| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 54.3 | Low | 89.3 | Confident | 242 Ų | 242 | 55.5 Ų | 55.5 | 100% | 1.192 | 26% | 0.259 | S | S | * | . | 0 | 138 | 0 | -73.2 | 174.7 | 175.1 | 0 | 0 | 108.7 | R3 | M1-R3 PolarHBondContact O-N 3.17Š| |||
| 2 | K | 79.8 | Confident | 89.6 | Confident | 170 Ų | 170 | 50.8 Ų | 50.8 | 74% | 0.739 | 24% | 0.238 | S | C | * | . | trans | -80 | 112.5 | 173.3 | -69 | -174.3 | -179.1 | -172.3 | 0 | 107.7 | K89 | K2-K89 HydrophobicContact CD-CD 4.35Š| ||
| 3 | R | 90 | Very high | 89.7 | Confident | 70 Ų | 70 | 48.6 Ų | 48.6 | 26% | 0.264 | 23% | 0.231 | S | C | . | . | trans | -58.7 | 143.7 | 178 | -60.7 | -174.5 | 71.6 | -172.6 | 2.5 | 110.3 | M1 N90 I139 L140 S143 | M1-R3 PolarHBondContact O-N 3.17Å; R3-N90 PolarHBondContact O-N 2.89Å; R3-I139 HydrophobicContact CB-CD1 3.78Å; R3-I139 HydrophobicContact CB-CG2 4.44Å; R3-I139 VanDerWaalsContact NH1-CG2 3.26Å; R3-L140 PolarHBondContact NH1-O 2.86Å; R3-S143 VanDerWaalsContact CZ-O 3.26Å; R3-S143 PolarHBondContact NH1-O 2.81Å; R3-S143 PolarHBondContact NH2-O 3.25Å | ||
| 4 | Q | 93.6 | Very high | 89.7 | Confident | 73 Ų | 73 | 45.1 Ų | 45.1 | 34% | 0.341 | 22% | 0.215 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -121.1 | 160.7 | -178.7 | -72.5 | 179.2 | -58.8 | 0 | 0 | 110.3 | T88 K89 I239 | Q4-T88 CarbonylContact C-O 3.56Å; Q4-T88 VanDerWaalsContact CA-O 3.29Å; Q4-T88 WeakPolarHBondContact CA-O 3.47Å; Q4-T88 WeakPolarHBondContact CB-O 3.4Å; Q4-K89 HydrophobicContact CG-CG 3.91Å; Q4-I239 HydrophobicContact CB-CD1 3.66Å; Q4-I239 HydrophobicContact CB-CG1 3.46Å; Q4-I239 VanDerWaalsContact CB-CG1 3.46Å; Q4-I239 PolarHBondContact O-N 3.38Å |
| 5 | V | 95.3 | Very high | 89.7 | Confident | 0 Ų | 0 | 49.6 Ų | 49.6 | 0% | 0 | 23% | 0.228 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -142.8 | 140 | 177.9 | 61 | 0 | 0 | 0 | 0 | 109.1 | L7 T88 P137 I139 L146 P236 N237 I238 | V5-L7 HydrophobicContact CG1-CD2 4.21Å; V5-L7 HydrophobicContact CG1-CG 4.32Å; V5-L7 HydrophobicContact CG2-CD2 3.88Å; V5-T88 HydrophobicContact CG1-CG2 3.66Å; V5-T88 PolarHBondContact N-O 2.85Å; V5-T88 PolarHBondContact O-N 2.79Å; V5-P137 HydrophobicContact CG1-CB 3.79Å; V5-P137 HydrophobicContact CG1-CG 3.67Å; V5-I139 HydrophobicContact CB-CD1 4.13Å; V5-I139 HydrophobicContact CG1-CD1 4.35Å; V5-L146 HydrophobicContact CG2-CD2 4.43Å; V5-P236 HydrophobicContact CG2-CB 3.8Å; V5-N237 CarbonylContact C-O 3.51Å; V5-N237 WeakPolarHBondContact CA-O 3.27Å; V5-I238 HydrophobicContact CG2-CG1 4.38Å |
| 6 | V | 96.6 | Very high | 89.3 | Confident | 28 Ų | 28 | 47.3 Ų | 47.3 | 17% | 0.17 | 22% | 0.218 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -95.8 | 113.5 | 169 | -173 | 0 | 0 | 0 | 0 | 108 | S85 A86 V87 P236 N237 I239 | V6-S85 WeakPolarHBondContact CG1-OG 3.49Å; V6-A86 CarbonylContact C-O 3.58Å; V6-A86 WeakPolarHBondContact CA-O 3.26Å; V6-V87 HydrophobicContact CG1-CG2 4.46Å; V6-V87 HydrophobicContact CG2-CG1 4.46Å; V6-V87 HydrophobicContact CG2-CG2 4.05Å; V6-P236 CarbonylContact O-C 3.53Å; V6-P236 WeakPolarHBondContact O-CA 3.48Å; V6-N237 HydrophobicContact CB-CB 4.49Å; V6-N237 PolarHBondContact N-O 2.92Å; V6-N237 PolarHBondContact O-N 2.78Å; V6-I239 HydrophobicContact CG2-CD1 4.42Å; V6-I239 HydrophobicContact CG2-CG2 3.98Å |
| 7 | L | 96.2 | Very high | 88.4 | Confident | 1 Ų | 1 | 47.9 Ų | 47.9 | 1% | 0.005 | 23% | 0.225 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -94.1 | 110 | 175.7 | -59.2 | 178.3 | 0 | 0 | 0 | 108.5 | V5 S85 A86 T88 V94 L135 P137 L148 P236 | V5-L7 HydrophobicContact CG1-CD2 4.21Å; V5-L7 HydrophobicContact CG1-CG 4.32Å; V5-L7 HydrophobicContact CG2-CD2 3.88Å; L7-S85 WeakPolarHBondContact O-CA 3.32Å; L7-A86 PolarHBondContact N-O 3.41Å; L7-A86 PolarHBondContact O-N 2.77Å; L7-T88 HydrophobicContact CD1-CG2 4.05Å; L7-T88 HydrophobicContact CG-CG2 4.41Å; L7-V94 HydrophobicContact CD1-CB 4.46Å; L7-V94 HydrophobicContact CD1-CG2 4.09Å; L7-L135 HydrophobicContact CB-CD1 4.38Å; L7-L135 HydrophobicContact CD1-CB 3.83Å; L7-L135 HydrophobicContact CD1-CD1 3.96Å; L7-P137 HydrophobicContact CD1-CG 4.37Å; L7-L148 HydrophobicContact CD1-CD1 4.44Å; L7-L148 HydrophobicContact CD2-CD1 4.28Å; L7-P236 HydrophobicContact CD2-CB 3.73Å |
| 8 | N | 95.7 | Very high | 87 | Confident | 23 Ų | 23 | 54.8 Ų | 54.8 | 12% | 0.123 | 25% | 0.249 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -95 | 119.6 | 172.8 | -59.1 | -85.8 | 0 | 0 | 0 | 108.7 | T63 S85 I234 T235 N237 | N8-T63 HydrophobicContact CB-CG2 4.19Å; N8-S85 PolarHBondContact OD1-OG 2.75Å; N8-I234 CarbonylContact O-C 3.57Å; N8-I234 WeakPolarHBondContact O-CA 3.3Å; N8-T235 PolarHBondContact N-O 2.9Å; N8-T235 PolarHBondContact ND2-O 2.79Å; N8-T235 PolarHBondContact O-N 3.11Å; N8-N237 PolarHBondContact ND2-ND2 3.07Å |
| 9 | V | 94.8 | Very high | 85.5 | Confident | 1 Ų | 1 | 60.7 Ų | 60.7 | 1% | 0.006 | 28% | 0.283 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.6 | 131.9 | -179 | -178.5 | 0 | 0 | 0 | 0 | 108.8 | I11 R83 N84 M96 M133 L135 V232 L233 I234 | V9-I11 HydrophobicContact CG1-CG1 4.27Å; V9-R83 WeakPolarHBondContact O-CA 3.28Å; V9-N84 PolarHBondContact N-O 3.25Å; V9-N84 PolarHBondContact O-N 3.01Å; V9-N84 VanDerWaalsContact O-O 3.12Å; V9-M96 HydrophobicContact CB-CE 3.92Å; V9-M96 HydrophobicContact CB-SD 3.99Å; V9-M96 HydrophobicContact CG1-CE 3.85Å; V9-M96 HydrophobicContact CG1-SD 4.23Å; V9-M96 HydrophobicContact CG2-CE 4.36Å; V9-M96 HydrophobicContact CG2-SD 3.75Å; V9-M133 HydrophobicContact CB-CE 4.32Å; V9-M133 HydrophobicContact CG1-CE 3.57Å; V9-M133 HydrophobicContact CG2-CE 3.87Å; V9-L135 HydrophobicContact CG2-CD1 3.6Å; V9-V232 HydrophobicContact CG1-CG1 4.15Å; V9-L233 CarbonylContact C-O 3.52Å; V9-L233 VanDerWaalsContact CA-O 3.32Å; V9-L233 WeakPolarHBondContact CA-O 3.37Å; V9-I234 HydrophobicContact CG2-CG1 4.37Å; V9-I234 HydrophobicContact CG2-CG2 4.26Å |
| 10 | E | 94.3 | Very high | 83.9 | Confident | 0 Ų | 0 | 61.8 Ų | 61.8 | 0% | 0 | 29% | 0.288 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.3 | 125.9 | 171.4 | 177.1 | 165.4 | -135 | 0 | 0 | 110 | L12 T63 G64 V80 T82 R83 L233 | E10-L12 HydrophobicContact CG-CD2 3.75Å; E10-L12 HydrophobicContact CG-CG 4.33Å; E10-T63 HydrophobicContact CB-CG2 3.8Å; E10-T63 VanDerWaalsContact OE2-CA 3.22Å; E10-T63 WeakPolarHBondContact OE2-CA 2.93Å; E10-G64 PolarHBondContact OE2-N 2.9Å; E10-V80 HydrophobicContact CG-CG1 4.28Å; E10-T82 WeakPolarHBondContact CA-O 3.31Å; E10-R83 IonicContact OE1-CZ 3.25Å; E10-R83 IonicContact OE1-NE 3.48Å; E10-R83 PolarHBondContact OE1-NE 3.06Å; E10-R83 IonicContact OE1-NH2 3.46Å; E10-R83 PolarHBondContact OE1-NH2 3.45Å; E10-L233 HydrophobicContact CB-CB 4.37Å; E10-L233 PolarHBondContact N-O 3Å; E10-L233 PolarHBondContact O-N 2.96Å |
| 11 | I | 92.3 | Very high | 82.5 | Confident | 2 Ų | 2 | 65.1 Ų | 65.1 | 1% | 0.01 | 30% | 0.304 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.7 | 122.2 | -179.7 | -54.5 | 167.5 | 0 | 0 | 0 | 107 | V9 V81 T82 I98 F131 V232 | V9-I11 HydrophobicContact CG1-CG1 4.27Å; I11-V81 HydrophobicContact CB-CB 4.33Å; I11-V81 HydrophobicContact CG2-CB 4.13Å; I11-V81 PolarHBondContact O-N 3.37Å; I11-T82 PolarHBondContact N-O 3.44Å; I11-T82 PolarHBondContact O-N 2.86Å; I11-I98 HydrophobicContact CD1-CD1 3.93Å; I11-F131 HydrophobicContact CD1-CD1 3.59Å; I11-F131 HydrophobicContact CD1-CE1 3.28Å; I11-F131 HydrophobicContact CD1-CG 4.4Å; I11-F131 HydrophobicContact CD1-CZ 3.88Å; I11-F131 HydrophobicContact CG1-CE1 4.35Å; I11-V232 HydrophobicContact CG1-CG1 4.39Å; I11-V232 HydrophobicContact CG1-CG2 4.39Å; I11-V232 HydrophobicContact CG2-CG2 4.48Å |
| 12 | L | 92.6 | Very high | 82.9 | Confident | 0 Ų | 0 | 55.9 Ų | 55.9 | 0% | 0 | 27% | 0.266 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.1 | 141.3 | 178.5 | -52.6 | 178.9 | 0 | 0 | 0 | 108.9 | E10 I14 F68 L69 L72 S79 V80 L230 V231 L233 | E10-L12 HydrophobicContact CG-CD2 3.75Å; E10-L12 HydrophobicContact CG-CG 4.33Å; L12-I14 HydrophobicContact CB-CD1 4.25Å; L12-F68 HydrophobicContact CD1-CE1 4.38Å; L12-L69 HydrophobicContact CD1-CD1 4.14Å; L12-L69 HydrophobicContact CD2-CD1 4.32Å; L12-L72 HydrophobicContact CD1-CD1 3.65Å; L12-S79 CarbonylContact C-O 3.57Å; L12-S79 WeakPolarHBondContact CA-O 3.29Å; L12-V80 HydrophobicContact CD2-CB 4.27Å; L12-V80 HydrophobicContact CD2-CG1 4.4Å; L12-V80 HydrophobicContact CD2-CG2 3.76Å; L12-L230 CarbonylContact O-C 3.48Å; L12-L230 WeakPolarHBondContact O-CA 3.41Å; L12-V231 HydrophobicContact CB-CB 4.36Å; L12-V231 PolarHBondContact N-O 2.94Å; L12-V231 PolarHBondContact O-N 3.22Å; L12-L233 HydrophobicContact CD1-CD1 4.05Å |
| 13 | S | 91 | Very high | 82.7 | Confident | 22 Ų | 22 | 47.9 Ų | 47.9 | 15% | 0.154 | 23% | 0.231 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -109.1 | 128.7 | 165.8 | 63.5 | 0 | 0 | 0 | 0 | 108.9 | V78 S79 I229 | S13-V78 WeakPolarHBondContact O-CA 3.29Å; S13-S79 PolarHBondContact N-O 3.31Å; S13-S79 PolarHBondContact O-N 3.49Å; S13-I229 CarbonylContact C-O 3.57Å; S13-I229 WeakPolarHBondContact CA-O 3.34Å |
| 14 | I | 89.6 | Confident | 82.2 | Confident | 0 Ų | 0 | 44.6 Ų | 44.6 | 0% | 0 | 22% | 0.219 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -112.5 | 114 | 175.6 | -56.1 | 85.1 | 0 | 0 | 0 | 106.9 | L12 I24 D77 V78 T228 I229 V231 | L12-I14 HydrophobicContact CB-CD1 4.25Å; I14-I24 HydrophobicContact CD1-CD1 4.07Å; I14-I24 HydrophobicContact CG1-CD1 4.4Å; I14-D77 WeakPolarHBondContact CA-O 2.98Å; I14-V78 HydrophobicContact CG1-CG2 4.11Å; I14-V78 HydrophobicContact CG2-CG2 4.49Å; I14-T228 WeakPolarHBondContact O-CA 3.12Å; I14-I229 PolarHBondContact N-O 3.48Å; I14-I229 PolarHBondContact O-N 3.41Å; I14-V231 HydrophobicContact CD1-CB 3.84Å; I14-V231 HydrophobicContact CD1-CG2 3.4Å |
| 15 | R | 89 | Confident | 81.6 | Confident | 112 Ų | 112 | 43 Ų | 43 | 42% | 0.423 | 21% | 0.213 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -100.3 | 131.5 | -179.5 | -177 | -174.7 | 66.5 | -173.7 | 1.2 | 110.3 | G76 D77 D226 D227 | R15-G76 WeakPolarHBondContact O-CA 3.26Å; R15-D77 HydrophobicContact CB-CB 4.25Å; R15-D77 IonicContact CZ-OD2 3.55Å; R15-D77 PolarHBondContact N-O 2.9Å; R15-D77 IonicContact NE-OD2 2.72Å; R15-D77 PolarHBondContact NE-OD2 2.62Å; R15-D77 IonicContact NH2-OD2 2.76Å; R15-D77 PolarHBondContact NH2-OD2 3.48Å; R15-D77 PolarHBondContact O-N 3.05Å; R15-D226 VanDerWaalsContact CD-OD1 3.26Å; R15-D226 WeakPolarHBondContact CD-OD1 3.4Å; R15-D226 VanDerWaalsContact CD-OD2 3.3Å; R15-D226 WeakPolarHBondContact CD-OD2 3.49Å; R15-D226 WeakPolarHBondContact CG-OD1 3.27Å; R15-D227 CarbonylContact C-O 3.47Å; R15-D227 WeakPolarHBondContact CA-O 3.3Å |
| 16 | K | 83.3 | Confident | 80.8 | Confident | 13 Ų | 13 | 43.2 Ų | 43.2 | 6% | 0.057 | 21% | 0.214 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -123.1 | 115.3 | 179.3 | -57.6 | -176.3 | 76 | 178.2 | 0 | 109.4 | Q21 G23 Q75 D226 D227 I229 | K16-Q21 PolarHBondContact NZ-O 3.43Å; K16-G23 PolarHBondContact NZ-O 2.74Å; K16-Q75 VanDerWaalsContact CE-O 3.29Å; K16-Q75 WeakPolarHBondContact CE-O 3.26Å; K16-D226 WeakPolarHBondContact O-CA 3.11Å; K16-D227 PolarHBondContact N-O 2.89Å; K16-D227 PolarHBondContact O-N 2.94Å; K16-I229 HydrophobicContact CD-CD1 4.38Å |
| 17 | T | 74.1 | Confident | 79.9 | Confident | 57 Ų | 57 | 45.2 Ų | 45.2 | 35% | 0.35 | 22% | 0.223 | S | C | . | . | trans | -96.8 | -9.1 | -174.4 | 51.8 | 0 | 0 | 0 | 0 | 114 | N225 | T17-N225 CarbonylContact C-O 3.6Š| ||
