178.1-66.4176.570-114-4.7108.8D36 T40D36-R38 WeakPolarHBondContact O-CG 3.46Å; D36-R38 PolarHBondContact O-N 2.52Å; D36-R38 VanDerWaalsContact O-N 3.1Å; R38-T40 HydrophobicContact CB-CG2 4.47Å; R38-T40 PolarHBondContact O-N 2.98Å; R38-T40 VanDerWaalsContact O-N 3.08Å
39H90Very high87.3Confident170 Ų17091.6 Ų91.679%0.78754%0.537SS*.  trans-73.797171.8-64.9-90.1000109.1
40T91.8Very high86.9Confident78 Ų7889.7 Ų89.748%0.47953%0.53SS..  trans-95.6-28.6179.252.50000113R38 G53R38-T40 HydrophobicContact CB-CG2 4.47Å; R38-T40 PolarHBondContact O-N 2.98Å; R38-T40 VanDerWaalsContact O-N 3.08Å; T40-G53 WeakPolarHBondContact O-CA 3.33Å
41I90.8Very high86.7Confident59 Ų5986.7 Ų86.730%0.30351%0.514SS..EExtended strand (participates in β ladder)trans-138142.8-175.5-63.9144.6000108.3I43 F52 D54 I55 F57I41-I43 HydrophobicContact CG2-CG1 4.16Å; I41-F52 CarbonylContact C-O 3.58Å; I41-F52 WeakPolarHBondContact CA-O 3.42Å; I41-D54 WeakPolarHBondContact CD1-O 3.49Å; I41-D54 WeakPolarHBondContact CG1-O 3.43Å; I41-I55 HydrophobicContact CG2-CG2 3.7Å; I41-F57 HydrophobicContact CD1-CD1 4.27Å; I41-F57 HydrophobicContact CD1-CE1 3.52Å; I41-F57 HydrophobicContact CD1-CZ 4.22Å; I41-F57 HydrophobicContact CG1-CE1 4.41Å
42H89.7Confident86.5Confident50 Ų5090.3 Ų90.323%0.23152%0.521CS..EExtended strand (participates in β ladder)trans-130.4133170176.849.2000109.1D50 M51 F52 R87H42-D50 IonicContact NE2-OD1 3.83Å; H42-M51 CarbonylContact O-C 3.53Å; H42-M51 WeakPolarHBondContact O-CA 3.15Å; H42-F52 HydrophobicContact CB-CB 4.24Å; H42-F52 PolarHBondContact N-O 3.46Å; H42-F52 PolarHBondContact O-N 3.09Å; H42-R87 PolarHBondContact CE1-NH1 2.78Å; H42-R87 PolarHBondContact NE2-NH1 2.66Å
43I89Confident86.3Confident57 Ų5787.2 Ų87.229%0.29251%0.507SS..EExtended strand (participates in β ladder)trans-126.3107.5171.3-55.4176.1000104.6I41 M51 L58 L65I41-I43 HydrophobicContact CG2-CG1 4.16Å; I43-M51 HydrophobicContact CB-CE 4.48Å; I43-M51 HydrophobicContact CD1-CE 4.04Å; I43-M51 HydrophobicContact CG1-CE 3.82Å; I43-M51 HydrophobicContact CG2-CE 4.07Å; I43-M51 HydrophobicContact CG2-CG 4.32Å; I43-L58 HydrophobicContact CD1-CD1 3.66Å; I43-L65 HydrophobicContact CD1-CD1 4.06Å; I43-L65 HydrophobicContact CD1-CD2 3.59Å; I43-L65 HydrophobicContact CD1-CG 4.48Å; I43-L65 HydrophobicContact CG2-CD1 4.16Å
44G82.3Confident86.2Confident15 Ų1586.3 Ų86.316%0.15550%0.496CS..  trans-91176.2176.200000111.5G46 D50G44-G46 VanDerWaalsContact C-N 3.3Å; G44-G46 PolarHBondContact O-N 2.96Å; G44-D50 WeakPolarHBondContact CA-O 3.2Å; G44-D50 WeakPolarHBondContact CA-OD2 3.13Å; G44-D50 PolarHBondContact N-O 2.98Å
45S78.9Confident86Confident77 Ų7782.2 Ų82.254%0.53847%0.474SS..SBendtrans-80.2-13.7-172.9-163.50000112.6G47 D50S45-G47 PolarHBondContact O-N 2.93Å; S45-D50 PolarHBondContact N-OD2 2.86Å
46G73.3Confident85.7Confident45 Ų4582.9 Ų82.946%0.46447%0.47SS..SBendtrans-7524.9179.300000115.1G44 S49 D50G44-G46 VanDerWaalsContact C-N 3.3Å; G44-G46 PolarHBondContact O-N 2.96Å; G46-S49 PolarHBondContact O-OG 3.08Å; G46-D50 PolarHBondContact N-OD2 3Å
47G72.7Confident85.5Confident20 Ų2083.5 Ų83.521%0.20647%0.468CS..G310 helixtrans58.8-145.8-177.400000112.8S45 S49 D50S45-G47 PolarHBondContact O-N 2.93Å; G47-S49 PolarHBondContact O-N 3.17Å; G47-D50 PolarHBondContact O-N 3.26Å; G47-D50 VanDerWaalsContact O-N 3.11Å
48G72.1Confident85.1Confident69 Ų6975.9 Ų75.971%0.71144%0.435SS*.G310 helixtrans-61.6-15.4-174.800000115.7
49S75.3Confident84.7Confident116 Ų11673.3 Ų73.381%0.81143%0.432SS*.G310 helixtrans-85-16.5179.171.50000113.9G46 G47G46-S49 PolarHBondContact O-OG 3.08Å; G47-S49 PolarHBondContact O-N 3.17Å
50D83.4Confident84.3Confident68 Ų6868.4 Ų68.436%0.36443%0.427SS..SBendtrans-113.441.4-175.1-167.516.8000110.6H42 G44 S45 G46 G47H42-D50 IonicContact NE2-OD1 3.83Å; G44-D50 WeakPolarHBondContact CA-O 3.2Å; G44-D50 WeakPolarHBondContact CA-OD2 3.13Å; G44-D50 PolarHBondContact N-O 2.98Å; S45-D50 PolarHBondContact N-OD2 2.86Å; G46-D50 PolarHBondContact N-OD2 3Å; G47-D50 PolarHBondContact O-N 3.26Å; G47-D50 VanDerWaalsContact O-N 3.11Å
51M86.9Confident83.9Confident40 Ų4070.1 Ų70.120%0.19743%0.428CS..EExtended strand (participates in β ladder)trans-120.3137.4-179.1-59.3-179.780.200110.6H42 I43 I55 L58 F62 L65H42-M51 CarbonylContact O-C 3.53Å; H42-M51 WeakPolarHBondContact O-CA 3.15Å; I43-M51 HydrophobicContact CB-CE 4.48Å; I43-M51 HydrophobicContact CD1-CE 4.04Å; I43-M51 HydrophobicContact CG1-CE 3.82Å; I43-M51 HydrophobicContact CG2-CE 4.07Å; I43-M51 HydrophobicContact CG2-CG 4.32Å; M51-I55 HydrophobicContact CB-CD1 4.42Å; M51-I55 HydrophobicContact CE-CB 4.43Å; M51-I55 HydrophobicContact CE-CD1 3.68Å; M51-I55 HydrophobicContact CE-CG2 4.06Å; M51-I55 HydrophobicContact SD-CD1 4.11Å; M51-L58 HydrophobicContact CE-CD1 4.45Å; M51-F62 HydrophobicContact CE-CE1 4.27Å; M51-L65 HydrophobicContact CE-CD1 3.76Å
52F89Confident83.4Confident148 Ų14870.6 Ų70.665%0.64943%0.428SS*.EExtended strand (participates in β ladder)trans-138149177.2169.5-98000111.2I41 H42I41-F52 CarbonylContact C-O 3.58Å; I41-F52 WeakPolarHBondContact CA-O 3.42Å; H42-F52 HydrophobicContact CB-CB 4.24Å; H42-F52 PolarHBondContact N-O 3.46Å; H42-F52 PolarHBondContact O-N 3.09Å