| 18 | R | 64.5 | Low | 78.9 | Confident | 172 Ų | 172 | 47 Ų | 47 | 65% | 0.649 | 24% | 0.238 | S | C | * | . | S | Bend | trans | -100.9 | 161.4 | -177.3 | -71.9 | 171.4 | 175.4 | 178 | 3.7 | 109.9 | E20 | R18-E20 HydrophobicContact CB-CB 4.3Å; R18-E20 HydrophobicContact CB-CG 3.65Å; R18-E20 WeakPolarHBondContact CD-OE1 3.33Å; R18-E20 IonicContact NH1-OE1 3.41Å; R18-E20 PolarHBondContact NH1-OE1 3.01Å; R18-E20 PolarHBondContact O-N 3.06Å |
| 19 | N | 57.6 | Low | 78.2 | Confident | 168 Ų | 168 | 45.9 Ų | 45.9 | 90% | 0.898 | 23% | 0.233 | S | C | * | . | S | Bend | trans | -63.2 | 22.4 | 169.1 | -127.9 | 21.4 | 0 | 0 | 0 | 113.1 | ||
| 20 | E | 53.1 | Low | 77.4 | Confident | 81 Ų | 81 | 47.3 Ų | 47.3 | 38% | 0.379 | 24% | 0.238 | S | C | . | . | trans | -65.2 | 146.7 | 173.9 | -72.2 | 166.9 | -175.5 | 0 | 0 | 108.7 | R18 A22 | R18-E20 HydrophobicContact CB-CB 4.3Å; R18-E20 HydrophobicContact CB-CG 3.65Å; R18-E20 WeakPolarHBondContact CD-OE1 3.33Å; R18-E20 IonicContact NH1-OE1 3.41Å; R18-E20 PolarHBondContact NH1-OE1 3.01Å; R18-E20 PolarHBondContact O-N 3.06Å; E20-A22 PolarHBondContact O-N 3.4Å | ||
| 21 | Q | 54.5 | Low | 76.4 | Confident | 133 Ų | 133 | 51.7 Ų | 51.7 | 62% | 0.621 | 27% | 0.269 | S | S | * | . | trans | -45.3 | 137.5 | -175.7 | -63.1 | 167.8 | -13.3 | 0 | 0 | 112 | K16 G23 T50 | K16-Q21 PolarHBondContact NZ-O 3.43Å; Q21-G23 PolarHBondContact O-N 3.43Å; Q21-T50 HydrophobicContact CB-CG2 4Å; Q21-T50 PolarHBondContact OE1-OG1 3.25Å | ||
| 22 | A | 63.3 | Low | 75.3 | Confident | 48 Ų | 48 | 54 Ų | 54 | 40% | 0.397 | 28% | 0.282 | S | S | . | . | S | Bend | trans | -61.9 | 122.6 | 172.9 | 0 | 0 | 0 | 0 | 0 | 109.4 | E20 T50 T52 | E20-A22 PolarHBondContact O-N 3.4Å; A22-T50 WeakPolarHBondContact O-CG2 3.49Å; A22-T52 HydrophobicContact CB-CG2 4.28Å |
| 23 | G | 74.7 | Confident | 73.8 | Confident | 1 Ų | 1 | 65.4 Ų | 65.4 | 1% | 0.01 | 33% | 0.325 | C | S | . | . | S | Bend | trans | 114.9 | -176.4 | 178.5 | 0 | 0 | 0 | 0 | 0 | 114.9 | K16 Q21 | K16-G23 PolarHBondContact NZ-O 2.74Å; Q21-G23 PolarHBondContact O-N 3.43Å |
| 24 | I | 80.3 | Confident | 72.6 | Confident | 2 Ų | 2 | 68.5 Ų | 68.5 | 1% | 0.01 | 34% | 0.343 | C | S | . | . | B | Isolated β-bridge | trans | -112 | 129.8 | -179.8 | -63.4 | 170.4 | 0 | 0 | 0 | 107.7 | I14 W26 V29 V51 L72 Q75 I229 V231 | I14-I24 HydrophobicContact CD1-CD1 4.07Å; I14-I24 HydrophobicContact CG1-CD1 4.4Å; I24-W26 HydrophobicContact CB-CD2 4.43Å; I24-W26 HydrophobicContact CB-CZ2 4.25Å; I24-W26 HydrophobicContact CD1-CH2 4.19Å; I24-W26 HydrophobicContact CD1-CZ2 3.72Å; I24-W26 HydrophobicContact CG2-CD2 3.74Å; I24-W26 HydrophobicContact CG2-CE3 4.09Å; I24-W26 HydrophobicContact CG2-CG 4.12Å; I24-W26 HydrophobicContact CG2-CH2 4.34Å; I24-W26 HydrophobicContact CG2-CZ2 4.01Å; I24-W26 HydrophobicContact CG2-CZ3 4.37Å; I24-W26 PolarHBondContact O-N 2.66Å; I24-V29 HydrophobicContact CG2-CG2 4.18Å; I24-V51 PolarHBondContact N-O 2.88Å; I24-V51 PolarHBondContact O-N 2.85Å; I24-L72 HydrophobicContact CG2-CD2 4.42Å; I24-Q75 HydrophobicContact CG2-CG 4.2Å; I24-I229 HydrophobicContact CD1-CB 4.45Å; I24-I229 HydrophobicContact CD1-CD1 4.49Å; I24-I229 HydrophobicContact CD1-CG2 3.86Å; I24-I229 HydrophobicContact CG1-CD1 3.9Å; I24-I229 HydrophobicContact CG1-CG2 4.39Å; I24-V231 HydrophobicContact CD1-CG2 3.48Å; I24-V231 VanDerWaalsContact CD1-CG2 3.48Å |
| 25 | D | 80.2 | Confident | 71.3 | Confident | 39 Ų | 39 | 69.4 Ų | 69.4 | 21% | 0.209 | 35% | 0.348 | C | S | . | . | trans | -81 | 92.4 | 167 | -177.6 | -16.8 | 0 | 0 | 0 | 108.3 | N27 A28 V29 Q75 | D25-N27 VanDerWaalsContact C-N 3.26Å; D25-N27 PolarHBondContact O-N 3.45Å; D25-N27 WeakPolarHBondContact OD1-CA 3.4Å; D25-N27 WeakPolarHBondContact OD1-CB 3.1Å; D25-N27 PolarHBondContact OD1-N 2.83Å; D25-A28 HydrophobicContact CB-CB 4.04Å; D25-A28 VanDerWaalsContact CG-CB 3.48Å; D25-A28 PolarHBondContact O-N 2.92Å; D25-A28 PolarHBondContact OD1-N 3.03Å; D25-V29 WeakPolarHBondContact O-CG2 3.09Å; D25-V29 PolarHBondContact O-N 3.09Å; D25-V29 VanDerWaalsContact O-N 3.15Å; D25-Q75 VanDerWaalsContact N-OE1 3.1Å | ||
| 26 | W | 80 | Confident | 69.9 | Low | 5 Ų | 5 | 67.7 Ų | 67.7 | 2% | 0.019 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -67.9 | -29.1 | 179.7 | -70.5 | 103.3 | 0 | 0 | 0 | 112.1 | I24 V29 F30 F43 F68 L72 I193 V231 | I24-W26 HydrophobicContact CB-CD2 4.43Å; I24-W26 HydrophobicContact CB-CZ2 4.25Å; I24-W26 HydrophobicContact CD1-CH2 4.19Å; I24-W26 HydrophobicContact CD1-CZ2 3.72Å; I24-W26 HydrophobicContact CG2-CD2 3.74Å; I24-W26 HydrophobicContact CG2-CE3 4.09Å; I24-W26 HydrophobicContact CG2-CG 4.12Å; I24-W26 HydrophobicContact CG2-CH2 4.34Å; I24-W26 HydrophobicContact CG2-CZ2 4.01Å; I24-W26 HydrophobicContact CG2-CZ3 4.37Å; I24-W26 PolarHBondContact O-N 2.66Å; W26-V29 HydrophobicContact CE3-CB 4.44Å; W26-V29 HydrophobicContact CE3-CG1 4.43Å; W26-V29 PolarHBondContact O-N 2.84Å; W26-F30 HydrophobicContact CB-CD2 4.3Å; W26-F30 HydrophobicContact CB-CE2 4.32Å; W26-F30 HydrophobicContact CD2-CE2 4.34Å; W26-F30 HydrophobicContact CE3-CD2 4.36Å; W26-F30 AromaticContact CE3-CE2 3.54Å; W26-F30 HydrophobicContact CE3-CE2 3.54Å; W26-F30 HydrophobicContact CE3-CZ 4.08Å; W26-F30 HydrophobicContact CZ3-CE2 4.25Å; W26-F30 HydrophobicContact CZ3-CZ 4.35Å; W26-F30 WeakPolarHBondContact O-CD2 3.48Å; W26-F30 PolarHBondContact O-N 3.23Å; W26-F43 HydrophobicContact CB-CD2 4.36Å; W26-F43 HydrophobicContact CB-CE1 4.01Å; W26-F43 HydrophobicContact CB-CE2 3.69Å; W26-F43 HydrophobicContact CB-CZ 3.51Å; W26-F43 AromaticContact CD1-CE2 3.81Å; W26-F43 AromaticContact CD1-CZ 3.37Å; W26-F43 HydrophobicContact CD2-CE2 4.37Å; W26-F43 HydrophobicContact CG-CE1 4.46Å; W26-F43 AromaticContact CG-CE2 3.65Å; W26-F43 HydrophobicContact CG-CE2 3.65Å; W26-F43 AromaticContact CG-CZ 3.54Å; W26-F43 HydrophobicContact CG-CZ 3.54Å; W26-F68 HydrophobicContact CZ3-CE2 4.32Å; W26-F68 AromaticContact CZ3-CZ 3.92Å; W26-F68 HydrophobicContact CZ3-CZ 3.92Å; W26-L72 HydrophobicContact CH2-CD2 4.16Å; W26-L72 HydrophobicContact CZ3-CD2 3.89Å; W26-I193 HydrophobicContact CH2-CG2 3.62Å; W26-I193 HydrophobicContact CZ2-CG2 4.14Å; W26-I193 HydrophobicContact CZ3-CG2 4.06Å; W26-V231 HydrophobicContact CH2-CG1 3.87Å; W26-V231 HydrophobicContact CH2-CG2 3.87Å; W26-V231 HydrophobicContact CZ2-CG1 4.45Å; W26-V231 HydrophobicContact CZ2-CG2 3.9Å |
| 27 | N | 76.2 | Confident | 68.8 | Low | 69 Ų | 69 | 70 Ų | 70 | 37% | 0.369 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -65.2 | -43.7 | 177 | -71.2 | -28.9 | 0 | 0 | 0 | 110.1 | D25 F30 S31 D49 | D25-N27 VanDerWaalsContact C-N 3.26Å; D25-N27 PolarHBondContact O-N 3.45Å; D25-N27 WeakPolarHBondContact OD1-CA 3.4Å; D25-N27 WeakPolarHBondContact OD1-CB 3.1Å; D25-N27 PolarHBondContact OD1-N 2.83Å; N27-F30 PolarHBondContact O-N 2.89Å; N27-S31 WeakPolarHBondContact O-CB 3.42Å; N27-S31 PolarHBondContact O-N 2.81Å; N27-S31 PolarHBondContact O-OG 2.92Å; N27-D49 PolarHBondContact ND2-OD1 2.79Å |
| 28 | A | 76.5 | Confident | 67.9 | Low | 39 Ų | 39 | 71.4 Ų | 71.4 | 32% | 0.322 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -62.9 | -43.3 | 174 | 0 | 0 | 0 | 0 | 0 | 112.3 | D25 F30 S31 D32 | D25-A28 HydrophobicContact CB-CB 4.04Å; D25-A28 VanDerWaalsContact CG-CB 3.48Å; D25-A28 PolarHBondContact O-N 2.92Å; D25-A28 PolarHBondContact OD1-N 3.03Å; A28-F30 PolarHBondContact O-N 3.4Å; A28-S31 PolarHBondContact O-N 3.45Å; A28-D32 PolarHBondContact O-N 3.34Å |
| 29 | V | 80.8 | Confident | 67.4 | Low | 0 Ų | 0 | 66.6 Ų | 66.6 | 0% | 0 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -59.2 | -48.6 | 177 | 173.7 | 0 | 0 | 0 | 0 | 110.8 | I24 D25 W26 D32 L35 F68 A71 L72 Q75 | I24-V29 HydrophobicContact CG2-CG2 4.18Å; D25-V29 WeakPolarHBondContact O-CG2 3.09Å; D25-V29 PolarHBondContact O-N 3.09Å; D25-V29 VanDerWaalsContact O-N 3.15Å; W26-V29 HydrophobicContact CE3-CB 4.44Å; W26-V29 HydrophobicContact CE3-CG1 4.43Å; W26-V29 PolarHBondContact O-N 2.84Å; V29-D32 WeakPolarHBondContact O-CB 3.21Å; V29-D32 PolarHBondContact O-N 3.45Å; V29-L35 WeakPolarHBondContact O-CD1 3.4Å; V29-F68 HydrophobicContact CG1-CD2 4.23Å; V29-F68 HydrophobicContact CG1-CE2 3.79Å; V29-A71 HydrophobicContact CG1-CB 4.03Å; V29-L72 HydrophobicContact CG1-CD2 4.09Å; V29-L72 HydrophobicContact CG1-CG 4.22Å; V29-L72 HydrophobicContact CG2-CD2 3.92Å; V29-Q75 HydrophobicContact CG2-CG 3.44Å; V29-Q75 VanDerWaalsContact CG2-CG 3.44Å |
| 30 | F | 78.4 | Confident | 67.1 | Low | 30 Ų | 30 | 59 Ų | 59 | 13% | 0.132 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -81.5 | -20 | -176.2 | -70.8 | -61.5 | 0 | 0 | 0 | 114.8 | W26 N27 A28 D32 L35 L39 V58 F68 I193 | W26-F30 HydrophobicContact CB-CD2 4.3Å; W26-F30 HydrophobicContact CB-CE2 4.32Å; W26-F30 HydrophobicContact CD2-CE2 4.34Å; W26-F30 HydrophobicContact CE3-CD2 4.36Å; W26-F30 AromaticContact CE3-CE2 3.54Å; W26-F30 HydrophobicContact CE3-CE2 3.54Å; W26-F30 HydrophobicContact CE3-CZ 4.08Å; W26-F30 HydrophobicContact CZ3-CE2 4.25Å; W26-F30 HydrophobicContact CZ3-CZ 4.35Å; W26-F30 WeakPolarHBondContact O-CD2 3.48Å; W26-F30 PolarHBondContact O-N 3.23Å; N27-F30 PolarHBondContact O-N 2.89Å; A28-F30 PolarHBondContact O-N 3.4Å; F30-D32 PolarHBondContact O-N 2.86Å; F30-L35 HydrophobicContact CD1-CD1 3.84Å; F30-L35 HydrophobicContact CE1-CD1 4.47Å; F30-L39 HydrophobicContact CB-CD1 3.83Å; F30-L39 HydrophobicContact CD1-CD1 3.38Å; F30-L39 HydrophobicContact CD2-CD1 4.02Å; F30-L39 HydrophobicContact CE1-CD1 3.96Å; F30-L39 HydrophobicContact CG-CD1 3.45Å; F30-L39 VanDerWaalsContact CG-CD1 3.45Å; F30-V58 HydrophobicContact CE1-CG2 4.13Å; F30-V58 HydrophobicContact CZ-CG2 4.17Å; F30-F68 HydrophobicContact CE1-CD2 4.33Å; F30-F68 AromaticContact CE1-CE2 3.79Å; F30-F68 HydrophobicContact CE1-CE2 3.79Å; F30-F68 AromaticContact CZ-CE2 3.81Å; F30-F68 HydrophobicContact CZ-CE2 3.81Å; F30-F68 HydrophobicContact CZ-CZ 4.46Å; F30-I193 HydrophobicContact CE1-CD1 4.27Å; F30-I193 HydrophobicContact CE2-CD1 4.28Å; F30-I193 HydrophobicContact CZ-CD1 3.43Å; F30-I193 VanDerWaalsContact CZ-CD1 3.43Å |
| 31 | S | 72.9 | Confident | 66.8 | Low | 92 Ų | 92 | 58.8 Ų | 58.8 | 64% | 0.643 | 35% | 0.345 | S | S | * | . | H | α-helix | trans | -74.4 | -11.4 | 171.9 | -62.2 | 0 | 0 | 0 | 0 | 112.5 | N27 A28 R33 | N27-S31 WeakPolarHBondContact O-CB 3.42Å; N27-S31 PolarHBondContact O-N 2.81Å; N27-S31 PolarHBondContact O-OG 2.92Å; A28-S31 PolarHBondContact O-N 3.45Å; S31-R33 PolarHBondContact O-N 2.78Å |
| 32 | D | 68.1 | Low | 66.3 | Low | 52 Ų | 52 | 57.4 Ų | 57.4 | 28% | 0.278 | 35% | 0.346 | S | S | . | . | trans | -61.7 | 111.3 | 173.6 | -168.3 | -32.9 | 0 | 0 | 0 | 110.2 | A28 V29 F30 T34 L35 A71 | A28-D32 PolarHBondContact O-N 3.34Å; V29-D32 WeakPolarHBondContact O-CB 3.21Å; V29-D32 PolarHBondContact O-N 3.45Å; F30-D32 PolarHBondContact O-N 2.86Å; D32-T34 PolarHBondContact O-N 3.44Å; D32-T34 VanDerWaalsContact OD1-CB 3.26Å; D32-T34 WeakPolarHBondContact OD1-CB 3.26Å; D32-T34 VanDerWaalsContact OD1-CG2 3.29Å; D32-T34 WeakPolarHBondContact OD1-CG2 3.22Å; D32-T34 PolarHBondContact OD1-N 3.49Å; D32-T34 PolarHBondContact OD1-OG1 2.75Å; D32-T34 PolarHBondContact OD2-OG1 3.3Å; D32-L35 HydrophobicContact CB-CG 4.44Å; D32-L35 WeakPolarHBondContact O-CB 3.46Å; D32-L35 PolarHBondContact O-N 2.98Å; D32-A71 HydrophobicContact CB-CB 3.95Å | ||
| 33 | R | 62.5 | Low | 65.5 | Low | 238 Ų | 238 | 56.5 Ų | 56.5 | 90% | 0.898 | 33% | 0.333 | S | S | * | . | G | 310 helix | trans | -59.1 | -19.7 | -177.5 | -57.4 | -175.1 | 81.2 | -170.8 | 5.8 | 112.6 | S31 L35 | S31-R33 PolarHBondContact O-N 2.78Å; R33-L35 PolarHBondContact O-N 2.78Å |
| 34 | T | 65 | Low | 64.1 | Low | 88 Ų | 88 | 61.6 Ų | 61.6 | 54% | 0.54 | 36% | 0.364 | S | S | . | . | G | 310 helix | trans | -70.2 | -18.7 | 178.5 | 64.8 | 0 | 0 | 0 | 0 | 113.5 | D32 G36 | D32-T34 PolarHBondContact O-N 3.44Å; D32-T34 VanDerWaalsContact OD1-CB 3.26Å; D32-T34 WeakPolarHBondContact OD1-CB 3.26Å; D32-T34 VanDerWaalsContact OD1-CG2 3.29Å; D32-T34 WeakPolarHBondContact OD1-CG2 3.22Å; D32-T34 PolarHBondContact OD1-N 3.49Å; D32-T34 PolarHBondContact OD1-OG1 2.75Å; D32-T34 PolarHBondContact OD2-OG1 3.3Å; T34-G36 VanDerWaalsContact C-N 3.35Å |
| 35 | L | 63.1 | Low | 62.5 | Low | 19 Ų | 19 | 63.4 Ų | 63.4 | 10% | 0.099 | 38% | 0.377 | C | S | . | . | G | 310 helix | trans | -69.3 | -34.6 | 178.3 | -66 | 179 | 0 | 0 | 0 | 112.1 | V29 F30 D32 R33 L37 A67 F68 A71 | V29-L35 WeakPolarHBondContact O-CD1 3.4Å; F30-L35 HydrophobicContact CD1-CD1 3.84Å; F30-L35 HydrophobicContact CE1-CD1 4.47Å; D32-L35 HydrophobicContact CB-CG 4.44Å; D32-L35 WeakPolarHBondContact O-CB 3.46Å; D32-L35 PolarHBondContact O-N 2.98Å; R33-L35 PolarHBondContact O-N 2.78Å; L35-L37 HydrophobicContact CB-CB 4.4Å; L35-L37 HydrophobicContact CB-CD1 3.98Å; L35-L37 HydrophobicContact CB-CG 4.01Å; L35-L37 HydrophobicContact CD1-CD1 4.45Å; L35-L37 WeakPolarHBondContact O-CG 3.46Å; L35-L37 PolarHBondContact O-N 3.02Å; L35-L37 VanDerWaalsContact O-N 3.09Å; L35-A67 HydrophobicContact CD2-CB 4.12Å; L35-F68 VanDerWaalsContact CD2-CA 3.47Å; L35-F68 HydrophobicContact CD2-CB 4.01Å; L35-F68 HydrophobicContact CD2-CD2 4.18Å; L35-A71 HydrophobicContact CD1-CB 4.35Å; L35-A71 HydrophobicContact CD2-CB 4.07Å; L35-A71 HydrophobicContact CG-CB 4.31Å |
| 36 | G | 58.6 | Low | 60.5 | Low | 75 Ų | 75 | 66.5 Ų | 66.5 | 77% | 0.773 | 41% | 0.408 | S | S | * | . | trans | 58.9 | 18.5 | -176.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | T34 | T34-G36 VanDerWaalsContact C-N 3.35Š| ||
| 37 | L | 60.7 | Low | 58.5 | Low | 63 Ų | 63 | 71.1 Ų | 71.1 | 33% | 0.33 | 45% | 0.447 | S | S | . | . | trans | -90.7 | 135.6 | -175 | -62.9 | 169.6 | 0 | 0 | 0 | 110.3 | L35 V58 L62 | L35-L37 HydrophobicContact CB-CB 4.4Å; L35-L37 HydrophobicContact CB-CD1 3.98Å; L35-L37 HydrophobicContact CB-CG 4.01Å; L35-L37 HydrophobicContact CD1-CD1 4.45Å; L35-L37 WeakPolarHBondContact O-CG 3.46Å; L35-L37 PolarHBondContact O-N 3.02Å; L35-L37 VanDerWaalsContact O-N 3.09Å; L37-V58 HydrophobicContact CD1-CG1 4.07Å; L37-L62 HydrophobicContact CD1-CD2 3.39Å | ||
| 38 | S | 55.3 | Low | 56.9 | Low | 86 Ų | 86 | 71 Ų | 71 | 60% | 0.601 | 45% | 0.451 | S | S | * | . | trans | -77.5 | 119.6 | 154.4 | 55.2 | 0 | 0 | 0 | 0 | 107.1 | G40 | S38-G40 PolarHBondContact O-N 2.78Š| ||
| 39 | L | 53.5 | Low | 55.6 | Low | 71 Ų | 71 | 73.8 Ų | 73.8 | 37% | 0.372 | 46% | 0.461 | S | S | . | . | trans | -66.4 | 93 | 172.1 | -137.6 | 73.1 | 0 | 0 | 0 | 107.3 | F30 S41 F43 V58 | F30-L39 HydrophobicContact CB-CD1 3.83Å; F30-L39 HydrophobicContact CD1-CD1 3.38Å; F30-L39 HydrophobicContact CD2-CD1 4.02Å; F30-L39 HydrophobicContact CE1-CD1 3.96Å; F30-L39 HydrophobicContact CG-CD1 3.45Å; F30-L39 VanDerWaalsContact CG-CD1 3.45Å; L39-S41 PolarHBondContact O-N 3.42Å; L39-S41 VanDerWaalsContact O-N 3.17Å; L39-F43 HydrophobicContact CD2-CB 4.36Å; L39-V58 HydrophobicContact CD1-CG2 4.26Å | ||
| 40 | G | 52.2 | Low | 54.3 | Low | 9 Ų | 9 | 75 Ų | 75 | 9% | 0.093 | 47% | 0.469 | C | S | . | . | trans | -66.8 | 111.4 | 176 | 0 | 0 | 0 | 0 | 0 | 108.1 | S38 N59 | S38-G40 PolarHBondContact O-N 2.78Å; G40-N59 VanDerWaalsContact CA-ND2 3.26Å; G40-N59 WeakPolarHBondContact CA-ND2 3.35Å | ||
| 41 | S | 46.9 | Very low | 53.2 | Low | 75 Ų | 75 | 74.3 Ų | 74.3 | 52% | 0.524 | 47% | 0.467 | S | S | . | . | S | Bend | trans | 64.2 | 141.8 | -177.8 | 55.1 | 0 | 0 | 0 | 0 | 115.3 | L39 F43 | L39-S41 PolarHBondContact O-N 3.42Å; L39-S41 VanDerWaalsContact O-N 3.17Å; S41-F43 PolarHBondContact O-N 2.94Å |
| 42 | T | 43.6 | Very low | 52.5 | Low | 105 Ų | 105 | 73.5 Ų | 73.5 | 64% | 0.644 | 46% | 0.458 | S | S | * | . | trans | -32.7 | 125 | 178.7 | -38.1 | 0 | 0 | 0 | 0 | 112.1 | T44 | T42-T44 HydrophobicContact CG2-CG2 3.78Å; T42-T44 PolarHBondContact O-N 2.81Å | ||
| 43 | F | 46.2 | Very low | 52.4 | Low | 28 Ų | 28 | 72.8 Ų | 72.8 | 12% | 0.123 | 46% | 0.463 | C | S | . | . | trans | -61.8 | 85.8 | 150.2 | -174.7 | -110 | 0 | 0 | 0 | 105.6 | W26 L39 S41 S45 V51 | W26-F43 HydrophobicContact CB-CD2 4.36Å; W26-F43 HydrophobicContact CB-CE1 4.01Å; W26-F43 HydrophobicContact CB-CE2 3.69Å; W26-F43 HydrophobicContact CB-CZ 3.51Å; W26-F43 AromaticContact CD1-CE2 3.81Å; W26-F43 AromaticContact CD1-CZ 3.37Å; W26-F43 HydrophobicContact CD2-CE2 4.37Å; W26-F43 HydrophobicContact CG-CE1 4.46Å; W26-F43 AromaticContact CG-CE2 3.65Å; W26-F43 HydrophobicContact CG-CE2 3.65Å; W26-F43 AromaticContact CG-CZ 3.54Å; W26-F43 HydrophobicContact CG-CZ 3.54Å; L39-F43 HydrophobicContact CD2-CB 4.36Å; S41-F43 PolarHBondContact O-N 2.94Å; F43-S45 VanDerWaalsContact CD1-OG 3.22Å; F43-S45 WeakPolarHBondContact CD1-OG 3.39Å; F43-S45 VanDerWaalsContact CE1-OG 3.26Å; F43-S45 WeakPolarHBondContact CE1-OG 3.42Å; F43-S45 PolarHBondContact O-N 3.46Å; F43-V51 HydrophobicContact CE1-CG2 3.91Å; F43-V51 HydrophobicContact CZ-CB 4.38Å; F43-V51 HydrophobicContact CZ-CG2 3.97Å | ||
| 44 | T | 45.3 | Very low | 53 | Low | 108 Ų | 108 | 62.4 Ų | 62.4 | 66% | 0.663 | 43% | 0.43 | S | S | * | . | trans | -72.6 | 70.9 | 170.9 | 37.1 | 0 | 0 | 0 | 0 | 107.2 | T42 | T42-T44 HydrophobicContact CG2-CG2 3.78Å; T42-T44 PolarHBondContact O-N 2.81Å | ||
| 45 | S | 46.1 | Very low | 53.5 | Low | 41 Ų | 41 | 59.6 Ų | 59.6 | 29% | 0.287 | 41% | 0.413 | S | S | . | . | trans | -75.8 | 131.1 | 157.7 | 48.3 | 0 | 0 | 0 | 0 | 107.8 | F43 A47 | F43-S45 VanDerWaalsContact CD1-OG 3.22Å; F43-S45 WeakPolarHBondContact CD1-OG 3.39Å; F43-S45 VanDerWaalsContact CE1-OG 3.26Å; F43-S45 WeakPolarHBondContact CE1-OG 3.42Å; F43-S45 PolarHBondContact O-N 3.46Å; S45-A47 PolarHBondContact O-N 3.44Å | ||
| 46 | A | 38.2 | Very low | 54.3 | Low | 103 Ų | 103 | 58.9 Ų | 58.9 | 85% | 0.851 | 41% | 0.409 | S | S | * | . | S | Bend | trans | -65.8 | 88.3 | 155.4 | 0 | 0 | 0 | 0 | 0 | 107.9 | ||
| 47 | A | 38.6 | Very low | 55.4 | Low | 102 Ų | 102 | 57 Ų | 57 | 84% | 0.843 | 38% | 0.381 | S | S | * | . | S | Bend | trans | 69.2 | 33.4 | 144.5 | 0 | 0 | 0 | 0 | 0 | 122 | S45 | S45-A47 PolarHBondContact O-N 3.44Š|
| 48 | S | 42.8 | Very low | 56.4 | Low | 66 Ų | 66 | 54 Ų | 54 | 46% | 0.462 | 37% | 0.365 | S | S | . | . | trans | -158.9 | 138.7 | 167.4 | 168.2 | 0 | 0 | 0 | 0 | 112.3 | T50 V51 | S48-T50 WeakPolarHBondContact CB-O 3.33Å; S48-T50 PolarHBondContact O-N 3.45Å; S48-T50 PolarHBondContact OG-N 2.61Å; S48-T50 PolarHBondContact OG-O 3.46Å; S48-V51 WeakPolarHBondContact O-CG2 3.34Å | ||
| 49 | D | 49.9 | Very low | 57.7 | Low | 98 Ų | 98 | 53 Ų | 53 | 52% | 0.524 | 35% | 0.353 | S | S | . | . | S | Bend | trans | -57.7 | -30.4 | 177.5 | -136.1 | 9.7 | 0 | 0 | 0 | 111.6 | N27 | N27-D49 PolarHBondContact ND2-OD1 2.79Š|
| 50 | T | 52.1 | Low | 58.8 | Low | 27 Ų | 27 | 51.2 Ų | 51.2 | 17% | 0.166 | 35% | 0.352 | C | S | . | . | S | Bend | trans | -104.8 | 115 | 170.9 | -33.5 | 0 | 0 | 0 | 0 | 109.4 | Q21 A22 S48 | Q21-T50 HydrophobicContact CB-CG2 4Å; Q21-T50 PolarHBondContact OE1-OG1 3.25Å; A22-T50 WeakPolarHBondContact O-CG2 3.49Å; S48-T50 WeakPolarHBondContact CB-O 3.33Å; S48-T50 PolarHBondContact O-N 3.45Å; S48-T50 PolarHBondContact OG-N 2.61Å; S48-T50 PolarHBondContact OG-O 3.46Å |
| 51 | V | 56.4 | Low | 60 | Low | 14 Ų | 14 | 56.3 Ų | 56.3 | 9% | 0.085 | 37% | 0.372 | C | S | . | . | B | Isolated β-bridge | trans | -110.9 | 123.5 | 179 | 179.7 | 0 | 0 | 0 | 0 | 109 | I24 F43 S48 G53 | I24-V51 PolarHBondContact N-O 2.88Å; I24-V51 PolarHBondContact O-N 2.85Å; F43-V51 HydrophobicContact CE1-CG2 3.91Å; F43-V51 HydrophobicContact CZ-CB 4.38Å; F43-V51 HydrophobicContact CZ-CG2 3.97Å; S48-V51 WeakPolarHBondContact O-CG2 3.34Å; V51-G53 WeakPolarHBondContact CG1-O 3.37Å |
| 52 | T | 56.8 | Low | 61.7 | Low | 76 Ų | 76 | 52.8 Ų | 52.8 | 47% | 0.466 | 35% | 0.347 | S | S | . | . | S | Bend | trans | -82.4 | -26.9 | 173.8 | 53.2 | 0 | 0 | 0 | 0 | 112 | A22 G196 | A22-T52 HydrophobicContact CB-CG2 4.28Å; T52-G196 WeakPolarHBondContact O-CA 3.36Å |
| 53 | G | 67.7 | Low | 63.5 | Low | 36 Ų | 36 | 48.2 Ų | 48.2 | 37% | 0.371 | 32% | 0.319 | S | S | . | . | S | Bend | trans | -153 | 140.4 | 174.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | V51 S195 | V51-G53 WeakPolarHBondContact CG1-O 3.37Å; G53-S195 CarbonylContact C-O 3.54Å; G53-S195 WeakPolarHBondContact CA-O 3.47Å |
| 54 | G | 74.4 | Confident | 65.2 | Low | 21 Ų | 21 | 48.6 Ų | 48.6 | 22% | 0.216 | 33% | 0.331 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 179.9 | 165.1 | -175.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | S195 | G54-S195 PolarHBondContact N-O 3.18Å; G54-S195 PolarHBondContact N-OG 3.15Å; G54-S195 PolarHBondContact O-N 3.19Å; G54-S195 PolarHBondContact O-OG 3.28Å |
| 55 | V | 75.9 | Confident | 67.1 | Low | 28 Ų | 28 | 45 Ų | 45 | 17% | 0.17 | 31% | 0.31 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.9 | 128.6 | 179.1 | -175.6 | 0 | 0 | 0 | 0 | 108.2 | Y150 Q182 V184 V192 I193 I194 | V55-Y150 WeakPolarHBondContact CG2-OH 3.29Å; V55-Q182 VanDerWaalsContact CG2-NE2 3.32Å; V55-V184 HydrophobicContact CG1-CG1 3.85Å; V55-V192 HydrophobicContact CG1-CG2 3.49Å; V55-V192 VanDerWaalsContact CG1-CG2 3.49Å; V55-I193 CarbonylContact C-O 3.48Å; V55-I193 VanDerWaalsContact CA-O 3.29Å; V55-I193 WeakPolarHBondContact CA-O 3.42Å; V55-I194 HydrophobicContact CG1-CG1 4.39Å |
| 56 | S | 79.4 | Confident | 69.1 | Low | 5 Ų | 5 | 51.9 Ų | 51.9 | 4% | 0.035 | 33% | 0.334 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.1 | 146.9 | 176.2 | -169.9 | 0 | 0 | 0 | 0 | 110.2 | V192 I193 | S56-V192 CarbonylContact O-C 3.54Å; S56-V192 WeakPolarHBondContact O-CA 3.39Å; S56-I193 PolarHBondContact N-O 2.81Å; S56-I193 PolarHBondContact O-N 3.3Å |
| 57 | I | 81.5 | Confident | 71.3 | Confident | 34 Ų | 34 | 48.4 Ų | 48.4 | 17% | 0.174 | 31% | 0.306 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.5 | 133.7 | 175.2 | -57.8 | 174.5 | 0 | 0 | 0 | 107.4 | D185 L186 Q190 T191 V192 | I57-D185 WeakPolarHBondContact CD1-O 3.49Å; I57-L186 HydrophobicContact CB-CD2 4.29Å; I57-L186 HydrophobicContact CD1-CD2 3.78Å; I57-L186 HydrophobicContact CG1-CD2 3.8Å; I57-L186 HydrophobicContact CG2-CD2 3.58Å; I57-Q190 HydrophobicContact CG2-CB 4.05Å; I57-Q190 HydrophobicContact CG2-CG 4.4Å; I57-T191 WeakPolarHBondContact CA-O 3.27Å; I57-V192 HydrophobicContact CG1-CG2 4.39Å |
| 58 | V | 82.5 | Confident | 73.6 | Confident | 0 Ų | 0 | 43.6 Ų | 43.6 | 0% | 0 | 27% | 0.266 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.6 | 139.3 | 179 | -178.9 | 0 | 0 | 0 | 0 | 109.4 | F30 L37 L39 G60 L62 Q190 T191 I193 | F30-V58 HydrophobicContact CE1-CG2 4.13Å; F30-V58 HydrophobicContact CZ-CG2 4.17Å; L37-V58 HydrophobicContact CD1-CG1 4.07Å; L39-V58 HydrophobicContact CD1-CG2 4.26Å; V58-G60 PolarHBondContact O-N 3.32Å; V58-L62 HydrophobicContact CB-CD1 3.91Å; V58-L62 HydrophobicContact CB-CG 4.5Å; V58-L62 HydrophobicContact CG1-CD1 4.16Å; V58-L62 HydrophobicContact CG1-CG 4.4Å; V58-L62 HydrophobicContact CG2-CD1 4Å; V58-Q190 WeakPolarHBondContact O-CA 3.11Å; V58-T191 PolarHBondContact N-O 3.33Å; V58-T191 PolarHBondContact O-N 3.45Å; V58-I193 HydrophobicContact CG2-CD1 3.82Å |