53G91.4Very high83Confident36 Ų3674.8 Ų74.837%0.37145%0.447SS..EExtended strand (participates in β ladder)trans94-174.5178.100000114.5T40 I55T40-G53 WeakPolarHBondContact O-CA 3.33Å; G53-I55 PolarHBondContact O-N 3.18Å; G53-I55 VanDerWaalsContact O-N 3.09Å
54D90.8Very high82.7Confident107 Ų10777.6 Ų77.657%0.57246%0.462SS*.  trans-79.892.5-177.1-174.99.6000111.7I41 S56 F57I41-D54 WeakPolarHBondContact CD1-O 3.49Å; I41-D54 WeakPolarHBondContact CG1-O 3.43Å; D54-S56 VanDerWaalsContact C-N 3.33Å; D54-S56 WeakPolarHBondContact OD1-CB 3.34Å; D54-S56 PolarHBondContact OD1-N 2.89Å; D54-S56 VanDerWaalsContact OD1-N 3.11Å; D54-S56 PolarHBondContact OD1-OG 3.09Å; D54-F57 WeakPolarHBondContact O-CD1 3.33Å; D54-F57 WeakPolarHBondContact O-CE1 3.18Å
55I88.4Confident82.5Confident45 Ų4578 Ų7823%0.23146%0.461CS..  trans-93.513.6177.459.2170.1000113I41 M51 G53 F57 L58 F62I41-I55 HydrophobicContact CG2-CG2 3.7Å; M51-I55 HydrophobicContact CB-CD1 4.42Å; M51-I55 HydrophobicContact CE-CB 4.43Å; M51-I55 HydrophobicContact CE-CD1 3.68Å; M51-I55 HydrophobicContact CE-CG2 4.06Å; M51-I55 HydrophobicContact SD-CD1 4.11Å; G53-I55 PolarHBondContact O-N 3.18Å; G53-I55 VanDerWaalsContact O-N 3.09Å; I55-F57 PolarHBondContact O-N 3.15Å; I55-F57 VanDerWaalsContact O-N 3.1Å; I55-L58 HydrophobicContact CB-CD1 4.25Å; I55-L58 HydrophobicContact CG2-CD1 4.38Å; I55-L58 WeakPolarHBondContact O-CB 3.4Å; I55-L58 PolarHBondContact O-N 3.47Å; I55-F62 HydrophobicContact CD1-CE1 4.25Å
56S87.4Confident81.9Confident62 Ų6278.2 Ų78.243%0.43446%0.46SS..G310 helixtrans-59.4-27.9-177-56.60000113D54 L58 Q59D54-S56 VanDerWaalsContact C-N 3.33Å; D54-S56 WeakPolarHBondContact OD1-CB 3.34Å; D54-S56 PolarHBondContact OD1-N 2.89Å; D54-S56 VanDerWaalsContact OD1-N 3.11Å; D54-S56 PolarHBondContact OD1-OG 3.09Å; S56-L58 PolarHBondContact O-N 3.34Å; S56-Q59 VanDerWaalsContact CB-NE2 3.32Å; S56-Q59 WeakPolarHBondContact O-CB 3.14Å; S56-Q59 WeakPolarHBondContact O-CG 3.47Å; S56-Q59 PolarHBondContact O-N 3.1Å; S56-Q59 PolarHBondContact O-NE2 2.8Å
57F87.4Confident81.4Confident123 Ų12379.3 Ų79.354%0.53947%0.471SS..G310 helixtrans-65.5-18.8176.173.7-82.2000113.9I41 D54 I55I41-F57 HydrophobicContact CD1-CD1 4.27Å; I41-F57 HydrophobicContact CD1-CE1 3.52Å; I41-F57 HydrophobicContact CD1-CZ 4.22Å; I41-F57 HydrophobicContact CG1-CE1 4.41Å; D54-F57 WeakPolarHBondContact O-CD1 3.33Å; D54-F57 WeakPolarHBondContact O-CE1 3.18Å; I55-F57 PolarHBondContact O-N 3.15Å; I55-F57 VanDerWaalsContact O-N 3.1Å
58L85.6Confident80.7Confident15 Ų1579.9 Ų79.98%0.07947%0.471CS..G310 helixtrans-91.6-2.4178.5-65.1169.2000113.2I43 M51 I55 S56 G60 K61 F62 L65I43-L58 HydrophobicContact CD1-CD1 3.66Å; M51-L58 HydrophobicContact CE-CD1 4.45Å; I55-L58 HydrophobicContact CB-CD1 4.25Å; I55-L58 HydrophobicContact CG2-CD1 4.38Å; I55-L58 WeakPolarHBondContact O-CB 3.4Å; I55-L58 PolarHBondContact O-N 3.47Å; S56-L58 PolarHBondContact O-N 3.34Å; L58-G60 PolarHBondContact O-N 3.09Å; L58-K61 CarbonylContact O-C 3.54Å; L58-K61 WeakPolarHBondContact O-CA 3.49Å; L58-K61 PolarHBondContact O-N 3.34Å; L58-F62 HydrophobicContact CB-CD1 4.29Å; L58-F62 HydrophobicContact CB-CE1 4Å; L58-F62 HydrophobicContact CB-CZ 4.36Å; L58-F62 PolarHBondContact O-N 3.3Å; L58-L65 HydrophobicContact CD1-CD1 4.09Å; L58-L65 HydrophobicContact CD1-CD2 4Å; L58-L65 HydrophobicContact CD1-CG 4.45Å; L58-L65 HydrophobicContact CD2-CD2 4.23Å
59Q81.7Confident79.9Confident139 Ų13982.8 Ų82.865%0.6547%0.474SS*.THydrogen-bonded Turntrans-51.9116.4179-71.3171.427.200110.4S56 K61S56-Q59 VanDerWaalsContact CB-NE2 3.32Å; S56-Q59 WeakPolarHBondContact O-CB 3.14Å; S56-Q59 WeakPolarHBondContact O-CG 3.47Å; S56-Q59 PolarHBondContact O-N 3.1Å; S56-Q59 PolarHBondContact O-NE2 2.8Å; Q59-K61 VanDerWaalsContact C-N 3.32Å; Q59-K61 PolarHBondContact O-N 2.83Å
60G81.9Confident79Confident67 Ų6782.3 Ų82.369%0.69147%0.466SS*.THydrogen-bonded Turntrans81.8-1.4-176.300000116L58L58-G60 PolarHBondContact O-N 3.09Å
61K84.4Confident77.3Confident115 Ų11587.4 Ų87.450%0.549%0.488SS..  trans-120.818.2-178.7-61179.3-177.1177.10113.2L58 Q59 H63 L64L58-K61 CarbonylContact O-C 3.54Å; L58-K61 WeakPolarHBondContact O-CA 3.49Å; L58-K61 PolarHBondContact O-N 3.34Å; Q59-K61 VanDerWaalsContact C-N 3.32Å; Q59-K61 PolarHBondContact O-N 2.83Å; K61-H63 PolarHBondContact O-N 3.08Å; K61-L64 HydrophobicContact CB-CD1 4.04Å; K61-L64 HydrophobicContact CB-CG 4.42Å; K61-L64 HydrophobicContact CD-CD1 4.41Å; K61-L64 WeakPolarHBondContact O-CB 3.3Å; K61-L64 PolarHBondContact O-N 3.22Å
62F79.4Confident75.2Confident69 Ų6993.4 Ų93.430%0.30352%0.516SS..G310 helixtrans-57.9-31.2177-65.4-75.9000111.8M51 I55 L58 L64 L65 T68M51-F62 HydrophobicContact CE-CE1 4.27Å; I55-F62 HydrophobicContact CD1-CE1 4.25Å; L58-F62 HydrophobicContact CB-CD1 4.29Å; L58-F62 HydrophobicContact CB-CE1 4Å; L58-F62 HydrophobicContact CB-CZ 4.36Å; L58-F62 PolarHBondContact O-N 3.3Å; F62-L64 PolarHBondContact O-N 3.08Å; F62-L65 HydrophobicContact CD1-CD1 4Å; F62-L65 VanDerWaalsContact O-CB 3.25Å; F62-L65 WeakPolarHBondContact O-CB 3.42Å; F62-L65 WeakPolarHBondContact O-CG 3.23Å; F62-L65 PolarHBondContact O-N 3.16Å; F62-T68 PolarHBondContact O-OG1 2.77Å
63H81.5Confident73.2Confident137 Ų13791.4 Ų91.463%0.63452%0.518SS*.G310 helixtrans-56.4-17.7173.767.9-91.6000115.3K61 L65K61-H63 PolarHBondContact O-N 3.08Å; H63-L65 VanDerWaalsContact C-N 3.29Å