| 59 | N | 80.9 | Confident | 75.8 | Confident | 66 Ų | 66 | 42.5 Ų | 42.5 | 35% | 0.353 | 26% | 0.255 | S | S | . | . | S | Bend | trans | -71.1 | 125.2 | 172.8 | -75 | -28.8 | 0 | 0 | 0 | 110.1 | G40 Q190 | G40-N59 VanDerWaalsContact CA-ND2 3.26Å; G40-N59 WeakPolarHBondContact CA-ND2 3.35Å; N59-Q190 PolarHBondContact OD1-NE2 2.98Å |
| 60 | G | 77.8 | Confident | 77.5 | Confident | 33 Ų | 33 | 44.6 Ų | 44.6 | 34% | 0.34 | 26% | 0.259 | S | S | . | . | S | Bend | trans | 97.1 | 171.5 | -179.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | V58 L62 G189 T191 | V58-G60 PolarHBondContact O-N 3.32Å; G60-L62 PolarHBondContact O-N 3.34Å; G60-G189 CarbonylContact C-O 3.54Å; G60-G189 WeakPolarHBondContact CA-O 3.2Å; G60-G189 PolarHBondContact N-O 2.89Å; G60-T191 PolarHBondContact O-N 3.31Å; G60-T191 PolarHBondContact O-OG1 2.81Å |
| 61 | K | 77.8 | Confident | 79.1 | Confident | 117 Ų | 117 | 43.3 Ų | 43.3 | 51% | 0.509 | 25% | 0.251 | S | S | . | . | trans | -87 | 106.2 | -174.7 | -176.5 | 176.1 | -179.5 | 177.3 | 0 | 110.7 | T63 T235 | K61-T63 VanDerWaalsContact CE-O 3.23Å; K61-T63 WeakPolarHBondContact CE-O 3.29Å; K61-T63 WeakPolarHBondContact CG-O 3.48Å; K61-T235 HydrophobicContact CB-CG2 4.3Å; K61-T235 HydrophobicContact CG-CG2 4.19Å | ||
| 62 | L | 82.7 | Confident | 80.5 | Confident | 1 Ų | 1 | 42.6 Ų | 42.6 | 1% | 0.005 | 25% | 0.247 | C | C | . | . | trans | -82.5 | -26.9 | 169.6 | -66.7 | 177.3 | 0 | 0 | 0 | 112.2 | L37 V58 G60 G64 S65 F68 T191 I193 L233 | L37-L62 HydrophobicContact CD1-CD2 3.39Å; V58-L62 HydrophobicContact CB-CD1 3.91Å; V58-L62 HydrophobicContact CB-CG 4.5Å; V58-L62 HydrophobicContact CG1-CD1 4.16Å; V58-L62 HydrophobicContact CG1-CG 4.4Å; V58-L62 HydrophobicContact CG2-CD1 4Å; G60-L62 PolarHBondContact O-N 3.34Å; L62-G64 PolarHBondContact O-N 2.75Å; L62-G64 VanDerWaalsContact O-N 3.11Å; L62-S65 WeakPolarHBondContact O-CB 3.34Å; L62-S65 PolarHBondContact O-N 2.99Å; L62-F68 HydrophobicContact CB-CD1 4.27Å; L62-F68 HydrophobicContact CD1-CD2 4.45Å; L62-F68 HydrophobicContact CD1-CE1 4.5Å; L62-F68 HydrophobicContact CD1-CE2 4.26Å; L62-F68 HydrophobicContact CD1-CZ 4.27Å; L62-F68 HydrophobicContact CD2-CB 4.11Å; L62-F68 HydrophobicContact CD2-CD2 4.02Å; L62-F68 HydrophobicContact CD2-CG 3.97Å; L62-T191 HydrophobicContact CB-CG2 3.99Å; L62-T191 HydrophobicContact CD1-CG2 4.42Å; L62-T191 HydrophobicContact CG-CG2 4.5Å; L62-T191 PolarHBondContact N-OG1 2.91Å; L62-I193 HydrophobicContact CD1-CD1 3.38Å; L62-I193 HydrophobicContact CD1-CG1 3.87Å; L62-L233 HydrophobicContact CB-CD1 4.33Å | ||
| 63 | T | 80 | Confident | 82 | Confident | 9 Ų | 9 | 41.4 Ų | 41.4 | 6% | 0.055 | 24% | 0.242 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -57.7 | 116.3 | 177.2 | -59 | 0 | 0 | 0 | 0 | 110.7 | N8 E10 K61 T235 | N8-T63 HydrophobicContact CB-CG2 4.19Å; E10-T63 HydrophobicContact CB-CG2 3.8Å; E10-T63 VanDerWaalsContact OE2-CA 3.22Å; E10-T63 WeakPolarHBondContact OE2-CA 2.93Å; K61-T63 VanDerWaalsContact CE-O 3.23Å; K61-T63 WeakPolarHBondContact CE-O 3.29Å; K61-T63 WeakPolarHBondContact CG-O 3.48Å; T63-T235 PolarHBondContact OG1-OG1 2.82Å |
| 64 | G | 83.2 | Confident | 82.8 | Confident | 36 Ų | 36 | 43.5 Ų | 43.5 | 37% | 0.371 | 25% | 0.251 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 82.3 | 5.4 | -176.2 | 0 | 0 | 0 | 0 | 0 | 115.4 | E10 L62 K66 | E10-G64 PolarHBondContact OE2-N 2.9Å; L62-G64 PolarHBondContact O-N 2.75Å; L62-G64 VanDerWaalsContact O-N 3.11Å; G64-K66 PolarHBondContact O-N 2.71Å |
| 65 | S | 85.6 | Confident | 83.3 | Confident | 31 Ų | 31 | 43.6 Ų | 43.6 | 22% | 0.217 | 25% | 0.246 | C | C | . | . | trans | -72.5 | 113.3 | 178.2 | 176.2 | 0 | 0 | 0 | 0 | 111.2 | L62 A67 F68 L69 | L62-S65 WeakPolarHBondContact O-CB 3.34Å; L62-S65 PolarHBondContact O-N 2.99Å; S65-A67 VanDerWaalsContact C-N 3.28Å; S65-A67 PolarHBondContact O-N 3.46Å; S65-F68 PolarHBondContact O-N 2.81Å; S65-F68 PolarHBondContact OG-N 3Å; S65-L69 PolarHBondContact O-N 2.76Å | ||
| 66 | K | 86.4 | Confident | 83.8 | Confident | 186 Ų | 186 | 43 Ų | 43 | 81% | 0.809 | 25% | 0.245 | S | C | * | . | H | α-helix | trans | -64 | -34.7 | 174.7 | -66.1 | -176.3 | -179.9 | -179.8 | 0 | 112.2 | G64 F68 K70 | G64-K66 PolarHBondContact O-N 2.71Å; K66-F68 VanDerWaalsContact C-N 3.35Å; K66-K70 VanDerWaalsContact O-CB 3.26Å; K66-K70 WeakPolarHBondContact O-CB 3.46Å; K66-K70 PolarHBondContact O-N 2.99Å |
| 67 | A | 85.3 | Confident | 84.3 | Confident | 31 Ų | 31 | 47 Ų | 47 | 26% | 0.256 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -64.3 | -42.2 | 176.2 | 0 | 0 | 0 | 0 | 0 | 110.8 | L35 S65 K70 A71 | L35-A67 HydrophobicContact CD2-CB 4.12Å; S65-A67 VanDerWaalsContact C-N 3.28Å; S65-A67 PolarHBondContact O-N 3.46Å; A67-K70 PolarHBondContact O-N 2.81Å; A67-A71 WeakPolarHBondContact O-CB 3.39Å; A67-A71 PolarHBondContact O-N 2.95Å |
| 68 | F | 86.7 | Confident | 84.7 | Confident | 0 Ų | 0 | 47.2 Ų | 47.2 | 0% | 0 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -66.6 | -44.7 | 176.5 | -173.9 | -115.3 | 0 | 0 | 0 | 113.2 | L12 W26 V29 F30 L35 L62 S65 K66 K70 A71 L72 I193 L233 | L12-F68 HydrophobicContact CD1-CE1 4.38Å; W26-F68 HydrophobicContact CZ3-CE2 4.32Å; W26-F68 AromaticContact CZ3-CZ 3.92Å; W26-F68 HydrophobicContact CZ3-CZ 3.92Å; V29-F68 HydrophobicContact CG1-CD2 4.23Å; V29-F68 HydrophobicContact CG1-CE2 3.79Å; F30-F68 HydrophobicContact CE1-CD2 4.33Å; F30-F68 AromaticContact CE1-CE2 3.79Å; F30-F68 HydrophobicContact CE1-CE2 3.79Å; F30-F68 AromaticContact CZ-CE2 3.81Å; F30-F68 HydrophobicContact CZ-CE2 3.81Å; F30-F68 HydrophobicContact CZ-CZ 4.46Å; L35-F68 VanDerWaalsContact CD2-CA 3.47Å; L35-F68 HydrophobicContact CD2-CB 4.01Å; L35-F68 HydrophobicContact CD2-CD2 4.18Å; L62-F68 HydrophobicContact CB-CD1 4.27Å; L62-F68 HydrophobicContact CD1-CD2 4.45Å; L62-F68 HydrophobicContact CD1-CE1 4.5Å; L62-F68 HydrophobicContact CD1-CE2 4.26Å; L62-F68 HydrophobicContact CD1-CZ 4.27Å; L62-F68 HydrophobicContact CD2-CB 4.11Å; L62-F68 HydrophobicContact CD2-CD2 4.02Å; L62-F68 HydrophobicContact CD2-CG 3.97Å; S65-F68 PolarHBondContact O-N 2.81Å; S65-F68 PolarHBondContact OG-N 3Å; K66-F68 VanDerWaalsContact C-N 3.35Å; F68-K70 VanDerWaalsContact C-N 3.25Å; F68-K70 PolarHBondContact O-N 2.76Å; F68-A71 PolarHBondContact O-N 2.78Å; F68-L72 HydrophobicContact CD1-CD1 3.82Å; F68-L72 HydrophobicContact CE1-CD1 3.35Å; F68-L72 HydrophobicContact CE1-CG 4.19Å; F68-L72 HydrophobicContact CE2-CD1 4.31Å; F68-L72 HydrophobicContact CE2-CG 4.28Å; F68-L72 HydrophobicContact CG-CD1 4.47Å; F68-L72 HydrophobicContact CZ-CD1 3.65Å; F68-L72 HydrophobicContact CZ-CD2 4.43Å; F68-L72 HydrophobicContact CZ-CG 4.05Å; F68-L72 WeakPolarHBondContact O-CB 3.34Å; F68-L72 WeakPolarHBondContact O-CG 3.46Å; F68-L72 PolarHBondContact O-N 3.28Å; F68-I193 HydrophobicContact CZ-CD1 4.15Å; F68-L233 HydrophobicContact CD1-CD1 4.06Å; F68-L233 HydrophobicContact CE1-CD1 3.78Å; F68-L233 HydrophobicContact CE1-CD2 3.88Å; F68-L233 HydrophobicContact CE1-CG 4.43Å; F68-L233 HydrophobicContact CZ-CD2 4.36Å |
| 69 | L | 88.2 | Confident | 85.2 | Confident | 44 Ų | 44 | 50.3 Ų | 50.3 | 23% | 0.23 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -59.8 | -38.4 | 172.4 | -95.6 | 63.4 | 0 | 0 | 0 | 111.6 | L12 S65 L72 S73 V78 V80 | L12-L69 HydrophobicContact CD1-CD1 4.14Å; L12-L69 HydrophobicContact CD2-CD1 4.32Å; S65-L69 PolarHBondContact O-N 2.76Å; L69-L72 PolarHBondContact O-N 3.4Å; L69-S73 PolarHBondContact O-N 3.46Å; L69-V78 HydrophobicContact CG-CG1 4.42Å; L69-V80 HydrophobicContact CD2-CG2 3.92Å |
| 70 | K | 86.7 | Confident | 85.6 | Confident | 141 Ų | 141 | 49.9 Ų | 49.9 | 61% | 0.613 | 29% | 0.29 | S | S | * | . | H | α-helix | trans | -66.9 | -45.1 | 177.2 | -178.8 | 60.3 | -176.6 | 168.2 | 0 | 111.8 | K66 A67 F68 S73 | K66-K70 VanDerWaalsContact O-CB 3.26Å; K66-K70 WeakPolarHBondContact O-CB 3.46Å; K66-K70 PolarHBondContact O-N 2.99Å; A67-K70 PolarHBondContact O-N 2.81Å; F68-K70 VanDerWaalsContact C-N 3.25Å; F68-K70 PolarHBondContact O-N 2.76Å; K70-S73 WeakPolarHBondContact O-CB 3.22Å; K70-S73 PolarHBondContact O-N 2.88Å; K70-S73 VanDerWaalsContact O-N 3.13Å; K70-S73 PolarHBondContact O-OG 3.15Å |
| 71 | A | 85 | Confident | 86 | Confident | 0 Ų | 0 | 51.5 Ų | 51.5 | 0% | 0 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -60.7 | -45.1 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111 | V29 D32 L35 A67 F68 S73 S74 | V29-A71 HydrophobicContact CG1-CB 4.03Å; D32-A71 HydrophobicContact CB-CB 3.95Å; L35-A71 HydrophobicContact CD1-CB 4.35Å; L35-A71 HydrophobicContact CD2-CB 4.07Å; L35-A71 HydrophobicContact CG-CB 4.31Å; A67-A71 WeakPolarHBondContact O-CB 3.39Å; A67-A71 PolarHBondContact O-N 2.95Å; F68-A71 PolarHBondContact O-N 2.78Å; A71-S73 VanDerWaalsContact C-N 3.26Å; A71-S73 PolarHBondContact O-N 2.77Å; A71-S74 VanDerWaalsContact O-CB 3.31Å; A71-S74 WeakPolarHBondContact O-CB 3.22Å; A71-S74 PolarHBondContact O-N 3.1Å; A71-S74 VanDerWaalsContact O-N 3.1Å; A71-S74 PolarHBondContact O-OG 2.61Å |
| 72 | L | 86.5 | Confident | 86.6 | Confident | 0 Ų | 0 | 47.9 Ų | 47.9 | 0% | 0 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -62.3 | -31 | 174.1 | -77.4 | 172.9 | 0 | 0 | 0 | 113 | L12 I24 W26 V29 F68 L69 S74 Q75 V78 | L12-L72 HydrophobicContact CD1-CD1 3.65Å; I24-L72 HydrophobicContact CG2-CD2 4.42Å; W26-L72 HydrophobicContact CH2-CD2 4.16Å; W26-L72 HydrophobicContact CZ3-CD2 3.89Å; V29-L72 HydrophobicContact CG1-CD2 4.09Å; V29-L72 HydrophobicContact CG1-CG 4.22Å; V29-L72 HydrophobicContact CG2-CD2 3.92Å; F68-L72 HydrophobicContact CD1-CD1 3.82Å; F68-L72 HydrophobicContact CE1-CD1 3.35Å; F68-L72 HydrophobicContact CE1-CG 4.19Å; F68-L72 HydrophobicContact CE2-CD1 4.31Å; F68-L72 HydrophobicContact CE2-CG 4.28Å; F68-L72 HydrophobicContact CG-CD1 4.47Å; F68-L72 HydrophobicContact CZ-CD1 3.65Å; F68-L72 HydrophobicContact CZ-CD2 4.43Å; F68-L72 HydrophobicContact CZ-CG 4.05Å; F68-L72 WeakPolarHBondContact O-CB 3.34Å; F68-L72 WeakPolarHBondContact O-CG 3.46Å; F68-L72 PolarHBondContact O-N 3.28Å; L69-L72 PolarHBondContact O-N 3.4Å; L72-S74 PolarHBondContact O-N 3.32Å; L72-S74 VanDerWaalsContact O-N 3.15Å; L72-Q75 VanDerWaalsContact O-CB 3.32Å; L72-Q75 WeakPolarHBondContact O-CB 3.22Å; L72-Q75 PolarHBondContact O-N 3.13Å; L72-V78 VanDerWaalsContact C-CG2 3.46Å; L72-V78 HydrophobicContact CB-CG2 3.69Å; L72-V78 WeakPolarHBondContact O-CG2 3.42Å |
| 73 | S | 87.4 | Confident | 87 | Confident | 51 Ų | 51 | 54.8 Ų | 54.8 | 36% | 0.357 | 31% | 0.307 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65.7 | -13.9 | 176.7 | 76.2 | 0 | 0 | 0 | 0 | 113.8 | L69 K70 A71 G76 | L69-S73 PolarHBondContact O-N 3.46Å; K70-S73 WeakPolarHBondContact O-CB 3.22Å; K70-S73 PolarHBondContact O-N 2.88Å; K70-S73 VanDerWaalsContact O-N 3.13Å; K70-S73 PolarHBondContact O-OG 3.15Å; A71-S73 VanDerWaalsContact C-N 3.26Å; A71-S73 PolarHBondContact O-N 2.77Å; S73-G76 WeakPolarHBondContact CA-O 3.46Å |
| 74 | S | 85.2 | Confident | 87.5 | Confident | 79 Ų | 79 | 57.6 Ų | 57.6 | 55% | 0.552 | 32% | 0.322 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.9 | -20.4 | 168.3 | 73 | 0 | 0 | 0 | 0 | 113.2 | A71 L72 | A71-S74 VanDerWaalsContact O-CB 3.31Å; A71-S74 WeakPolarHBondContact O-CB 3.22Å; A71-S74 PolarHBondContact O-N 3.1Å; A71-S74 VanDerWaalsContact O-N 3.1Å; A71-S74 PolarHBondContact O-OG 2.61Å; L72-S74 PolarHBondContact O-N 3.32Å; L72-S74 VanDerWaalsContact O-N 3.15Å |
| 75 | Q | 83.6 | Confident | 88 | Confident | 24 Ų | 24 | 58.8 Ų | 58.8 | 11% | 0.112 | 33% | 0.325 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -94.8 | -16.2 | -176.8 | -55.7 | -62.8 | -55.1 | 0 | 0 | 112.8 | K16 I24 D25 V29 L72 | K16-Q75 VanDerWaalsContact CE-O 3.29Å; K16-Q75 WeakPolarHBondContact CE-O 3.26Å; I24-Q75 HydrophobicContact CG2-CG 4.2Å; D25-Q75 VanDerWaalsContact N-OE1 3.1Å; V29-Q75 HydrophobicContact CG2-CG 3.44Å; V29-Q75 VanDerWaalsContact CG2-CG 3.44Å; L72-Q75 VanDerWaalsContact O-CB 3.32Å; L72-Q75 WeakPolarHBondContact O-CB 3.22Å; L72-Q75 PolarHBondContact O-N 3.13Å |
| 76 | G | 86.9 | Confident | 88.4 | Confident | 16 Ų | 16 | 58.3 Ų | 58.3 | 17% | 0.165 | 32% | 0.323 | C | S | . | . | S | Bend | trans | 162.1 | -174.9 | -179.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | R15 S73 V78 | R15-G76 WeakPolarHBondContact O-CA 3.26Å; S73-G76 WeakPolarHBondContact CA-O 3.46Å; G76-V78 PolarHBondContact O-N 2.89Å |
| 77 | D | 90.3 | Very high | 88.8 | Confident | 88 Ų | 88 | 53.9 Ų | 53.9 | 47% | 0.471 | 31% | 0.311 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -74 | 106.4 | 175.9 | -70.6 | -31.1 | 0 | 0 | 0 | 109.6 | I14 R15 | I14-D77 WeakPolarHBondContact CA-O 2.98Å; R15-D77 HydrophobicContact CB-CB 4.25Å; R15-D77 IonicContact CZ-OD2 3.55Å; R15-D77 PolarHBondContact N-O 2.9Å; R15-D77 IonicContact NE-OD2 2.72Å; R15-D77 PolarHBondContact NE-OD2 2.62Å; R15-D77 IonicContact NH2-OD2 2.76Å; R15-D77 PolarHBondContact NH2-OD2 3.48Å; R15-D77 PolarHBondContact O-N 3.05Å |
| 78 | V | 90.9 | Very high | 89.3 | Confident | 38 Ų | 38 | 52.9 Ų | 52.9 | 23% | 0.23 | 30% | 0.301 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.7 | 128.8 | -179.1 | -176 | 0 | 0 | 0 | 0 | 110.4 | S13 I14 L69 L72 G76 | S13-V78 WeakPolarHBondContact O-CA 3.29Å; I14-V78 HydrophobicContact CG1-CG2 4.11Å; I14-V78 HydrophobicContact CG2-CG2 4.49Å; L69-V78 HydrophobicContact CG-CG1 4.42Å; L72-V78 VanDerWaalsContact C-CG2 3.46Å; L72-V78 HydrophobicContact CB-CG2 3.69Å; L72-V78 WeakPolarHBondContact O-CG2 3.42Å; G76-V78 PolarHBondContact O-N 2.89Å |
| 79 | S | 91.9 | Very high | 89.6 | Confident | 66 Ų | 66 | 57.5 Ų | 57.5 | 46% | 0.462 | 32% | 0.322 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.4 | 140.1 | 170.5 | -177.3 | 0 | 0 | 0 | 0 | 110.9 | L12 S13 V81 | L12-S79 CarbonylContact C-O 3.57Å; L12-S79 WeakPolarHBondContact CA-O 3.29Å; S13-S79 PolarHBondContact N-O 3.31Å; S13-S79 PolarHBondContact O-N 3.49Å; S79-V81 PolarHBondContact O-N 2.88Å |
| 80 | V | 88.9 | Confident | 89.9 | Confident | 57 Ų | 57 | 57.7 Ų | 57.7 | 35% | 0.345 | 32% | 0.323 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -80.5 | 112 | 170.5 | -177.6 | 0 | 0 | 0 | 0 | 107.6 | E10 L12 L69 | E10-V80 HydrophobicContact CG-CG1 4.28Å; L12-V80 HydrophobicContact CD2-CB 4.27Å; L12-V80 HydrophobicContact CD2-CG1 4.4Å; L12-V80 HydrophobicContact CD2-CG2 3.76Å; L69-V80 HydrophobicContact CD2-CG2 3.92Å |
| 81 | V | 87.4 | Confident | 90.3 | Very high | 67 Ų | 67 | 56 Ų | 56 | 41% | 0.406 | 32% | 0.32 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -76.2 | -48.5 | 179.3 | 176.8 | 0 | 0 | 0 | 0 | 110 | I11 S79 L230 | I11-V81 HydrophobicContact CB-CB 4.33Å; I11-V81 HydrophobicContact CG2-CB 4.13Å; I11-V81 PolarHBondContact O-N 3.37Å; S79-V81 PolarHBondContact O-N 2.88Å; V81-L230 HydrophobicContact CG2-CD2 4.42Å |
| 82 | T | 89.5 | Confident | 90.8 | Very high | 40 Ų | 40 | 59 Ų | 59 | 25% | 0.245 | 34% | 0.338 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -158.4 | 143.7 | -179.5 | -72.8 | 0 | 0 | 0 | 0 | 110.4 | E10 I11 I98 | E10-T82 WeakPolarHBondContact CA-O 3.31Å; I11-T82 PolarHBondContact N-O 3.44Å; I11-T82 PolarHBondContact O-N 2.86Å; T82-I98 HydrophobicContact CG2-CD1 3.84Å; T82-I98 HydrophobicContact CG2-CG1 4.48Å; T82-I98 WeakPolarHBondContact OG1-CD1 3.45Å |
| 83 | R | 91.1 | Very high | 91.3 | Very high | 146 Ų | 146 | 62.5 Ų | 62.5 | 55% | 0.551 | 36% | 0.361 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -122.1 | 128.3 | 167.8 | -173.9 | -179.7 | -64.9 | 162.7 | 1.4 | 108.4 | V9 E10 | V9-R83 WeakPolarHBondContact O-CA 3.28Å; E10-R83 IonicContact OE1-CZ 3.25Å; E10-R83 IonicContact OE1-NE 3.48Å; E10-R83 PolarHBondContact OE1-NE 3.06Å; E10-R83 IonicContact OE1-NH2 3.46Å; E10-R83 PolarHBondContact OE1-NH2 3.45Å |
| 84 | N | 91.1 | Very high | 91.7 | Very high | 69 Ų | 69 | 60.8 Ų | 60.8 | 37% | 0.369 | 35% | 0.349 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -135.3 | 150.4 | 175.3 | -162.1 | 22.1 | 0 | 0 | 0 | 110.4 | V9 M96 | V9-N84 PolarHBondContact N-O 3.25Å; V9-N84 PolarHBondContact O-N 3.01Å; V9-N84 VanDerWaalsContact O-O 3.12Å; N84-M96 HydrophobicContact CB-CE 3.45Å; N84-M96 VanDerWaalsContact CB-CE 3.45Å; N84-M96 HydrophobicContact CB-SD 4.26Å |
| 85 | S | 92.7 | Very high | 92.2 | Very high | 61 Ų | 61 | 61.7 Ų | 61.7 | 43% | 0.427 | 35% | 0.352 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.9 | 128 | 173.9 | -167 | 0 | 0 | 0 | 0 | 108.6 | V6 L7 N8 | V6-S85 WeakPolarHBondContact CG1-OG 3.49Å; L7-S85 WeakPolarHBondContact O-CA 3.32Å; N8-S85 PolarHBondContact OD1-OG 2.75Å |
| 86 | A | 94.4 | Very high | 92.7 | Very high | 21 Ų | 21 | 61.4 Ų | 61.4 | 17% | 0.174 | 35% | 0.351 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.9 | 130.9 | -177.6 | 0 | 0 | 0 | 0 | 0 | 110.1 | V6 L7 V94 | V6-A86 CarbonylContact C-O 3.58Å; V6-A86 WeakPolarHBondContact CA-O 3.26Å; L7-A86 PolarHBondContact N-O 3.41Å; L7-A86 PolarHBondContact O-N 2.77Å; A86-V94 HydrophobicContact CB-CG1 3.5Å; A86-V94 VanDerWaalsContact CB-CG1 3.5Å; A86-V94 HydrophobicContact CB-CG2 4.48Å |
| 87 | V | 94.9 | Very high | 92.9 | Very high | 92 Ų | 92 | 65.9 Ų | 65.9 | 56% | 0.558 | 37% | 0.368 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -93.6 | 122.4 | 170.7 | -171.2 | 0 | 0 | 0 | 0 | 107.9 | V6 I239 | V6-V87 HydrophobicContact CG1-CG2 4.46Å; V6-V87 HydrophobicContact CG2-CG1 4.46Å; V6-V87 HydrophobicContact CG2-CG2 4.05Å; V87-I239 HydrophobicContact CG1-CD1 4.09Å |
| 88 | T | 95.4 | Very high | 92.9 | Very high | 10 Ų | 10 | 64.7 Ų | 64.7 | 6% | 0.061 | 36% | 0.361 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.1 | 161.6 | -179.9 | -168.4 | 0 | 0 | 0 | 0 | 111.6 | Q4 V5 L7 T92 V94 P137 | Q4-T88 CarbonylContact C-O 3.56Å; Q4-T88 VanDerWaalsContact CA-O 3.29Å; Q4-T88 WeakPolarHBondContact CA-O 3.47Å; Q4-T88 WeakPolarHBondContact CB-O 3.4Å; V5-T88 HydrophobicContact CG1-CG2 3.66Å; V5-T88 PolarHBondContact N-O 2.85Å; V5-T88 PolarHBondContact O-N 2.79Å; L7-T88 HydrophobicContact CD1-CG2 4.05Å; L7-T88 HydrophobicContact CG-CG2 4.41Å; T88-T92 WeakPolarHBondContact OG1-CB 3.49Å; T88-T92 PolarHBondContact OG1-O 2.71Å; T88-V94 VanDerWaalsContact CB-CG2 3.41Å; T88-V94 HydrophobicContact CG2-CG2 3.55Å; T88-P137 HydrophobicContact CG2-CG 3.58Å |
| 89 | K | 94.4 | Very high | 92.9 | Very high | 98 Ų | 98 | 65.3 Ų | 65.3 | 43% | 0.426 | 37% | 0.37 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.8 | 160.5 | 173.5 | -70 | 173.3 | -177.8 | 170.8 | 0 | 109.7 | K2 Q4 L91 T92 | K2-K89 HydrophobicContact CD-CD 4.35Å; Q4-K89 HydrophobicContact CG-CG 3.91Å; K89-L91 PolarHBondContact O-N 3.02Å; K89-T92 WeakPolarHBondContact O-CB 3.26Å; K89-T92 PolarHBondContact O-N 3.28Å; K89-T92 VanDerWaalsContact O-N 3.16Å |
| 90 | N | 94.2 | Very high | 92.9 | Very high | 47 Ų | 47 | 66.5 Ų | 66.5 | 25% | 0.251 | 37% | 0.371 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -51.4 | 137.4 | 168.9 | -165.6 | 23 | 0 | 0 | 0 | 111 | R3 T92 P137 F138 I139 | R3-N90 PolarHBondContact O-N 2.89Å; N90-T92 PolarHBondContact O-N 3.11Å; N90-P137 PolarHBondContact OD1-O 3.21Å; N90-F138 VanDerWaalsContact OD1-CA 3.26Å; N90-F138 WeakPolarHBondContact OD1-CA 3.47Å; N90-I139 HydrophobicContact CB-CD1 4.18Å; N90-I139 HydrophobicContact CB-CG1 4.38Å; N90-I139 PolarHBondContact OD1-N 2.92Å |
| 91 | L | 94 | Very high | 93.2 | Very high | 106 Ų | 106 | 69.8 Ų | 69.8 | 56% | 0.555 | 38% | 0.383 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 57.6 | 27.7 | -179.2 | -59.8 | 173.4 | 0 | 0 | 0 | 114.5 | K89 P137 F138 | K89-L91 PolarHBondContact O-N 3.02Å; L91-P137 PolarHBondContact N-O 2.84Å; L91-F138 HydrophobicContact CD2-CB 4.13Å; L91-F138 HydrophobicContact CD2-CD2 3.77Å; L91-F138 HydrophobicContact CD2-CG 4.34Å; L91-F138 HydrophobicContact CG-CD2 4.18Å |
| 92 | T | 96.1 | Very high | 93.5 | Very high | 62 Ų | 62 | 70.2 Ų | 70.2 | 38% | 0.38 | 38% | 0.38 | S | S | . | . | trans | -115.6 | 115.2 | 175 | -56.4 | 0 | 0 | 0 | 0 | 109.9 | T88 K89 N90 | T88-T92 WeakPolarHBondContact OG1-CB 3.49Å; T88-T92 PolarHBondContact OG1-O 2.71Å; K89-T92 WeakPolarHBondContact O-CB 3.26Å; K89-T92 PolarHBondContact O-N 3.28Å; K89-T92 VanDerWaalsContact O-N 3.16Å; N90-T92 PolarHBondContact O-N 3.11Å | ||
| 93 | P | 96.7 | Very high | 93.7 | Very high | 75 Ų | 75 | 72.2 Ų | 72.2 | 49% | 0.487 | 40% | 0.396 | S | S | . | . | trans | -67.7 | 145.8 | -176.7 | 27.6 | -34 | 0 | 0 | 0 | 111.7 | T134 L135 L136 | P93-T134 HydrophobicContact CB-CG2 3.91Å; P93-L135 CarbonylContact C-O 3.57Å; P93-L135 WeakPolarHBondContact CA-O 3.39Å; P93-L136 HydrophobicContact CB-CD1 4.31Å | ||
| 94 | V | 96.4 | Very high | 93.8 | Very high | 15 Ų | 15 | 66.9 Ų | 66.9 | 9% | 0.091 | 38% | 0.376 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.3 | 97.3 | 176.7 | -179 | 0 | 0 | 0 | 0 | 108.3 | L7 A86 T88 M96 T134 L135 | L7-V94 HydrophobicContact CD1-CB 4.46Å; L7-V94 HydrophobicContact CD1-CG2 4.09Å; A86-V94 HydrophobicContact CB-CG1 3.5Å; A86-V94 VanDerWaalsContact CB-CG1 3.5Å; A86-V94 HydrophobicContact CB-CG2 4.48Å; T88-V94 VanDerWaalsContact CB-CG2 3.41Å; T88-V94 HydrophobicContact CG2-CG2 3.55Å; V94-M96 HydrophobicContact CG1-CG 4.48Å; V94-T134 WeakPolarHBondContact O-CA 3.49Å; V94-L135 HydrophobicContact CB-CB 4.41Å; V94-L135 PolarHBondContact N-O 2.84Å; V94-L135 PolarHBondContact O-N 3.15Å |
| 95 | P | 96 | Very high | 93.9 | Very high | 98 Ų | 98 | 65.5 Ų | 65.5 | 64% | 0.636 | 37% | 0.368 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -76.3 | 142.1 | 172.8 | 32 | -33.4 | 0 | 0 | 0 | 110.4 | M133 | P95-M133 CarbonylContact C-O 3.59Å; P95-M133 WeakPolarHBondContact CA-O 3.29Å |
| 96 | M | 92.7 | Very high | 93.8 | Very high | 17 Ų | 17 | 67.9 Ų | 67.9 | 8% | 0.084 | 37% | 0.373 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -135.4 | 132.7 | 174.6 | -69.1 | -177.1 | 49.7 | 0 | 0 | 108.4 | V9 N84 V94 N132 M133 | V9-M96 HydrophobicContact CB-CE 3.92Å; V9-M96 HydrophobicContact CB-SD 3.99Å; V9-M96 HydrophobicContact CG1-CE 3.85Å; V9-M96 HydrophobicContact CG1-SD 4.23Å; V9-M96 HydrophobicContact CG2-CE 4.36Å; V9-M96 HydrophobicContact CG2-SD 3.75Å; N84-M96 HydrophobicContact CB-CE 3.45Å; N84-M96 VanDerWaalsContact CB-CE 3.45Å; N84-M96 HydrophobicContact CB-SD 4.26Å; V94-M96 HydrophobicContact CG1-CG 4.48Å; M96-N132 CarbonylContact O-C 3.57Å; M96-N132 WeakPolarHBondContact O-CA 3.38Å; M96-M133 HydrophobicContact CE-CE 4.2Å; M96-M133 PolarHBondContact N-O 3.17Å; M96-M133 PolarHBondContact O-N 2.88Å; M96-M133 HydrophobicContact SD-CE 3.63Å |