64L82.6Confident70.8Confident116 Ų11697.7 Ų97.761%0.60754%0.537SS*.G310 helixtrans-81.7-11174.8-58.6179.6000112.7K61 F62K61-L64 HydrophobicContact CB-CD1 4.04Å; K61-L64 HydrophobicContact CB-CG 4.42Å; K61-L64 HydrophobicContact CD-CD1 4.41Å; K61-L64 WeakPolarHBondContact O-CB 3.3Å; K61-L64 PolarHBondContact O-N 3.22Å; F62-L64 PolarHBondContact O-N 3.08Å
65L78.8Confident68.8Low25 Ų25100.5 Ų100.513%0.13155%0.547CS..SBendtrans-83131.8177.1-57.7-179.4000109.6I43 M51 L58 F62 H63 G67 T68I43-L65 HydrophobicContact CD1-CD1 4.06Å; I43-L65 HydrophobicContact CD1-CD2 3.59Å; I43-L65 HydrophobicContact CD1-CG 4.48Å; I43-L65 HydrophobicContact CG2-CD1 4.16Å; M51-L65 HydrophobicContact CE-CD1 3.76Å; L58-L65 HydrophobicContact CD1-CD1 4.09Å; L58-L65 HydrophobicContact CD1-CD2 4Å; L58-L65 HydrophobicContact CD1-CG 4.45Å; L58-L65 HydrophobicContact CD2-CD2 4.23Å; F62-L65 HydrophobicContact CD1-CD1 4Å; F62-L65 VanDerWaalsContact O-CB 3.25Å; F62-L65 WeakPolarHBondContact O-CB 3.42Å; F62-L65 WeakPolarHBondContact O-CG 3.23Å; F62-L65 PolarHBondContact O-N 3.16Å; H63-L65 VanDerWaalsContact C-N 3.29Å; L65-G67 PolarHBondContact O-N 3.14Å; L65-T68 HydrophobicContact CB-CG2 3.95Å; L65-T68 HydrophobicContact CD1-CG2 4.14Å; L65-T68 PolarHBondContact O-OG1 3.37Å
66P66Low66.7Low81 Ų81105.9 Ų105.953%0.52658%0.576SS.*THydrogen-bonded Turntrans-59.8129.6170.6-2335.1000110.4F85P66-F85 HydrophobicContact CB-CE2 4.03Å; P66-F85 HydrophobicContact CG-CE2 3.94Å
67G61.8Low64.4Low67 Ų67106.3 Ų106.369%0.69159%0.591SS**THydrogen-bonded Turntrans87.6-1.6172.800000116.5L65 V69L65-G67 PolarHBondContact O-N 3.14Å; G67-V69 VanDerWaalsContact C-N 3.32Å; G67-V69 PolarHBondContact O-N 3.05Å
68T59.1Low62.5Low32 Ų32106.9 Ų106.920%0.19660%0.604CS.*  trans-90.271.9169.465.60000109.9F62 L65 V70F62-T68 PolarHBondContact O-OG1 2.77Å; L65-T68 HydrophobicContact CB-CG2 3.95Å; L65-T68 HydrophobicContact CD1-CG2 4.14Å; L65-T68 PolarHBondContact O-OG1 3.37Å; T68-V70 VanDerWaalsContact C-N 3.26Å; T68-V70 PolarHBondContact O-N 3.08Å; T68-V70 VanDerWaalsContact O-N 3.07Å
69V55.4Low60.4Low130 Ų130115.5 Ų115.579%0.78864%0.641SS**  trans-72.794.5157.9-176.90000105.2G67 E71G67-V69 VanDerWaalsContact C-N 3.32Å; G67-V69 PolarHBondContact O-N 3.05Å; V69-E71 PolarHBondContact O-N 2.89Å
70V55.3Low58.7Low106 Ų106116.6 Ų116.664%0.64265%0.652SS**  trans-68.9117158.5176.10000104.2T68 E72T68-V70 VanDerWaalsContact C-N 3.26Å; T68-V70 PolarHBondContact O-N 3.08Å; T68-V70 VanDerWaalsContact O-N 3.07Å; V70-E72 PolarHBondContact O-N 3.42Å
71E49.2Very low56.9Low176 Ų176120.4 Ų120.482%0.82266%0.656SS**  trans-51.4108.6177.2-60-167.7158.900110.1V69V69-E71 PolarHBondContact O-N 2.89Å
72E42.9Very low55.1Low166 Ų166119.9 Ų119.978%0.77666%0.664SS**  trans-107.8124.4152-69.8-73142.800104.7V70 E74V70-E72 PolarHBondContact O-N 3.42Å; E72-E74 PolarHBondContact O-N 2.97Å; E72-E74 VanDerWaalsContact O-N 3.14Å
73P46.7Very low53.6Low106 Ų106124.4 Ų124.469%0.68868%0.684SS**  trans-89.578.6-166.235.4-33.2000110.6
74E40.8Very low52Low167 Ų167124.9 Ų124.978%0.7869%0.686SS**  trans-141.4109.2171.1-61.9-64.7149.400112.4E72E72-E74 PolarHBondContact O-N 2.97Å; E72-E74 VanDerWaalsContact O-N 3.14Å
75E48.9Very low50.3Low166 Ų166125.2 Ų125.278%0.77668%0.683SS**  trans22.2129.1155.8-55.5-163.215300122.5
76D43.4Very low48.7Very low159 Ų159129.5 Ų129.585%0.8571%0.71SS**  trans61.196.4142.4-62.3-15.4000119.4
77G38.5Very low47.8Very low71 Ų71132.8 Ų132.873%0.73271%0.712SS**  trans-179.774.9167.600000114.6F79G77-F79 PolarHBondContact O-N 3.25Å
78T48.7Very low47Very low134 Ų134135.5 Ų135.582%0.82272%0.715SS**  trans-3994.4168.8-54.30000114.1
79F41.3Very low46.2Very low196 Ų196136.6 Ų136.686%0.8673%0.728SS**  trans-151.963.2152.5-71.2-69.6000109.8G77 L81G77-F79 PolarHBondContact O-N 3.25Å; F79-L81 VanDerWaalsContact C-N 3.29Å; F79-L81 PolarHBondContact O-N 2.99Å
80D44.9Very low45.7Very low163 Ų163137 Ų13787%0.87273%0.731SS**  trans-75.783.1169.6-123-12.8000109
81L44.9Very low44.8Very low147 Ų147138.4 Ų138.477%0.7774%0.739SS**  trans-103.1107.9162.7-73.2169.6000107F79 F83F79-L81 VanDerWaalsContact C-N 3.29Å; F79-L81 PolarHBondContact O-N 2.99Å; L81-F83 VanDerWaalsContact C-N 3.32Å; L81-F83 PolarHBondContact O-N 3.03Å
82P46Very low44.6Very low104 Ų104136.3 Ų136.368%0.67574%0.743SS**  trans-66.797172.827.3-32000107.6Q84P82-Q84 PolarHBondContact O-N 3.44Å
83F49.2Very low44.7Very low163 Ų163131.7 Ų131.772%0.71574%0.739SS**  trans-70.986.2171.2-168.4-94.1000107.7L81 F85L81-F83 VanDerWaalsContact C-N 3.32Å; L81-F83 PolarHBondContact O-N 3.03Å; F83-F85 PolarHBondContact O-N 2.79Å
84Q47.5Very low44.5Very low148 Ų148137.4 Ų137.469%0.69275%0.747SS**  trans-68.4118.8175.6-65-162.736.800108.5P82 T86P82-Q84 PolarHBondContact O-N 3.44Å; Q84-T86 VanDerWaalsContact C-N 3.29Å; Q84-T86 PolarHBondContact O-N 3.46Å
85F46Very low44.8Very low122 Ų122137.2 Ų137.254%0.53575%0.746SS.*  trans-61.996.5161.3-108-92.2000107.3P66 F83 R87P66-F85 HydrophobicContact CB-CE2 4.03Å; P66-F85 HydrophobicContact CG-CE2 3.94Å; F83-F85 PolarHBondContact O-N 2.79Å; F85-R87 PolarHBondContact O-N 3.01Å