| 97 | Q | 92.6 | Very high | 93.4 | Very high | 110 Ų | 110 | 68.9 Ų | 68.9 | 51% | 0.514 | 38% | 0.379 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -140.9 | 128.3 | -178.2 | -179.4 | 76.6 | 74.7 | 0 | 0 | 109.9 | A99 F131 N132 | Q97-A99 HydrophobicContact CG-CB 3.76Å; Q97-F131 VanDerWaalsContact NE2-C 3.32Å; Q97-F131 PolarHBondContact NE2-O 3.42Å; Q97-N132 VanDerWaalsContact OE1-CB 3.22Å |
| 98 | I | 89.4 | Confident | 93 | Very high | 63 Ų | 63 | 66 Ų | 66 | 32% | 0.323 | 36% | 0.361 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.3 | 98.6 | 166.4 | -55.3 | 158 | 0 | 0 | 0 | 105.2 | I11 T82 G130 F131 | I11-I98 HydrophobicContact CD1-CD1 3.93Å; T82-I98 HydrophobicContact CG2-CD1 3.84Å; T82-I98 HydrophobicContact CG2-CG1 4.48Å; T82-I98 WeakPolarHBondContact OG1-CD1 3.45Å; I98-G130 CarbonylContact O-C 3.54Å; I98-F131 HydrophobicContact CD1-CD1 4.27Å; I98-F131 PolarHBondContact N-O 2.72Å; I98-F131 PolarHBondContact O-N 3.16Å |
| 99 | A | 91.1 | Very high | 92.4 | Very high | 52 Ų | 52 | 68.2 Ų | 68.2 | 43% | 0.43 | 38% | 0.375 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.9 | 153.3 | -173.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | Q97 T128 T129 | Q97-A99 HydrophobicContact CG-CB 3.76Å; A99-T128 HydrophobicContact CB-CG2 3.52Å; A99-T129 CarbonylContact C-O 3.59Å; A99-T129 WeakPolarHBondContact CA-O 3.39Å |
| 100 | N | 91.8 | Very high | 91.9 | Very high | 91 Ų | 91 | 66.6 Ų | 66.6 | 49% | 0.487 | 37% | 0.373 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.4 | 128.2 | 162.6 | -175.4 | -102.8 | 0 | 0 | 0 | 108.6 | T128 T129 | N100-T128 WeakPolarHBondContact O-CA 3.23Å; N100-T129 PolarHBondContact N-O 3.01Å; N100-T129 PolarHBondContact O-N 2.9Å |
| 101 | Q | 94.6 | Very high | 91.4 | Very high | 126 Ų | 126 | 68.9 Ų | 68.9 | 59% | 0.589 | 39% | 0.385 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -103.6 | 125 | 173.8 | -172.9 | 172.6 | 68.1 | 0 | 0 | 108.7 | T126 I127 | Q101-T126 HydrophobicContact CG-CG2 4.2Å; Q101-T126 PolarHBondContact NE2-OG1 2.92Å; Q101-I127 CarbonylContact C-O 3.6Å; Q101-I127 WeakPolarHBondContact CA-O 3.43Å |
| 102 | Q | 93.9 | Very high | 91 | Very high | 75 Ų | 75 | 68.7 Ų | 68.7 | 35% | 0.35 | 39% | 0.389 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.3 | 130.5 | 179.2 | 179.9 | 173.8 | -6.6 | 0 | 0 | 109.7 | T126 I127 P158 | Q102-T126 CarbonylContact O-C 3.57Å; Q102-T126 WeakPolarHBondContact O-CA 3.22Å; Q102-I127 HydrophobicContact CB-CG2 4.21Å; Q102-I127 PolarHBondContact N-O 3.01Å; Q102-I127 PolarHBondContact O-N 3.33Å; Q102-P158 VanDerWaalsContact OE1-CG 3.3Å |
| 103 | S | 93.9 | Very high | 90.5 | Very high | 82 Ų | 82 | 69.6 Ų | 69.6 | 57% | 0.573 | 39% | 0.394 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -80.9 | 144.6 | 171.9 | -53 | 0 | 0 | 0 | 0 | 111 | A125 | S103-A125 CarbonylContact C-O 3.59Å; S103-A125 VanDerWaalsContact CA-O 3.22Å; S103-A125 WeakPolarHBondContact CA-O 3.4Å |
| 104 | Y | 93.3 | Very high | 90 | Very high | 35 Ų | 35 | 70 Ų | 70 | 14% | 0.137 | 40% | 0.404 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -142 | 158.6 | 173.3 | 70.6 | -83.8 | 0 | 0 | 0 | 110 | E106 A124 A125 I127 Q171 P173 | Y104-E106 HydrophobicContact CD2-CB 4.49Å; Y104-E106 HydrophobicContact CE2-CB 3.86Å; Y104-E106 HydrophobicContact CE2-CG 4.4Å; Y104-E106 PolarHBondContact O-N 2.8Å; Y104-A124 CarbonylContact O-C 3.56Å; Y104-A124 VanDerWaalsContact O-CA 3.27Å; Y104-A124 WeakPolarHBondContact O-CA 3.17Å; Y104-A125 HydrophobicContact CD1-CB 4.41Å; Y104-A125 HydrophobicContact CE1-CB 3.76Å; Y104-A125 HydrophobicContact CE2-CB 4.26Å; Y104-A125 PolarHBondContact N-O 2.88Å; Y104-A125 PolarHBondContact O-N 2.79Å; Y104-I127 HydrophobicContact CD1-CB 4.31Å; Y104-I127 HydrophobicContact CD1-CG2 4.19Å; Y104-I127 HydrophobicContact CE1-CB 4.11Å; Y104-I127 HydrophobicContact CE1-CG2 4.49Å; Y104-Q171 HydrophobicContact CD2-CB 4.13Å; Y104-Q171 WeakPolarHBondContact CD2-O 3.26Å; Y104-Q171 WeakPolarHBondContact CE2-O 2.83Å; Y104-P173 HydrophobicContact CD1-CG 4.1Å; Y104-P173 HydrophobicContact CD2-CG 4.17Å; Y104-P173 HydrophobicContact CE1-CG 3.84Å; Y104-P173 HydrophobicContact CE2-CG 3.91Å; Y104-P173 HydrophobicContact CG-CG 4.25Å |
| 105 | I | 93 | Very high | 89.4 | Confident | 39 Ų | 39 | 77.7 Ų | 77.7 | 20% | 0.2 | 45% | 0.445 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -83.4 | 103.9 | 176.5 | -55 | -51.9 | 0 | 0 | 0 | 109.3 | V108 L122 A124 Q171 | I105-V108 HydrophobicContact CG2-CG2 4.07Å; I105-L122 HydrophobicContact CD1-CB 4.31Å; I105-L122 HydrophobicContact CG2-CD2 4.21Å; I105-A124 HydrophobicContact CD1-CB 4.16Å; I105-Q171 WeakPolarHBondContact O-CB 3.47Å; I105-Q171 PolarHBondContact O-N 2.89Å |
| 106 | E | 90.5 | Very high | 88.9 | Confident | 111 Ų | 111 | 78.9 Ų | 78.9 | 52% | 0.519 | 45% | 0.45 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -72.7 | -43.6 | -179.9 | 178.9 | -177.4 | -124.2 | 0 | 0 | 111.4 | Y104 N123 A125 | Y104-E106 HydrophobicContact CD2-CB 4.49Å; Y104-E106 HydrophobicContact CE2-CB 3.86Å; Y104-E106 HydrophobicContact CE2-CG 4.4Å; Y104-E106 PolarHBondContact O-N 2.8Å; E106-N123 PolarHBondContact N-O 2.83Å; E106-A125 HydrophobicContact CB-CB 3.87Å |
| 107 | S | 86.8 | Confident | 88.5 | Confident | 43 Ų | 43 | 80.1 Ų | 80.1 | 30% | 0.301 | 47% | 0.466 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -150.3 | 158.4 | -178.6 | 62.7 | 0 | 0 | 0 | 0 | 112.1 | N123 | S107-N123 PolarHBondContact N-O 2.89Å; S107-N123 PolarHBondContact O-N 2.9Å; S107-N123 WeakPolarHBondContact OG-CB 3.39Å; S107-N123 PolarHBondContact OG-ND2 2.96Å; S107-N123 VanDerWaalsContact OG-ND2 3.08Å |
| 108 | V | 86.1 | Confident | 88.1 | Confident | 31 Ų | 31 | 78.7 Ų | 78.7 | 19% | 0.188 | 47% | 0.469 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.8 | 120.8 | 171.9 | -176.3 | 0 | 0 | 0 | 0 | 107.2 | I105 T120 S121 L122 S168 K169 | I105-V108 HydrophobicContact CG2-CG2 4.07Å; V108-T120 HydrophobicContact CG1-CG2 3.34Å; V108-S121 WeakPolarHBondContact CA-O 3.35Å; V108-L122 HydrophobicContact CB-CD2 4.34Å; V108-L122 HydrophobicContact CG1-CD2 4.03Å; V108-L122 HydrophobicContact CG2-CD2 3.56Å; V108-S168 WeakPolarHBondContact CG1-OG 3.36Å; V108-K169 WeakPolarHBondContact CG2-O 3.4Å |
| 109 | T | 83.7 | Confident | 87.8 | Confident | 57 Ų | 57 | 79.3 Ų | 79.3 | 35% | 0.35 | 48% | 0.478 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.5 | 125.7 | 178.5 | -54.1 | 0 | 0 | 0 | 0 | 108.7 | T120 S121 N123 | T109-T120 CarbonylContact O-C 3.36Å; T109-T120 WeakPolarHBondContact O-CA 3.44Å; T109-S121 PolarHBondContact N-O 2.83Å; T109-S121 PolarHBondContact O-N 3.05Å; T109-N123 PolarHBondContact OG1-ND2 2.9Å |
| 110 | T | 83.3 | Confident | 87.5 | Confident | 64 Ų | 64 | 81.1 Ų | 81.1 | 39% | 0.393 | 48% | 0.484 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.6 | 110.8 | 172.9 | -57.8 | 0 | 0 | 0 | 0 | 109.2 | S119 T120 | T110-S119 CarbonylContact C-O 3.53Å; T110-S119 WeakPolarHBondContact CA-O 3.41Å; T110-T120 PolarHBondContact OG1-OG1 2.82Å; T110-T120 VanDerWaalsContact OG1-OG1 3.11Å |
| 111 | D | 83.7 | Confident | 87.2 | Confident | 95 Ų | 95 | 79.6 Ų | 79.6 | 51% | 0.508 | 48% | 0.481 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.5 | 126.3 | 174.7 | -65.8 | -47.8 | 0 | 0 | 0 | 108.9 | S118 S119 | D111-S118 CarbonylContact O-C 3.53Å; D111-S118 VanDerWaalsContact O-CA 3.27Å; D111-S118 WeakPolarHBondContact O-CA 3.32Å; D111-S119 PolarHBondContact N-O 2.93Å; D111-S119 PolarHBondContact O-N 3.08Å |
| 112 | T | 85.9 | Confident | 86.9 | Confident | 102 Ų | 102 | 78.9 Ų | 78.9 | 63% | 0.626 | 48% | 0.481 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -113.8 | 117.7 | 176.9 | -59.9 | 0 | 0 | 0 | 0 | 109.3 | S118 | T112-S118 WeakPolarHBondContact CB-OG 3.29Å; T112-S118 VanDerWaalsContact CG2-OG 3.3Å; T112-S118 WeakPolarHBondContact CG2-OG 3.39Å; T112-S118 PolarHBondContact OG1-OG 2.8Å |
| 113 | T | 84.4 | Confident | 86.7 | Confident | 80 Ų | 80 | 78 Ų | 78 | 49% | 0.491 | 48% | 0.478 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.6 | 124.8 | 176.5 | -58.7 | 0 | 0 | 0 | 0 | 109.3 | N115 V116 G117 | T113-N115 PolarHBondContact O-N 3.34Å; T113-V116 HydrophobicContact CG2-CB 3.89Å; T113-V116 HydrophobicContact CG2-CG2 3.72Å; T113-V116 PolarHBondContact O-N 3.23Å; T113-V116 VanDerWaalsContact O-N 3.14Å; T113-G117 PolarHBondContact N-O 2.83Å; T113-G117 PolarHBondContact O-N 3.06Å; T113-G117 VanDerWaalsContact O-N 3.07Å |
| 114 | A | 86.2 | Confident | 86.7 | Confident | 83 Ų | 83 | 77.5 Ų | 77.5 | 69% | 0.686 | 48% | 0.479 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.7 | 133.6 | -180 | 0 | 0 | 0 | 0 | 0 | 111.1 | V116 | A114-V116 PolarHBondContact O-N 3.33Š|
| 115 | N | 85.1 | Confident | 86.7 | Confident | 178 Ų | 178 | 76.8 Ų | 76.8 | 95% | 0.952 | 48% | 0.48 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 61.9 | 2.3 | -179.1 | -60.9 | 34.5 | 0 | 0 | 0 | 116.3 | T113 | T113-N115 PolarHBondContact O-N 3.34Š|
| 116 | V | 84.1 | Confident | 86.8 | Confident | 123 Ų | 123 | 78.4 Ų | 78.4 | 75% | 0.745 | 49% | 0.492 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -111 | -35.3 | 178 | -177.5 | 0 | 0 | 0 | 0 | 111.1 | T113 A114 | T113-V116 HydrophobicContact CG2-CB 3.89Å; T113-V116 HydrophobicContact CG2-CG2 3.72Å; T113-V116 PolarHBondContact O-N 3.23Å; T113-V116 VanDerWaalsContact O-N 3.14Å; A114-V116 PolarHBondContact O-N 3.33Å |
| 117 | G | 85.7 | Confident | 87 | Confident | 42 Ų | 42 | 74.7 Ų | 74.7 | 43% | 0.433 | 48% | 0.476 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | 121.8 | -173.3 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | T113 | T113-G117 PolarHBondContact N-O 2.83Å; T113-G117 PolarHBondContact O-N 3.06Å; T113-G117 VanDerWaalsContact O-N 3.07Å |
| 118 | S | 84.2 | Confident | 87.4 | Confident | 81 Ų | 81 | 76.1 Ų | 76.1 | 57% | 0.566 | 48% | 0.483 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -109.6 | 138.3 | 174.4 | -56.3 | 0 | 0 | 0 | 0 | 110.7 | D111 T112 | D111-S118 CarbonylContact O-C 3.53Å; D111-S118 VanDerWaalsContact O-CA 3.27Å; D111-S118 WeakPolarHBondContact O-CA 3.32Å; T112-S118 WeakPolarHBondContact CB-OG 3.29Å; T112-S118 VanDerWaalsContact CG2-OG 3.3Å; T112-S118 WeakPolarHBondContact CG2-OG 3.39Å; T112-S118 PolarHBondContact OG1-OG 2.8Å |
| 119 | S | 83.3 | Confident | 87.7 | Confident | 75 Ų | 75 | 75 Ų | 75 | 52% | 0.524 | 48% | 0.475 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.3 | 133.2 | 171.5 | 54.3 | 0 | 0 | 0 | 0 | 109.8 | T110 D111 | T110-S119 CarbonylContact C-O 3.53Å; T110-S119 WeakPolarHBondContact CA-O 3.41Å; D111-S119 PolarHBondContact N-O 2.93Å; D111-S119 PolarHBondContact O-N 3.08Å |
| 120 | T | 84.6 | Confident | 88.1 | Confident | 90 Ų | 90 | 73.1 Ų | 73.1 | 55% | 0.552 | 47% | 0.468 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -111.3 | 127.9 | 177 | -59.7 | 0 | 0 | 0 | 0 | 109.7 | V108 T109 T110 | V108-T120 HydrophobicContact CG1-CG2 3.34Å; T109-T120 CarbonylContact O-C 3.36Å; T109-T120 WeakPolarHBondContact O-CA 3.44Å; T110-T120 PolarHBondContact OG1-OG1 2.82Å; T110-T120 VanDerWaalsContact OG1-OG1 3.11Å |
| 121 | S | 85.8 | Confident | 88.5 | Confident | 59 Ų | 59 | 70.6 Ų | 70.6 | 41% | 0.413 | 45% | 0.452 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.8 | 139.4 | 176.2 | -175.1 | 0 | 0 | 0 | 0 | 110.5 | V108 T109 | V108-S121 WeakPolarHBondContact CA-O 3.35Å; T109-S121 PolarHBondContact N-O 2.83Å; T109-S121 PolarHBondContact O-N 3.05Å |
| 122 | L | 87 | Confident | 88.9 | Confident | 112 Ų | 112 | 68.1 Ų | 68.1 | 59% | 0.586 | 44% | 0.438 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -96.6 | 120.6 | 171.5 | -61.8 | 176.4 | 0 | 0 | 0 | 108.8 | I105 V108 | I105-L122 HydrophobicContact CD1-CB 4.31Å; I105-L122 HydrophobicContact CG2-CD2 4.21Å; V108-L122 HydrophobicContact CB-CD2 4.34Å; V108-L122 HydrophobicContact CG1-CD2 4.03Å; V108-L122 HydrophobicContact CG2-CD2 3.56Å |
| 123 | N | 90.5 | Very high | 89.3 | Confident | 57 Ų | 57 | 63.3 Ų | 63.3 | 31% | 0.305 | 41% | 0.409 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.6 | 110.8 | 175.4 | -54.9 | -56.6 | 0 | 0 | 0 | 108.8 | E106 S107 T109 | E106-N123 PolarHBondContact N-O 2.83Å; S107-N123 PolarHBondContact N-O 2.89Å; S107-N123 PolarHBondContact O-N 2.9Å; S107-N123 WeakPolarHBondContact OG-CB 3.39Å; S107-N123 PolarHBondContact OG-ND2 2.96Å; S107-N123 VanDerWaalsContact OG-ND2 3.08Å; T109-N123 PolarHBondContact OG1-ND2 2.9Å |
| 124 | A | 93.1 | Very high | 89.9 | Confident | 71 Ų | 71 | 62.2 Ų | 62.2 | 59% | 0.587 | 40% | 0.402 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -90 | 139 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111 | Y104 I105 | Y104-A124 CarbonylContact O-C 3.56Å; Y104-A124 VanDerWaalsContact O-CA 3.27Å; Y104-A124 WeakPolarHBondContact O-CA 3.17Å; I105-A124 HydrophobicContact CD1-CB 4.16Å |
| 125 | A | 94.1 | Very high | 90.3 | Very high | 20 Ų | 20 | 58.2 Ų | 58.2 | 17% | 0.165 | 37% | 0.369 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.7 | 172.3 | 168.1 | 0 | 0 | 0 | 0 | 0 | 109.7 | S103 Y104 E106 | S103-A125 CarbonylContact C-O 3.59Å; S103-A125 VanDerWaalsContact CA-O 3.22Å; S103-A125 WeakPolarHBondContact CA-O 3.4Å; Y104-A125 HydrophobicContact CD1-CB 4.41Å; Y104-A125 HydrophobicContact CE1-CB 3.76Å; Y104-A125 HydrophobicContact CE2-CB 4.26Å; Y104-A125 PolarHBondContact N-O 2.88Å; Y104-A125 PolarHBondContact O-N 2.79Å; E106-A125 HydrophobicContact CB-CB 3.87Å |
| 126 | T | 95.1 | Very high | 90.9 | Very high | 72 Ų | 72 | 52.3 Ų | 52.3 | 44% | 0.442 | 34% | 0.337 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.3 | 141 | 176.3 | 62.1 | 0 | 0 | 0 | 0 | 110.7 | Q101 Q102 | Q101-T126 HydrophobicContact CG-CG2 4.2Å; Q101-T126 PolarHBondContact NE2-OG1 2.92Å; Q102-T126 CarbonylContact O-C 3.57Å; Q102-T126 WeakPolarHBondContact O-CA 3.22Å |
| 127 | I | 94.4 | Very high | 91.5 | Very high | 34 Ų | 34 | 46.5 Ų | 46.5 | 17% | 0.174 | 30% | 0.302 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -116 | 133.5 | 170.8 | -170.4 | 164.7 | 0 | 0 | 0 | 109.6 | Q101 Q102 Y104 T129 P158 P173 V175 | Q101-I127 CarbonylContact C-O 3.6Å; Q101-I127 WeakPolarHBondContact CA-O 3.43Å; Q102-I127 HydrophobicContact CB-CG2 4.21Å; Q102-I127 PolarHBondContact N-O 3.01Å; Q102-I127 PolarHBondContact O-N 3.33Å; Y104-I127 HydrophobicContact CD1-CB 4.31Å; Y104-I127 HydrophobicContact CD1-CG2 4.19Å; Y104-I127 HydrophobicContact CE1-CB 4.11Å; Y104-I127 HydrophobicContact CE1-CG2 4.49Å; I127-T129 HydrophobicContact CG1-CG2 4.23Å; I127-P158 HydrophobicContact CD1-CB 4.41Å; I127-P158 HydrophobicContact CG2-CB 4.29Å; I127-P158 HydrophobicContact CG2-CG 4.06Å; I127-P173 HydrophobicContact CD1-CB 3.64Å; I127-P173 HydrophobicContact CD1-CG 3.88Å; I127-P173 HydrophobicContact CG2-CB 4.44Å; I127-V175 HydrophobicContact CD1-CG2 3.46Å; I127-V175 VanDerWaalsContact CD1-CG2 3.46Å; I127-V175 HydrophobicContact CG1-CG2 4.42Å |
| 128 | T | 94.6 | Very high | 92 | Very high | 73 Ų | 73 | 48.3 Ų | 48.3 | 45% | 0.448 | 30% | 0.298 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.2 | 121.5 | -180 | -57.7 | 0 | 0 | 0 | 0 | 108.8 | A99 N100 | A99-T128 HydrophobicContact CB-CG2 3.52Å; N100-T128 WeakPolarHBondContact O-CA 3.23Å |
| 129 | T | 93.8 | Very high | 92.5 | Very high | 6 Ų | 6 | 44.6 Ų | 44.6 | 4% | 0.037 | 27% | 0.272 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.5 | 166 | -179.7 | 58.5 | 0 | 0 | 0 | 0 | 110.9 | A99 N100 I127 D156 P158 V175 | A99-T129 CarbonylContact C-O 3.59Å; A99-T129 WeakPolarHBondContact CA-O 3.39Å; N100-T129 PolarHBondContact N-O 3.01Å; N100-T129 PolarHBondContact O-N 2.9Å; I127-T129 HydrophobicContact CG1-CG2 4.23Å; T129-D156 WeakPolarHBondContact CB-O 3.39Å; T129-D156 WeakPolarHBondContact CG2-O 3.35Å; T129-P158 HydrophobicContact CG2-CG 4.42Å; T129-V175 HydrophobicContact CG2-CB 4.46Å; T129-V175 HydrophobicContact CG2-CG1 3.87Å; T129-V175 HydrophobicContact CG2-CG2 3.66Å |
| 130 | G | 91.2 | Very high | 93 | Very high | 19 Ų | 19 | 43.8 Ų | 43.8 | 20% | 0.196 | 26% | 0.261 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 122 | -152 | -176.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | I98 L154 S155 | I98-G130 CarbonylContact O-C 3.54Å; G130-L154 CarbonylContact O-C 3.54Å; G130-L154 WeakPolarHBondContact O-CA 3.44Å; G130-S155 PolarHBondContact N-O 2.76Å; G130-S155 PolarHBondContact O-N 2.94Å |
| 131 | F | 91.1 | Very high | 93.3 | Very high | 11 Ų | 11 | 44.2 Ų | 44.2 | 5% | 0.048 | 27% | 0.266 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.1 | 127.6 | -174.2 | 177.8 | -94.5 | 0 | 0 | 0 | 111.5 | I11 Q97 I98 M133 M152 S153 L154 F197 V232 | I11-F131 HydrophobicContact CD1-CD1 3.59Å; I11-F131 HydrophobicContact CD1-CE1 3.28Å; I11-F131 HydrophobicContact CD1-CG 4.4Å; I11-F131 HydrophobicContact CD1-CZ 3.88Å; I11-F131 HydrophobicContact CG1-CE1 4.35Å; Q97-F131 VanDerWaalsContact NE2-C 3.32Å; Q97-F131 PolarHBondContact NE2-O 3.42Å; I98-F131 HydrophobicContact CD1-CD1 4.27Å; I98-F131 PolarHBondContact N-O 2.72Å; I98-F131 PolarHBondContact O-N 3.16Å; F131-M133 HydrophobicContact CE1-CB 3.71Å; F131-M133 HydrophobicContact CZ-CB 3.78Å; F131-M133 HydrophobicContact CZ-SD 4.25Å; F131-M152 HydrophobicContact CE2-CB 4.21Å; F131-M152 HydrophobicContact CZ-CB 4.27Å; F131-S153 WeakPolarHBondContact CA-O 3.47Å; F131-L154 HydrophobicContact CB-CD1 4.01Å; F131-L154 HydrophobicContact CD2-CD1 4.42Å; F131-F197 HydrophobicContact CE2-CE2 4.44Å; F131-V232 HydrophobicContact CE2-CG2 4.41Å; F131-V232 HydrophobicContact CZ-CG2 4.29Å |
| 132 | N | 93 | Very high | 93.3 | Very high | 43 Ų | 43 | 49.6 Ų | 49.6 | 23% | 0.23 | 29% | 0.29 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.2 | 149.5 | 168 | 62 | -85.6 | 0 | 0 | 0 | 111.2 | M96 Q97 M152 S153 | M96-N132 CarbonylContact O-C 3.57Å; M96-N132 WeakPolarHBondContact O-CA 3.38Å; Q97-N132 VanDerWaalsContact OE1-CB 3.22Å; N132-M152 CarbonylContact O-C 3.6Å; N132-M152 VanDerWaalsContact O-CA 3.27Å; N132-M152 WeakPolarHBondContact O-CA 3.43Å; N132-S153 PolarHBondContact N-O 2.94Å; N132-S153 PolarHBondContact ND2-OG 3.48Å; N132-S153 PolarHBondContact O-N 2.79Å; N132-S153 PolarHBondContact OD1-O 3.25Å; N132-S153 PolarHBondContact OD1-OG 2.76Å |
| 133 | M | 93.8 | Very high | 93.3 | Very high | 1 Ų | 1 | 46 Ų | 46 | 1% | 0.005 | 27% | 0.274 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -148.9 | 142.8 | 175.7 | -178.3 | 177.6 | 67.8 | 0 | 0 | 110.8 | V9 P95 M96 F131 L135 S151 M152 V232 I234 | V9-M133 HydrophobicContact CB-CE 4.32Å; V9-M133 HydrophobicContact CG1-CE 3.57Å; V9-M133 HydrophobicContact CG2-CE 3.87Å; P95-M133 CarbonylContact C-O 3.59Å; P95-M133 WeakPolarHBondContact CA-O 3.29Å; M96-M133 HydrophobicContact CE-CE 4.2Å; M96-M133 PolarHBondContact N-O 3.17Å; M96-M133 PolarHBondContact O-N 2.88Å; M96-M133 HydrophobicContact SD-CE 3.63Å; F131-M133 HydrophobicContact CE1-CB 3.71Å; F131-M133 HydrophobicContact CZ-CB 3.78Å; F131-M133 HydrophobicContact CZ-SD 4.25Å; M133-L135 HydrophobicContact CE-CD1 3.75Å; M133-L135 HydrophobicContact CE-CD2 4Å; M133-L135 HydrophobicContact CE-CG 3.81Å; M133-L135 HydrophobicContact CG-CD2 3.97Å; M133-L135 HydrophobicContact CG-CG 4.27Å; M133-L135 HydrophobicContact SD-CD2 3.7Å; M133-L135 HydrophobicContact SD-CG 4.15Å; M133-S151 CarbonylContact C-O 3.48Å; M133-S151 WeakPolarHBondContact CA-O 3.46Å; M133-M152 HydrophobicContact CB-CB 4.14Å; M133-M152 HydrophobicContact CG-CB 4.03Å; M133-M152 HydrophobicContact SD-CE 3.77Å; M133-V232 HydrophobicContact SD-CG1 4.3Å; M133-I234 HydrophobicContact SD-CD1 4.27Å |
| 134 | T | 96.3 | Very high | 93.3 | Very high | 56 Ų | 56 | 48.6 Ų | 48.6 | 34% | 0.344 | 28% | 0.284 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.7 | 129.3 | 167.5 | -58.7 | 0 | 0 | 0 | 0 | 108.9 | P93 V94 Y150 S151 | P93-T134 HydrophobicContact CB-CG2 3.91Å; V94-T134 WeakPolarHBondContact O-CA 3.49Å; T134-Y150 WeakPolarHBondContact O-CA 3.37Å; T134-S151 PolarHBondContact N-O 2.62Å; T134-S151 PolarHBondContact O-N 3Å |
| 135 | L | 96.5 | Very high | 93.4 | Very high | 0 Ų | 0 | 46.7 Ų | 46.7 | 0% | 0 | 27% | 0.265 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -111 | 128.9 | 174.5 | -59.8 | -178.5 | 0 | 0 | 0 | 110 | L7 V9 P93 V94 M133 L148 Y150 I234 | L7-L135 HydrophobicContact CB-CD1 4.38Å; L7-L135 HydrophobicContact CD1-CB 3.83Å; L7-L135 HydrophobicContact CD1-CD1 3.96Å; V9-L135 HydrophobicContact CG2-CD1 3.6Å; P93-L135 CarbonylContact C-O 3.57Å; P93-L135 WeakPolarHBondContact CA-O 3.39Å; V94-L135 HydrophobicContact CB-CB 4.41Å; V94-L135 PolarHBondContact N-O 2.84Å; V94-L135 PolarHBondContact O-N 3.15Å; M133-L135 HydrophobicContact CE-CD1 3.75Å; M133-L135 HydrophobicContact CE-CD2 4Å; M133-L135 HydrophobicContact CE-CG 3.81Å; M133-L135 HydrophobicContact CG-CD2 3.97Å; M133-L135 HydrophobicContact CG-CG 4.27Å; M133-L135 HydrophobicContact SD-CD2 3.7Å; M133-L135 HydrophobicContact SD-CG 4.15Å; L135-L148 HydrophobicContact CB-CD1 4.23Å; L135-L148 HydrophobicContact CD2-CD2 4.49Å; L135-Y150 VanDerWaalsContact CD2-CB 3.47Å; L135-I234 HydrophobicContact CD1-CD1 4.29Å; L135-I234 HydrophobicContact CD1-CG2 4.08Å; L135-I234 HydrophobicContact CD2-CD1 3.69Å |
| 136 | L | 96.8 | Very high | 93.4 | Very high | 54 Ų | 54 | 45.7 Ų | 45.7 | 28% | 0.283 | 26% | 0.257 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.3 | 105.9 | 175.1 | 179.3 | 64.7 | 0 | 0 | 0 | 109.5 | P93 L149 | P93-L136 HydrophobicContact CB-CD1 4.31Å; L136-L149 HydrophobicContact CB-CB 4.26Å; L136-L149 HydrophobicContact CD2-CD2 4.19Å; L136-L149 PolarHBondContact N-O 2.98Å; L136-L149 PolarHBondContact O-N 2.76Å |
| 137 | P | 96.8 | Very high | 93.4 | Very high | 0 Ų | 0 | 45.9 Ų | 45.9 | 0% | 0 | 25% | 0.253 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.4 | 135.2 | 175.5 | 31.7 | -31.3 | 0 | 0 | 0 | 111.4 | V5 L7 T88 N90 L91 L146 L148 | V5-P137 HydrophobicContact CG1-CB 3.79Å; V5-P137 HydrophobicContact CG1-CG 3.67Å; L7-P137 HydrophobicContact CD1-CG 4.37Å; T88-P137 HydrophobicContact CG2-CG 3.58Å; N90-P137 PolarHBondContact OD1-O 3.21Å; L91-P137 PolarHBondContact N-O 2.84Å; P137-L146 HydrophobicContact CB-CD1 4.1Å; P137-L148 HydrophobicContact CB-CD1 4.25Å |
| 138 | F | 96.1 | Very high | 93.5 | Very high | 80 Ų | 80 | 44.3 Ų | 44.3 | 35% | 0.351 | 25% | 0.245 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -116.5 | 100.9 | 164.2 | 173.9 | -119.6 | 0 | 0 | 0 | 109.5 | N90 L91 L140 L146 Q147 | N90-F138 VanDerWaalsContact OD1-CA 3.26Å; N90-F138 WeakPolarHBondContact OD1-CA 3.47Å; L91-F138 HydrophobicContact CD2-CB 4.13Å; L91-F138 HydrophobicContact CD2-CD2 3.77Å; L91-F138 HydrophobicContact CD2-CG 4.34Å; L91-F138 HydrophobicContact CG-CD2 4.18Å; F138-L140 HydrophobicContact CD1-CD1 4.28Å; F138-L140 HydrophobicContact CE1-CD1 4.34Å; F138-L140 HydrophobicContact CE1-CG 4.49Å; F138-L140 PolarHBondContact O-N 2.82Å; F138-L146 CarbonylContact O-C 3.52Å; F138-L146 VanDerWaalsContact O-CA 3.22Å; F138-L146 WeakPolarHBondContact O-CA 3.49Å; F138-L146 WeakPolarHBondContact O-CB 3.46Å; F138-Q147 HydrophobicContact CB-CB 4.27Å; F138-Q147 HydrophobicContact CD1-CB 4.21Å; F138-Q147 PolarHBondContact N-O 2.91Å; F138-Q147 PolarHBondContact O-N 3.01Å |