86T45.7Very low44.6Very low115 Ų115136.5 Ų136.571%0.70675%0.747SS**  trans-66.27616324.10000108.3Q84 T88Q84-T86 VanDerWaalsContact C-N 3.29Å; Q84-T86 PolarHBondContact O-N 3.46Å; T86-T88 PolarHBondContact O-N 2.87Å
87R48.1Very low44.6Very low150 Ų150134.3 Ų134.357%0.56674%0.741SS**  trans-74.5117.9163.2-171.6-178.2178-167.74.7105.9H42 F85 A89H42-R87 PolarHBondContact CE1-NH1 2.78Å; H42-R87 PolarHBondContact NE2-NH1 2.66Å; F85-R87 PolarHBondContact O-N 3.01Å; R87-A89 HydrophobicContact CG-CB 3.95Å; R87-A89 PolarHBondContact O-N 3.01Å
88T45.1Very low44.9Very low124 Ų124138.7 Ų138.776%0.76175%0.748SS**  trans-67.767.8160.445.60000108.6T86 T90T86-T88 PolarHBondContact O-N 2.87Å; T88-T90 PolarHBondContact O-N 3.38Å
89A41.3Very low45.1Very low55 Ų55134.9 Ų134.946%0.45574%0.735SS.*  trans-81.5114.6175.900000108.6R87 V91R87-A89 HydrophobicContact CG-CB 3.95Å; R87-A89 PolarHBondContact O-N 3.01Å; A89-V91 PolarHBondContact O-N 3.28Å
90T45.3Very low45.3Very low140 Ų140132 Ų13286%0.85974%0.736SS**  trans-65.392.7164.4510000109.5T88T88-T90 PolarHBondContact O-N 3.38Å
91V36.2Very low45.4Very low134 Ų134127.9 Ų127.981%0.81272%0.72SS**  trans-131.8124.8155.3166.90000108.5A89A89-V91 PolarHBondContact O-N 3.28Å
92C44.5Very low45.6Very low133 Ų133126.1 Ų126.190%0.89972%0.717SS**  trans-59.6133179.4-171.60000111.9
93G46Very low46Very low68 Ų68126.9 Ų126.970%0.70172%0.715SS**  trans113.8110153.700000115.9
94R42.7Very low46.4Very low227 Ų227125.9 Ų125.986%0.85772%0.717SS**SBendtrans89.8114.7151.9-162.1155.8167.6-90.5-4.5116.5
95E46.3Very low47.2Very low162 Ų162128.6 Ų128.676%0.75773%0.726SS**  trans57.5101.3169.7-38.5-50.394.900118.5
96L45.9Very low47.7Very low152 Ų152130.3 Ų130.380%0.79674%0.741SS**  trans-78.6126169178.774.6000110.1
97P42.4Very low48.4Very low112 Ų112127.8 Ų127.873%0.72773%0.732SS**  trans-80.1130.1158.628.7-27.8000110.5G99P97-G99 PolarHBondContact O-N 3.09Å
98D45.5Very low49.1Very low164 Ų164128.6 Ų128.688%0.87775%0.746SS**  trans-61.1106.4178.1-72.8-52000112
99G51.3Low49.3Very low53 Ų53127.4 Ų127.455%0.54674%0.742SS.*  trans-163.7137.1170.900000111.8P97 S101P97-G99 PolarHBondContact O-N 3.09Å; G99-S101 PolarHBondContact O-N 3.16Å; G99-S101 VanDerWaalsContact O-N 3.16Å
100P46.5Very low50.2Low135 Ų135132.1 Ų132.188%0.87776%0.759SS**  trans-67.3115.6-178.927.7-33.2000109.9
101S46.1Very low50.7Low77 Ų77131 Ų13154%0.53875%0.754SS.*  trans-63.8138.7175.9-30.20000109.8G99 L103G99-S101 PolarHBondContact O-N 3.16Å; G99-S101 VanDerWaalsContact O-N 3.16Å; S101-L103 PolarHBondContact O-N 2.77Å
102P49.5Very low51.6Low110 Ų110131.2 Ų131.271%0.71476%0.756SS**  trans-74.177.7177.130.4-33.6000109.7L104P102-L104 PolarHBondContact O-N 3.45Å
103L55.4Low52.4Low120 Ų120132 Ų13263%0.62875%0.749SS**  trans-72.7124.1176.1-73.9163.4000108.6S101 K105S101-L103 PolarHBondContact O-N 2.77Å; L103-K105 PolarHBondContact O-N 2.74Å
104L57.3Low52.5Low143 Ų143132.3 Ų132.375%0.74975%0.752SS**  trans-49.5116166.5-66.7166.1000108P102 N106 A107P102-L104 PolarHBondContact O-N 3.45Å; L104-N106 PolarHBondContact O-N 3.2Å; L104-A107 PolarHBondContact O-N 2.94Å
105K63.3Low53.2Low205 Ų205123.8 Ų123.889%0.89174%0.735SS**THydrogen-bonded Turntrans-53.1-0.8-178.646.8175.6169.9-1790117L103L103-K105 PolarHBondContact O-N 2.74Å
106N57.1Low53.4Low157 Ų157122.8 Ų122.884%0.8474%0.742SS**THydrogen-bonded Turntrans-115.54.3175.2-69.9-43.2000113.8L104L104-N106 PolarHBondContact O-N 3.2Å
107A60.6Low53.6Low62 Ų62124 Ų12451%0.51274%0.744SS.*PPolyproline II helixtrans-96.8123179.900000110.5L104L104-A107 PolarHBondContact O-N 2.94Å
108I63.2Low53.8Low168 Ų168122.6 Ų122.686%0.86274%0.742SS**PPolyproline II helixtrans-91126.2166.435.5170.5000108.8
109S50.1Low53.9Low99 Ų99122 Ų12269%0.69274%0.738SS**PPolyproline II helixtrans-75.2131.7175.9-45.50000110
110L58.8Low53.9Low153 Ų153125.9 Ų125.980%0.80175%0.751SS**PPolyproline II helixtrans-69.7145.7165.1-63.8177.2000109.1V112L110-V112 PolarHBondContact O-N 2.85Å; L110-V112 VanDerWaalsContact O-N 3.15Å
111P56.7Low54.3Low116 Ų116125.7 Ų125.775%0.75374%0.742SS**PPolyproline II helixtrans-59.1121.9173.623.1-31.5000109.9I113P111-I113 PolarHBondContact O-N 3.11Å
112V55.4Low54.6Low140 Ų140127.4 Ų127.485%0.84875%0.751SS**  trans-72.9105.2172170.40000107.6L110 G114L110-V112 PolarHBondContact O-N 2.85Å; L110-V112 VanDerWaalsContact O-N 3.15Å; V112-G114 PolarHBondContact O-N 3.09Å; V112-G114 VanDerWaalsContact O-N 3.09Å
113I59.6Low55Low150 Ų150129 Ų12977%0.76976%0.759SS**  trans-75.194.6166.7-96.1155.7000107.8P111 G115P111-I113 PolarHBondContact O-N 3.11Å; I113-G115 PolarHBondContact O-N 2.92Å
114G49.1Very low55.1Low74 Ų74127.5 Ų127.576%0.76377%0.765SS**  trans-82.4102.917000000110.4V112V112-G114 PolarHBondContact O-N 3.09Å; V112-G114 VanDerWaalsContact O-N 3.09Å
115G56.6Low55.5Low47 Ų47129.3 Ų129.349%0.48577%0.769SS.*SBendtrans121.3154.2163.500000115.1I113 Q117I113-G115 PolarHBondContact O-N 2.92Å; G115-Q117 PolarHBondContact O-N 3.1Å
116P51.2Low55.6Low142 Ų142123.3 Ų123.392%0.92276%0.758SS**  trans-77.464.4179.135.2-36.1000110.5
117Q50.9Low56.2Low177 Ų177121.4 Ų121.483%0.82775%0.754SS**  trans-10182157.5-68.6-176.652.600105.5G115 L119G115-Q117 PolarHBondContact O-N 3.1Å; Q117-L119 PolarHBondContact O-N 3.22Å; Q117-L119 VanDerWaalsContact O-N 3.14Å
118A45.1Very low56.9Low83 Ų83124.3 Ų124.369%0.68677%0.768SS**  trans-45.9125.4159.500000106.4T120A118-T120 VanDerWaalsContact C-N 3.32Å; A118-T120 PolarHBondContact O-N 3.24Å
119L48.8Very low57.2Low151 Ų151125.8 Ų125.879%0.79177%0.768SS**  trans-39.3107.6163.7-72.3161.3000105.8Q117 L121Q117-L119 PolarHBondContact O-N 3.22Å; Q117-L119 VanDerWaalsContact O-N 3.14Å; L119-L121 HydrophobicContact CB-CG 4.32Å; L119-L121 PolarHBondContact O-N 3.5Å
120T49.9Very low58.2Low135 Ų135126.3 Ų126.383%0.82877%0.769SS**  trans-72.478.3168.1-58.90000103.4A118A118-T120 VanDerWaalsContact C-N 3.32Å; A118-T120 PolarHBondContact O-N 3.24Å
121L55.5Low58.9Low130 Ų130125 Ų12568%0.68177%0.769SS**  trans-52.3132.3159.4-66.8168.9000104.2L119 T123L119-L121 HydrophobicContact CB-CG 4.32Å; L119-L121 PolarHBondContact O-N 3.5Å; L121-T123 PolarHBondContact O-N 3.35Å
122P52.5Low59.4Low113 Ų113130.8 Ų130.873%0.73478%0.776SS**  trans-47.7134.9170.820.7-30.8000107.3A124P122-A124 PolarHBondContact O-N 3.29Å
123T58.9Low59.3Low143 Ų143131.7 Ų131.788%0.87778%0.776SS**  trans-58.486.1-179.8-61.20000109.1L121 Q125L121-T123 PolarHBondContact O-N 3.35Å; T123-Q125 PolarHBondContact O-N 3Å
124A56.6Low59Low90 Ų90132.6 Ų132.674%0.74478%0.776SS**  trans-77.4109.4170.800000105.3P122 A126P122-A124 PolarHBondContact O-N 3.29Å; A124-A126 PolarHBondContact O-N 3.41Å; A124-A126 VanDerWaalsContact O-N 3.16Å
125Q66.3Low59.3Low181 Ų181136.4 Ų136.485%0.84678%0.778SS**PPolyproline II helixtrans-46.5121.6171.9178.8173.5-14.400109.1T123T123-Q125 PolarHBondContact O-N 3Å
126A63.9Low58.8Low79 Ų79141.8 Ų141.865%0.65379%0.791SS**PPolyproline II helixtrans-54.7133.7-179.900000109.5A124A124-A126 PolarHBondContact O-N 3.41Å; A124-A126 VanDerWaalsContact O-N 3.16Å
127P69.7Low58.6Low116 Ų116141.1 Ų141.175%0.75378%0.784SS**PPolyproline II helixtrans-54138.2177.1-23.432.3000110.3K129P127-K129 PolarHBondContact O-N 2.85Å
128P76.6Confident58.2Low124 Ų124137.8 Ų137.881%0.80578%0.778SS**PPolyproline II helixtrans-57.8141.2-178.623.4-32.7000110.8
129K68.3Low57.7Low199 Ų199142.7 Ų142.787%0.86579%0.786SS**PPolyproline II helixtrans-57.8128.9-174.7-141.2161-170.4163.30109.6P127P127-K129 PolarHBondContact O-N 2.85Å
130P72.1Confident57.3Low109 Ų109140.2 Ų140.271%0.70878%0.779SS**PPolyproline II helixtrans-63.2145.1178.525.5-33.2000110.2R132P130-R132 PolarHBondContact O-N 2.89Å
131P73.3Confident56.3Low126 Ų126139.1 Ų139.182%0.81878%0.778SS**PPolyproline II helixtrans-59.9130.6177.924.5-32.6000109.9L133P131-L133 PolarHBondContact O-N 3.36Å; P131-L133 VanDerWaalsContact O-N 3.12Å
132R67.6Low55.8Low237 Ų237138 Ų13889%0.89478%0.778SS**  trans-64.8112.8177.3-84.6178.8136.9148-5.2109P130 H134P130-R132 PolarHBondContact O-N 2.89Å; R132-H134 PolarHBondContact O-N 3.19Å
133L53.2Low54.8Low160 Ų160141.1 Ų141.184%0.83878%0.783SS**  trans-66.6104.4170.4-144.5177.4000107.5P131 L135P131-L133 PolarHBondContact O-N 3.36Å; P131-L133 VanDerWaalsContact O-N 3.12Å; L133-L135 PolarHBondContact O-N 3.03Å; L133-L135 VanDerWaalsContact O-N 3.13Å
134H53.3Low53.4Low168 Ų168143.2 Ų143.278%0.77878%0.783SS**  trans-70.2101.3172.3-115.6-113.1000107.5R132 E136R132-H134 PolarHBondContact O-N 3.19Å; H134-E136 PolarHBondContact O-N 3.18Å
135L54.9Low52.1Low155 Ų155142.6 Ų142.681%0.81279%0.785SS**  trans-81.996.7169.3-168.262.8000107.6L133 T137L133-L135 PolarHBondContact O-N 3.03Å; L133-L135 VanDerWaalsContact O-N 3.13Å; L135-T137 PolarHBondContact O-N 3.43Å
136E46Very low50.3Low159 Ų159137.8 Ų137.874%0.74378%0.784SS**  trans-58.5119.3173.4-171.4131.5121.700109.4H134 P138H134-E136 PolarHBondContact O-N 3.18Å; E136-P138 HydrophobicContact CG-CG 4.22Å; E136-P138 WeakPolarHBondContact O-CD 3.36Å
137T47.2Very low48.8Very low128 Ų128139.4 Ų139.479%0.78579%0.791SS**  trans-101.3108.5165.8-550000107.6L135L135-T137 PolarHBondContact O-N 3.43Å
138P41.7Very low47.1Very low107 Ų107139.3 Ų139.370%0.69579%0.788SS**  trans-85.8132.3158.4-12.229.3000110.5E136E136-P138 HydrophobicContact CG-CG 4.22Å; E136-P138 WeakPolarHBondContact O-CD 3.36Å
139Q35Very low45.1Very low186 Ų186140 Ų14087%0.86978%0.784SS**  trans-51.5176.3169.7-118-164.6-128.900114.4
140P40.4Very low43.5Very low99 Ų99137.1 Ų137.164%0.64378%0.777SS**  trans-99.4150.7-140.626.8-6.7000116
141S29.8Very low42Very low113 Ų113143.4 Ų143.479%0.7979%0.787SS**  trans62.7168.2149.583.30000119.8
142P43.8Very low40Very low105 Ų105147.7 Ų147.768%0.68279%0.787SS**  cis-126155.3-30.133.4-18.6000111.8
143Q31.7Very low38.8Very low180 Ų180142.2 Ų142.284%0.84177%0.774SS**  trans178.6133.5143.7-101.4163.3-1600114.3
144E29.1Very low38.4Very low187 Ų187140.4 Ų140.487%0.87477%0.771SS**  trans32.6133.6150.3-73.7-175.4101.700123.3
145G29.9Very low37.4Very low77 Ų77140.2 Ų140.279%0.79477%0.771SS**  110.594.2123.900000118.1
146G29.2Very low36.6Very low80 Ų80139.8 Ų139.883%0.82578%0.775SS**  80.3136.8129.100000121.3
147S31.9Very low35.9Very low113 Ų113135.4 Ų135.479%0.7977%0.773SS**  trans96.597.5135.3-152.20000120.1
148V33.1Very low35.4Very low114 Ų114134.9 Ų134.969%0.69177%0.774SS**  trans31.2134.5135.3-72.40000123.8
149D34.9Very low35.8Very low137 Ų137135.2 Ų135.273%0.73378%0.776SS**  trans59.8136.9137.4-65.5-56.6000121.2
150I36.3Very low35.8Very low139 Ų139134.7 Ų134.771%0.71377%0.773SS**  161.1117.1111.2-78.8163.3000109.5
151W38.7Very low35.8Very low241 Ų241136.1 Ų136.191%0.91379%0.786SS**  trans-54.9131.2159.5-77.781.8000110.9
152R31.9Very low35.8Very low217 Ų217133.9 Ų133.982%0.81978%0.781SS**  trans-134.598.4168-165.7174-67.2-173.10.7112.2
153I43.6Very low35.6Very low121 Ų121136.8 Ų136.862%0.62179%0.79SS**  trans-71.5148.5154.3-51.2163.5000107.5E155I153-E155 HydrophobicContact CG2-CG 4.02Å
154P43.3Very low35.8Very low122 Ų122134.8 Ų134.879%0.79279%0.79SS**  trans-112.1107149.131.1-20.9000110.5
155E33.6Very low36.7Very low165 Ų165131.6 Ų131.677%0.77179%0.786SS**  trans-85131.4158.3-73-80.8129.100107.8I153I153-E155 HydrophobicContact CG2-CG 4.02Å
156T37.2Very low36.8Very low145 Ų145136.8 Ų136.889%0.8979%0.789SS**  trans-136.2120.9152.435.70000107.5
157G32.3Very low37.4Very low68 Ų68138.2 Ų138.270%0.70179%0.786SS**  trans-83.4154-162.600000116.8
158S36.8Very low37.5Very low116 Ų116136.2 Ų136.281%0.81178%0.784SS**  53.2155.7109.9-164.90000120
159P49.5Very low37.7Very low114 Ų114135.3 Ų135.374%0.7479%0.788SS**  cis-132.2162.5-29.829.3-10.8000112.9
160H34.3Very low38.5Very low175 Ų175138.4 Ų138.481%0.8180%0.798SS**  trans-152.4117.2135.6102.3-79000110.3
161S41.9Very low38.9Very low129 Ų129139.6 Ų139.690%0.90280%0.801SS**  trans-101.6131.5160.7-71.60000106.6
162G29.7Very low39.4Very low66 Ų66132 Ų13268%0.6878%0.783SS**  trans-166.8107.8173.200000110.8
163L38.1Very low40Very low167 Ų167131 Ų13187%0.87478%0.784SS**  trans-82.3169.1173-64.9167.4000110.6
164T37Very low40.3Very low137 Ų137132.2 Ų132.284%0.8479%0.792SS**  trans93.2154.3156.710.60000118.9
165P46.5Very low40.5Very low121 Ų121129.7 Ų129.779%0.78678%0.777SS**  -119.3162.2-10039.4-23.9000113.3
166E32.8Very low41.1Very low185 Ų185130.9 Ų130.986%0.86478%0.782SS**  trans-132.1132.1168.4-138.8-81.8102.500108.7
167S42.2Very low41.6Very low110 Ų110127 Ų12777%0.76976%0.764SS**  trans-121.2123.3-165.1169.80000107.4
168G34.7Very low42.5Very low72 Ų72128 Ų12874%0.74276%0.761SS**  trans130.476.8157.600000115.4
169A36.6Very low43Very low94 Ų94126.9 Ų126.978%0.77775%0.753SS**  trans-170.5103.113200000107.2E171A169-E171 PolarHBondContact O-N 2.87Å
170E51.4Low43.1Very low202 Ų202128.7 Ų128.794%0.94476%0.756SS**  trans-57.298.6169.6-59.8-78.9132.100108.8
171E45.6Very low43.8Very low165 Ų165128 Ų12877%0.77176%0.757SS**  trans-126.3137.2162.4-120.4-153.9111.800108.6A169 F173A169-E171 PolarHBondContact O-N 2.87Å; E171-F173 PolarHBondContact O-N 3.36Å
172P48.1Very low44.3Very low82 Ų82126.2 Ų126.253%0.53275%0.745SS.*  trans-71.5109.5-14729.1-34.2000110.3L174 S175P172-L174 PolarHBondContact O-N 3.29Å; P172-S175 WeakPolarHBondContact CB-OG 3.4Å; P172-S175 VanDerWaalsContact CG-OG 3.23Å; P172-S175 WeakPolarHBondContact CG-OG 3.47Å
173F44.9Very low45.3Very low194 Ų194129.9 Ų129.985%0.85175%0.748SS**THydrogen-bonded Turntrans-45.8116151-64.6-90000107.3E171E171-F173 PolarHBondContact O-N 3.36Å
174L50.8Low46.4Very low148 Ų148129.5 Ų129.578%0.77574%0.741SS**THydrogen-bonded Turntrans86.525.9165.4-42.8174.1000119.6P172 H176 A177P172-L174 PolarHBondContact O-N 3.29Å; L174-H176 VanDerWaalsContact C-N 3.31Å; L174-H176 PolarHBondContact O-N 3.49Å; L174-A177 PolarHBondContact O-N 3.25Å
175S46.2Very low47.8Very low69 Ų69127.2 Ų127.248%0.48373%0.727SS.*G310 helixtrans-71.8-12.6175.4-720000116.3P172 S178P172-S175 WeakPolarHBondContact CB-OG 3.4Å; P172-S175 VanDerWaalsContact CG-OG 3.23Å; P172-S175 WeakPolarHBondContact CG-OG 3.47Å; S175-S178 PolarHBondContact O-OG 2.74Å; S175-S178 VanDerWaalsContact O-OG 3.06Å
176H47Very low48.7Very low190 Ų190127.7 Ų127.788%0.8872%0.723SS**G310 helixtrans-91.44.6172.9-77.9-60.5000114.4L174L174-H176 VanDerWaalsContact C-N 3.31Å; L174-H176 PolarHBondContact O-N 3.49Å
177A47.9Very low50.4Low62 Ų62122.3 Ų122.351%0.51270%0.699SS.*G310 helixtrans-89-4.3169.800000113.4L174L174-A177 PolarHBondContact O-N 3.25Å
178S50.8Low52.2Low90 Ų90118.3 Ų118.363%0.62968%0.676SS**G310 helixtrans-87.9-3.4-179.259.10000114.7S175S175-S178 PolarHBondContact O-OG 2.74Å; S175-S178 VanDerWaalsContact O-OG 3.06Å
179S46.6Very low54.2Low93 Ų93120.2 Ų120.265%0.6568%0.675SS**G310 helixtrans-96.311.6177.1-1420000114.2
180L51Low55.8Low152 Ų152120.3 Ų120.380%0.79667%0.67SS**G310 helixtrans-93.3-5.5171.6-65180000113.5
181L50.2Low57.4Low160 Ų160114.6 Ų114.684%0.83865%0.645SS**SBendtrans-120-1.6178.1-61.3178.8000113.5L183L181-L183 PolarHBondContact O-N 3.11Å
182S51.2Low59.3Low92 Ų92110.6 Ų110.664%0.64363%0.628SS**  trans-76.861167176.10000109.5H184S182-H184 VanDerWaalsContact C-N 3.32Å; S182-H184 PolarHBondContact O-N 3.03Å
183L51.5Low61Low143 Ų143111.5 Ų111.575%0.74963%0.629SS**  trans-72.492.6166.9-172.483.6000106.5L181 V185L181-L183 PolarHBondContact O-N 3.11Å; L183-V185 VanDerWaalsContact C-N 3.29Å; L183-V185 HydrophobicContact CB-CG2 4.46Å; L183-V185 HydrophobicContact CD2-CG2 3.36Å; L183-V185 HydrophobicContact CG-CG2 3.69Å; L183-V185 PolarHBondContact O-N 3.49Å
184H62Low63Low159 Ų159106.7 Ų106.774%0.73661%0.612SS**  trans-71.792.9167.3-173.8-82.2000107.3S182 D186S182-H184 VanDerWaalsContact C-N 3.32Å; S182-H184 PolarHBondContact O-N 3.03Å; H184-D186 VanDerWaalsContact C-N 3.35Å; H184-D186 PolarHBondContact O-N 3.44Å
185V65.9Low64.8Low89 Ų89102.6 Ų102.654%0.53959%0.593SS.*  trans-74.992.2178-170.50000107.7L183 L187L183-V185 VanDerWaalsContact C-N 3.29Å; L183-V185 HydrophobicContact CB-CG2 4.46Å; L183-V185 HydrophobicContact CD2-CG2 3.36Å; L183-V185 HydrophobicContact CG-CG2 3.69Å; L183-V185 PolarHBondContact O-N 3.49Å; V185-L187 VanDerWaalsContact C-N 3.35Å; V185-L187 HydrophobicContact CG1-CD2 3.52Å; V185-L187 HydrophobicContact CG1-CG 3.71Å; V185-L187 PolarHBondContact O-N 2.75Å; V185-L187 VanDerWaalsContact O-N 3.14Å
186D65.9Low66.6Low130 Ų130103.9 Ų103.970%0.69559%0.594SS**  trans-82.187.4170.8-168.421.1000108.8H184 G188H184-D186 VanDerWaalsContact C-N 3.35Å; H184-D186 PolarHBondContact O-N 3.44Å; D186-G188 VanDerWaalsContact C-N 3.29Å; D186-G188 PolarHBondContact O-N 3.03Å
187L68.6Low68.4Low72 Ų7299.8 Ų99.838%0.37758%0.575SS.*  trans-72.990.5168.5-62.9-177000106.1V185 I191 L192V185-L187 VanDerWaalsContact C-N 3.35Å; V185-L187 HydrophobicContact CG1-CD2 3.52Å; V185-L187 HydrophobicContact CG1-CG 3.71Å; V185-L187 PolarHBondContact O-N 2.75Å; V185-L187 VanDerWaalsContact O-N 3.14Å; L187-I191 VanDerWaalsContact C-CG2 3.44Å; L187-I191 VanDerWaalsContact CA-CG2 3.47Å; L187-I191 HydrophobicContact CB-CG2 3.58Å; L187-I191 HydrophobicContact CD2-CD1 4.44Å; L187-I191 HydrophobicContact CD2-CG2 4.15Å; L187-I191 HydrophobicContact CG-CG2 4.42Å; L187-L192 HydrophobicContact CB-CD2 3.96Å; L187-L192 HydrophobicContact CB-CG 4.04Å; L187-L192 HydrophobicContact CD1-CD2 4.34Å; L187-L192 WeakPolarHBondContact O-CD1 3.36Å; L187-L192 WeakPolarHBondContact O-CG 3.35Å
188G79.3Confident70.3Confident26 Ų26101.3 Ų101.327%0.26857%0.574SS.*  trans-52.5164.7-179.800000113.2D186 S190 I191 L192D186-G188 VanDerWaalsContact C-N 3.29Å; D186-G188 PolarHBondContact O-N 3.03Å; G188-S190 PolarHBondContact O-N 3.03Å; G188-I191 WeakPolarHBondContact O-CG2 3.41Å; G188-I191 PolarHBondContact O-N 3.45Å; G188-L192 PolarHBondContact O-N 3.16Å
189P76.4Confident71.7Confident113 Ų113102.4 Ų102.473%0.73457%0.57SS**Hα-helixtrans-55.1-31-168.118.1-30.7000114.4D193P189-D193 WeakPolarHBondContact O-CB 3.14Å; P189-D193 PolarHBondContact O-N 3.38Å
190S71.3Confident73.3Confident96 Ų96102.3 Ų102.367%0.67156%0.563SS**Hα-helixtrans-68.3-37.6177.8-57.80000114.2G188 D194G188-S190 PolarHBondContact O-N 3.03Å; S190-D194 PolarHBondContact O-N 3.35Å
191I84.4Confident74.5Confident81 Ų81100.2 Ų100.242%0.41555%0.549SS..Hα-helixtrans-82.2-25.8178.8-173.8151.2000111.8L187 G188 V195L187-I191 VanDerWaalsContact C-CG2 3.44Å; L187-I191 VanDerWaalsContact CA-CG2 3.47Å; L187-I191 HydrophobicContact CB-CG2 3.58Å; L187-I191 HydrophobicContact CD2-CD1 4.44Å; L187-I191 HydrophobicContact CD2-CG2 4.15Å; L187-I191 HydrophobicContact CG-CG2 4.42Å; G188-I191 WeakPolarHBondContact O-CG2 3.41Å; G188-I191 PolarHBondContact O-N 3.45Å; I191-V195 WeakPolarHBondContact O-CB 3.39Å; I191-V195 VanDerWaalsContact O-CG2 3.23Å; I191-V195 WeakPolarHBondContact O-CG2 3.39Å; I191-V195 PolarHBondContact O-N 3.48Å; I191-V195 VanDerWaalsContact O-N 3.09Å
192L85.1Confident75.3Confident81 Ų8197.6 Ų97.642%0.42454%0.536SS..Hα-helixtrans-67.8-38.8169-71.7173.4000111.4L187 G188 V195 L196L187-L192 HydrophobicContact CB-CD2 3.96Å; L187-L192 HydrophobicContact CB-CG 4.04Å; L187-L192 HydrophobicContact CD1-CD2 4.34Å; L187-L192 WeakPolarHBondContact O-CD1 3.36Å; L187-L192 WeakPolarHBondContact O-CG 3.35Å; G188-L192 PolarHBondContact O-N 3.16Å; L192-V195 PolarHBondContact O-N 2.99Å; L192-L196 VanDerWaalsContact O-CB 3.3Å; L192-L196 WeakPolarHBondContact O-CB 3.48Å; L192-L196 WeakPolarHBondContact O-CD1 3.17Å; L192-L196 WeakPolarHBondContact O-CG 3.41Å; L192-L196 PolarHBondContact O-N 3.23Å
193D83.8Confident75.9Confident102 Ų10299.3 Ų99.355%0.54554%0.537SS..Hα-helixtrans-59.1-49174.9-160.566.9000111.1P189 V195 L196 Q197P189-D193 WeakPolarHBondContact O-CB 3.14Å; P189-D193 PolarHBondContact O-N 3.38Å; D193-V195 PolarHBondContact O-N 2.93Å; D193-L196 PolarHBondContact O-N 2.84Å; D193-Q197 VanDerWaalsContact O-CB 3.3Å; D193-Q197 WeakPolarHBondContact O-CB 3.24Å; D193-Q197 PolarHBondContact O-N 3.4Å
194D87.2Confident76.4Confident93 Ų9397.9 Ų97.950%0.49753%0.53SS..Hα-helixtrans-60.5-44.1176.8-69.2-12.4000112.4S190 Q197 I198S190-D194 PolarHBondContact O-N 3.35Å; D194-Q197 PolarHBondContact O-N 3.01Å; D194-I198 WeakPolarHBondContact O-CD1 3.17Å; D194-I198 VanDerWaalsContact O-CG1 3.24Å; D194-I198 WeakPolarHBondContact O-CG1 3.3Å; D194-I198 PolarHBondContact O-N 2.76Å
195V88.3Confident76.2Confident62 Ų6294.5 Ų94.538%0.37652%0.524SS..Hα-helixtrans-66.7-43.5179.2169.80000111.4I191 L192 D193 Q197 I198 M199I191-V195 WeakPolarHBondContact O-CB 3.39Å; I191-V195 VanDerWaalsContact O-CG2 3.23Å; I191-V195 WeakPolarHBondContact O-CG2 3.39Å; I191-V195 PolarHBondContact O-N 3.48Å; I191-V195 VanDerWaalsContact O-N 3.09Å; L192-V195 PolarHBondContact O-N 2.99Å; D193-V195 PolarHBondContact O-N 2.93Å; V195-Q197 VanDerWaalsContact C-N 3.34Å; V195-I198 PolarHBondContact O-N 2.84Å; V195-M199 HydrophobicContact CG1-SD 4.18Å; V195-M199 WeakPolarHBondContact O-CG 3.43Å; V195-M199 PolarHBondContact O-N 3.09Å
196L83.8Confident75.9Confident95 Ų9597.5 Ų97.550%0.49753%0.534SS..Hα-helixtrans-62.4-42.9175.4-72.8167.4000110.6L192 D193 I198 M199 D200L192-L196 VanDerWaalsContact O-CB 3.3Å; L192-L196 WeakPolarHBondContact O-CB 3.48Å; L192-L196 WeakPolarHBondContact O-CD1 3.17Å; L192-L196 WeakPolarHBondContact O-CG 3.41Å; L192-L196 PolarHBondContact O-N 3.23Å; D193-L196 PolarHBondContact O-N 2.84Å; L196-I198 VanDerWaalsContact C-N 3.29Å; L196-I198 PolarHBondContact O-N 3.21Å; L196-M199 PolarHBondContact O-N 2.83Å; L196-D200 WeakPolarHBondContact O-CB 3.25Å; L196-D200 PolarHBondContact O-N 3.34Å
197Q84.8Confident75.5Confident105 Ų10598.9 Ų98.949%0.49154%0.536SS..Hα-helixtrans-62.3-35.7177-166.9-173.8-19.100112.1D193 D194 V195 Q201D193-Q197 VanDerWaalsContact O-CB 3.3Å; D193-Q197 WeakPolarHBondContact O-CB 3.24Å; D193-Q197 PolarHBondContact O-N 3.4Å; D194-Q197 PolarHBondContact O-N 3.01Å; V195-Q197 VanDerWaalsContact C-N 3.34Å; Q197-Q201 WeakPolarHBondContact O-CB 3.41Å; Q197-Q201 WeakPolarHBondContact O-CG 3.41Å; Q197-Q201 PolarHBondContact O-N 3.34Å; Q197-Q201 PolarHBondContact O-NE2 3.21Å
198I87.4Confident75.1Confident94 Ų94102.4 Ų102.448%0.48255%0.554SS.*Hα-helixtrans-68.1-45.4175-70.8159.8000110.8D194 V195 L196 D200 Q201 D202D194-I198 WeakPolarHBondContact O-CD1 3.17Å; D194-I198 VanDerWaalsContact O-CG1 3.24Å; D194-I198 WeakPolarHBondContact O-CG1 3.3Å; D194-I198 PolarHBondContact O-N 2.76Å; V195-I198 PolarHBondContact O-N 2.84Å; L196-I198 VanDerWaalsContact C-N 3.29Å; L196-I198 PolarHBondContact O-N 3.21Å; I198-D200 VanDerWaalsContact C-N 3.27Å; I198-D200 PolarHBondContact O-N 2.98Å; I198-Q201 PolarHBondContact O-N 3.49Å; I198-D202 PolarHBondContact O-N 3Å; I198-D202 VanDerWaalsContact O-N 3.09Å
199M80.6Confident74.1Confident112 Ų112107 Ų10755%0.55258%0.579SS**Hα-helixtrans-62-36.3177.3-69175.761.200112.2V195 L196 L203V195-M199 HydrophobicContact CG1-SD 4.18Å; V195-M199 WeakPolarHBondContact O-CG 3.43Å; V195-M199 PolarHBondContact O-N 3.09Å; L196-M199 PolarHBondContact O-N 2.83Å; M199-L203 PolarHBondContact O-N 3.07Å
200D80.6Confident73Confident91 Ų91111.6 Ų111.649%0.48761%0.606SS.*Hα-helixtrans-73.4-34.9176.5-71.2-20.3000112.3L196 I198 D202 L203 D204L196-D200 WeakPolarHBondContact O-CB 3.25Å; L196-D200 PolarHBondContact O-N 3.34Å; I198-D200 VanDerWaalsContact C-N 3.27Å; I198-D200 PolarHBondContact O-N 2.98Å; D200-D202 VanDerWaalsContact C-N 3.32Å; D200-D202 PolarHBondContact O-N 3.04Å; D200-L203 WeakPolarHBondContact O-CB 3.4Å; D200-L203 PolarHBondContact O-N 2.9Å; D200-L203 VanDerWaalsContact O-N 3.16Å; D200-D204 PolarHBondContact O-N 3.36Å
201Q76.1Confident73.1Confident109 Ų109112.4 Ų112.451%0.50960%0.602SS.*Hα-helixtrans-63.7-36.9173.5-79.2170.987.500112.4Q197 I198 L203 D204 S205Q197-Q201 WeakPolarHBondContact O-CB 3.41Å; Q197-Q201 WeakPolarHBondContact O-CG 3.41Å; Q197-Q201 PolarHBondContact O-N 3.34Å; Q197-Q201 PolarHBondContact O-NE2 3.21Å; I198-Q201 PolarHBondContact O-N 3.49Å; Q201-L203 VanDerWaalsContact C-N 3.28Å; Q201-L203 PolarHBondContact O-N 3.34Å; Q201-D204 PolarHBondContact O-N 2.92Å; Q201-S205 WeakPolarHBondContact O-CB 3.45Å; Q201-S205 PolarHBondContact O-N 3.43Å
202D67.7Low72.5Confident105 Ų105114.1 Ų114.156%0.56161%0.612SS**Hα-helixtrans-67.3-32175.1-74.2-26.3000111.5I198 D200 S205I198-D202 PolarHBondContact O-N 3Å; I198-D202 VanDerWaalsContact O-N 3.09Å; D200-D202 VanDerWaalsContact C-N 3.32Å; D200-D202 PolarHBondContact O-N 3.04Å; D202-S205 PolarHBondContact O-N 3.02Å; D202-S205 PolarHBondContact O-OG 2.78Å
203L63.9Low71.8Confident128 Ų128115.9 Ų115.967%0.6762%0.623SS**Hα-helixtrans-69.9-38.1173.8-77163.3000112.6M199 D200 Q201 S205M199-L203 PolarHBondContact O-N 3.07Å; D200-L203 WeakPolarHBondContact O-CB 3.4Å; D200-L203 PolarHBondContact O-N 2.9Å; D200-L203 VanDerWaalsContact O-N 3.16Å; Q201-L203 VanDerWaalsContact C-N 3.28Å; Q201-L203 PolarHBondContact O-N 3.34Å; L203-S205 VanDerWaalsContact C-N 3.34Å
204D60.6Low71.1Confident113 Ų113116.7 Ų116.760%0.60463%0.627SS**Hα-helixtrans-74.6-23.7175.5-83.9-35.1000113.2D200 Q201 M206 Q207D200-D204 PolarHBondContact O-N 3.36Å; Q201-D204 PolarHBondContact O-N 2.92Å; D204-M206 PolarHBondContact O-N 2.99Å; D204-Q207 PolarHBondContact O-N 3.13Å
205S59.5Low70.1Confident87 Ų87118.2 Ų118.261%0.60864%0.635SS**THydrogen-bonded Turntrans-72.1-13.117780.90000113.9Q201 D202 L203Q201-S205 WeakPolarHBondContact O-CB 3.45Å; Q201-S205 PolarHBondContact O-N 3.43Å; D202-S205 PolarHBondContact O-N 3.02Å; D202-S205 PolarHBondContact O-OG 2.78Å; L203-S205 VanDerWaalsContact C-N 3.34Å
206M59.3Low68.9Low153 Ų153121.9 Ų121.975%0.75465%0.653SS**THydrogen-bonded Turntrans-97.235.4172.7-70.2-164.678.500113.1D204 I208D204-M206 PolarHBondContact O-N 2.99Å; M206-I208 PolarHBondContact O-N 2.93Å
207Q56Low67.9Low158 Ų158123.9 Ų123.974%0.73866%0.664SS**  trans-65.598.4161.5-81-174.451.800109.7D204D204-Q207 PolarHBondContact O-N 3.13Å
208I60.2Low66.6Low147 Ų147125.3 Ų125.375%0.75468%0.677SS**  trans-56.1123.7170.1-57.4164.3000107.6M206 T210M206-I208 PolarHBondContact O-N 2.93Å; I208-T210 PolarHBondContact O-N 3.14Å; I208-T210 VanDerWaalsContact O-N 3.13Å
209P59.1Low64.8Low121 Ų121127.9 Ų127.979%0.78669%0.693SS**  trans-66.2116170.626.8-30.4000108.3
210T54.6Low63.4Low211 Ų211129.4 Ų129.4100%1.29471%0.706SS**  trans-62.30165.540.70000112I208I208-T210 PolarHBondContact O-N 3.14Å; I208-T210 VanDerWaalsContact O-N 3.13Å

Retrieved 210 of 210 residues in 25.5 ms (Link to these results)