| 139 | I | 95.6 | Very high | 93.5 | Very high | 3 Ų | 3 | 44.4 Ų | 44.4 | 2% | 0.015 | 24% | 0.242 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -77.5 | 119.3 | 178.9 | -54.3 | 173.1 | 0 | 0 | 0 | 108.5 | R3 V5 N90 L146 I238 | R3-I139 HydrophobicContact CB-CD1 3.78Å; R3-I139 HydrophobicContact CB-CG2 4.44Å; R3-I139 VanDerWaalsContact NH1-CG2 3.26Å; V5-I139 HydrophobicContact CB-CD1 4.13Å; V5-I139 HydrophobicContact CG1-CD1 4.35Å; N90-I139 HydrophobicContact CB-CD1 4.18Å; N90-I139 HydrophobicContact CB-CG1 4.38Å; N90-I139 PolarHBondContact OD1-N 2.92Å; I139-L146 HydrophobicContact CG1-CB 4.33Å; I139-I238 HydrophobicContact CD1-CG2 4.47Å; I139-I238 HydrophobicContact CG2-CD1 4.01Å; I139-I238 HydrophobicContact CG2-CG2 4.43Å |
| 140 | L | 93.3 | Very high | 93.5 | Very high | 59 Ų | 59 | 44.1 Ų | 44.1 | 31% | 0.309 | 24% | 0.241 | S | C | . | . | P | Polyproline II helix | trans | -65.1 | 140.5 | 178.8 | -83.3 | 71.7 | 0 | 0 | 0 | 110.1 | R3 F138 D142 S143 T145 Q147 | R3-L140 PolarHBondContact NH1-O 2.86Å; F138-L140 HydrophobicContact CD1-CD1 4.28Å; F138-L140 HydrophobicContact CE1-CD1 4.34Å; F138-L140 HydrophobicContact CE1-CG 4.49Å; F138-L140 PolarHBondContact O-N 2.82Å; L140-D142 PolarHBondContact O-N 2.87Å; L140-S143 PolarHBondContact O-N 2.86Å; L140-T145 PolarHBondContact N-O 2.84Å; L140-Q147 HydrophobicContact CD1-CB 4.49Å |
| 141 | P | 90.1 | Very high | 93.6 | Very high | 99 Ų | 99 | 45.3 Ų | 45.3 | 64% | 0.643 | 25% | 0.246 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -53.3 | 137.3 | 175.2 | -25.4 | 34.6 | 0 | 0 | 0 | 111.8 | S143 | P141-S143 PolarHBondContact O-N 2.72Š|
| 142 | D | 85.4 | Confident | 93.7 | Very high | 172 Ų | 172 | 44.8 Ų | 44.8 | 92% | 0.92 | 24% | 0.244 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 52 | 19.1 | 174.6 | -51.4 | -43.5 | 0 | 0 | 0 | 116.3 | L140 | L140-D142 PolarHBondContact O-N 2.87Š|
| 143 | S | 88 | Confident | 93.6 | Very high | 35 Ų | 35 | 43.4 Ų | 43.4 | 25% | 0.245 | 24% | 0.237 | C | C | . | . | S | Bend | trans | -120.9 | 153.7 | -177.3 | -176.9 | 0 | 0 | 0 | 0 | 111.7 | R3 L140 P141 T145 | R3-S143 VanDerWaalsContact CZ-O 3.26Å; R3-S143 PolarHBondContact NH1-O 2.81Å; R3-S143 PolarHBondContact NH2-O 3.25Å; L140-S143 PolarHBondContact O-N 2.86Å; P141-S143 PolarHBondContact O-N 2.72Å; S143-T145 PolarHBondContact O-N 2.9Å; S143-T145 VanDerWaalsContact OG-CB 3.28Å; S143-T145 WeakPolarHBondContact OG-CB 3.46Å; S143-T145 PolarHBondContact OG-N 3.48Å; S143-T145 PolarHBondContact OG-OG1 2.85Å |
| 144 | Q | 90.6 | Very high | 93.4 | Very high | 113 Ų | 113 | 44.3 Ų | 44.3 | 53% | 0.528 | 24% | 0.242 | S | C | . | . | S | Bend | trans | -85.5 | 19.1 | 165.4 | -71.8 | -66.6 | -34.3 | 0 | 0 | 111.8 | K187 S188 | Q144-K187 CarbonylContact O-C 3.57Å; Q144-K187 WeakPolarHBondContact O-CA 3.39Å; Q144-S188 PolarHBondContact O-N 3.49Å |
| 145 | T | 94.3 | Very high | 93.1 | Very high | 30 Ų | 30 | 42.6 Ų | 42.6 | 18% | 0.184 | 23% | 0.232 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -109.9 | 142.7 | 179.5 | -46.3 | 0 | 0 | 0 | 0 | 110 | L140 S143 L186 | L140-T145 PolarHBondContact N-O 2.84Å; S143-T145 PolarHBondContact O-N 2.9Å; S143-T145 VanDerWaalsContact OG-CB 3.28Å; S143-T145 WeakPolarHBondContact OG-CB 3.46Å; S143-T145 PolarHBondContact OG-N 3.48Å; S143-T145 PolarHBondContact OG-OG1 2.85Å; T145-L186 CarbonylContact C-O 3.48Å; T145-L186 WeakPolarHBondContact CA-O 3.3Å; T145-L186 WeakPolarHBondContact CG2-O 3.11Å |
| 146 | L | 94.6 | Very high | 92.7 | Very high | 0 Ų | 0 | 43.9 Ų | 43.9 | 0% | 0 | 24% | 0.239 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -130.1 | 148.9 | 169.5 | 64.9 | 127.1 | 0 | 0 | 0 | 110.3 | V5 P137 F138 I139 L148 D185 L186 P236 I238 | V5-L146 HydrophobicContact CG2-CD2 4.43Å; P137-L146 HydrophobicContact CB-CD1 4.1Å; F138-L146 CarbonylContact O-C 3.52Å; F138-L146 VanDerWaalsContact O-CA 3.22Å; F138-L146 WeakPolarHBondContact O-CA 3.49Å; F138-L146 WeakPolarHBondContact O-CB 3.46Å; I139-L146 HydrophobicContact CG1-CB 4.33Å; L146-L148 HydrophobicContact CD1-CB 4.03Å; L146-L148 HydrophobicContact CD1-CD1 4.31Å; L146-D185 WeakPolarHBondContact O-CA 3Å; L146-L186 PolarHBondContact N-O 2.79Å; L146-L186 PolarHBondContact O-N 2.82Å; L146-P236 HydrophobicContact CD1-CB 3.93Å; L146-P236 HydrophobicContact CD1-CG 4.17Å; L146-P236 HydrophobicContact CD2-CB 3.53Å; L146-P236 HydrophobicContact CD2-CG 3.72Å; L146-P236 HydrophobicContact CG-CB 4.3Å; L146-P236 HydrophobicContact CG-CG 4.32Å; L146-I238 HydrophobicContact CD2-CD1 3.91Å; L146-I238 HydrophobicContact CD2-CG1 3.81Å |
| 147 | Q | 95.3 | Very high | 92.3 | Very high | 76 Ų | 76 | 49.6 Ų | 49.6 | 36% | 0.355 | 26% | 0.262 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.2 | 130.1 | 162 | -176.9 | 165.4 | 103.8 | 0 | 0 | 108.4 | F138 L140 T183 V184 D185 | F138-Q147 HydrophobicContact CB-CB 4.27Å; F138-Q147 HydrophobicContact CD1-CB 4.21Å; F138-Q147 PolarHBondContact N-O 2.91Å; F138-Q147 PolarHBondContact O-N 3.01Å; L140-Q147 HydrophobicContact CD1-CB 4.49Å; Q147-T183 HydrophobicContact CG-CG2 3.21Å; Q147-V184 CarbonylContact C-O 3.54Å; Q147-V184 WeakPolarHBondContact CA-O 3.47Å; Q147-D185 VanDerWaalsContact CB-OD1 3.27Å; Q147-D185 WeakPolarHBondContact CB-OD1 3.38Å; Q147-D185 VanDerWaalsContact CG-OD1 3.29Å; Q147-D185 WeakPolarHBondContact CG-OD1 3.18Å; Q147-D185 PolarHBondContact NE2-OD1 2.83Å |
| 148 | L | 95.5 | Very high | 92.1 | Very high | 0 Ų | 0 | 50.3 Ų | 50.3 | 0% | 0 | 27% | 0.266 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.1 | 107.7 | 178.1 | -172.8 | 67.3 | 0 | 0 | 0 | 108.8 | L7 L135 P137 L146 T183 V184 L186 I234 | L7-L148 HydrophobicContact CD1-CD1 4.44Å; L7-L148 HydrophobicContact CD2-CD1 4.28Å; L135-L148 HydrophobicContact CB-CD1 4.23Å; L135-L148 HydrophobicContact CD2-CD2 4.49Å; P137-L148 HydrophobicContact CB-CD1 4.25Å; L146-L148 HydrophobicContact CD1-CB 4.03Å; L146-L148 HydrophobicContact CD1-CD1 4.31Å; L148-T183 WeakPolarHBondContact O-CA 3.35Å; L148-V184 HydrophobicContact CB-CG2 4.13Å; L148-V184 PolarHBondContact N-O 2.84Å; L148-V184 PolarHBondContact O-N 3.33Å; L148-L186 HydrophobicContact CB-CD1 4.27Å; L148-L186 HydrophobicContact CD2-CD1 4.05Å; L148-I234 HydrophobicContact CD2-CB 4.39Å; L148-I234 HydrophobicContact CD2-CD1 4.23Å; L148-I234 HydrophobicContact CD2-CG2 3.77Å |
| 149 | L | 95.6 | Very high | 91.8 | Very high | 76 Ų | 76 | 51 Ų | 51 | 40% | 0.398 | 28% | 0.277 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.2 | 129 | 165.5 | 173 | 68.9 | 0 | 0 | 0 | 108 | L136 T183 | L136-L149 HydrophobicContact CB-CB 4.26Å; L136-L149 HydrophobicContact CD2-CD2 4.19Å; L136-L149 PolarHBondContact N-O 2.98Å; L136-L149 PolarHBondContact O-N 2.76Å; L149-T183 WeakPolarHBondContact CD1-OG1 3.47Å |
| 150 | Y | 93 | Very high | 91.7 | Very high | 0 Ų | 0 | 52.7 Ų | 52.7 | 0% | 0 | 29% | 0.286 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.1 | 140.9 | 174.5 | 60.9 | -94.5 | 0 | 0 | 0 | 111.2 | V55 T134 L135 M152 I180 N181 Q182 V184 I194 | V55-Y150 WeakPolarHBondContact CG2-OH 3.29Å; T134-Y150 WeakPolarHBondContact O-CA 3.37Å; L135-Y150 VanDerWaalsContact CD2-CB 3.47Å; Y150-M152 HydrophobicContact CD2-CE 3.68Å; Y150-M152 HydrophobicContact CD2-CG 4.38Å; Y150-M152 HydrophobicContact CD2-SD 4.39Å; Y150-M152 HydrophobicContact CE2-CE 4.07Å; Y150-M152 HydrophobicContact CE2-SD 4.47Å; Y150-M152 HydrophobicContact CG-CE 4.42Å; Y150-I180 HydrophobicContact CE2-CG2 4.14Å; Y150-N181 WeakPolarHBondContact O-CA 3.09Å; Y150-Q182 WeakPolarHBondContact CD1-O 3.41Å; Y150-Q182 HydrophobicContact CE1-CB 3.95Å; Y150-Q182 HydrophobicContact CE2-CB 3.74Å; Y150-Q182 HydrophobicContact CE2-CG 4.49Å; Y150-Q182 VanDerWaalsContact CZ-CB 3.41Å; Y150-Q182 PolarHBondContact N-O 3.08Å; Y150-Q182 PolarHBondContact O-N 3.14Å; Y150-Q182 VanDerWaalsContact O-N 3.08Å; Y150-Q182 VanDerWaalsContact OH-CB 3.29Å; Y150-Q182 WeakPolarHBondContact OH-CB 3.4Å; Y150-Q182 PolarHBondContact OH-NE2 3.28Å; Y150-V184 HydrophobicContact CD1-CG2 4.36Å; Y150-V184 HydrophobicContact CE1-CG1 3.99Å; Y150-V184 HydrophobicContact CE1-CG2 3.98Å; Y150-I194 HydrophobicContact CD1-CD1 4.11Å; Y150-I194 HydrophobicContact CD2-CD1 3.98Å; Y150-I194 HydrophobicContact CE1-CD1 3.76Å; Y150-I194 HydrophobicContact CE1-CG1 4.5Å; Y150-I194 HydrophobicContact CE2-CD1 3.6Å; Y150-I194 HydrophobicContact CE2-CG1 4.31Å; Y150-I194 HydrophobicContact CE2-CG2 4.27Å; Y150-I194 HydrophobicContact CG-CD1 4.19Å; Y150-I194 VanDerWaalsContact CZ-CD1 3.46Å |
| 151 | S | 94.2 | Very high | 91.6 | Very high | 44 Ų | 44 | 55.9 Ų | 55.9 | 31% | 0.308 | 30% | 0.299 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.7 | 119.9 | 173.6 | 177.7 | 0 | 0 | 0 | 0 | 107.3 | M133 T134 N181 | M133-S151 CarbonylContact C-O 3.48Å; M133-S151 WeakPolarHBondContact CA-O 3.46Å; T134-S151 PolarHBondContact N-O 2.62Å; T134-S151 PolarHBondContact O-N 3Å; S151-N181 WeakPolarHBondContact CA-OD1 3.33Å; S151-N181 WeakPolarHBondContact CB-OD1 3.39Å; S151-N181 PolarHBondContact OG-OD1 2.72Å |
| 152 | M | 92 | Very high | 91.7 | Very high | 0 Ų | 0 | 56.4 Ų | 56.4 | 0% | 0 | 30% | 0.296 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.4 | 139.8 | -177.7 | 48.5 | 178.5 | 65.9 | 0 | 0 | 110.1 | F131 N132 M133 Y150 T179 I180 I194 F197 V232 | F131-M152 HydrophobicContact CE2-CB 4.21Å; F131-M152 HydrophobicContact CZ-CB 4.27Å; N132-M152 CarbonylContact O-C 3.6Å; N132-M152 VanDerWaalsContact O-CA 3.27Å; N132-M152 WeakPolarHBondContact O-CA 3.43Å; M133-M152 HydrophobicContact CB-CB 4.14Å; M133-M152 HydrophobicContact CG-CB 4.03Å; M133-M152 HydrophobicContact SD-CE 3.77Å; Y150-M152 HydrophobicContact CD2-CE 3.68Å; Y150-M152 HydrophobicContact CD2-CG 4.38Å; Y150-M152 HydrophobicContact CD2-SD 4.39Å; Y150-M152 HydrophobicContact CE2-CE 4.07Å; Y150-M152 HydrophobicContact CE2-SD 4.47Å; Y150-M152 HydrophobicContact CG-CE 4.42Å; M152-T179 CarbonylContact O-C 3.59Å; M152-T179 WeakPolarHBondContact O-CA 3.29Å; M152-I180 HydrophobicContact CG-CB 3.85Å; M152-I180 WeakPolarHBondContact CG-O 3.36Å; M152-I180 PolarHBondContact N-O 2.79Å; M152-I180 PolarHBondContact O-N 2.85Å; M152-I180 HydrophobicContact SD-CB 4.27Å; M152-I194 HydrophobicContact CE-CB 4.46Å; M152-I194 HydrophobicContact CE-CD1 3.66Å; M152-I194 HydrophobicContact CE-CG2 4.18Å; M152-I194 HydrophobicContact SD-CG2 3.9Å; M152-F197 HydrophobicContact CB-CE2 4.42Å; M152-F197 HydrophobicContact CB-CZ 4.25Å; M152-F197 HydrophobicContact CG-CE2 3.92Å; M152-F197 HydrophobicContact CG-CZ 3.77Å; M152-F197 HydrophobicContact SD-CE2 3.47Å; M152-F197 WeakPolarHBondContact SD-CE2 3.43Å; M152-F197 HydrophobicContact SD-CZ 3.94Å; M152-V232 HydrophobicContact CE-CB 4.32Å; M152-V232 HydrophobicContact CE-CG1 4.25Å; M152-V232 HydrophobicContact CE-CG2 4.33Å; M152-V232 HydrophobicContact SD-CG2 4.49Å |
| 153 | S | 91.5 | Very high | 91.7 | Very high | 14 Ų | 14 | 55.7 Ų | 55.7 | 10% | 0.098 | 28% | 0.282 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.8 | 148.3 | 169.7 | 48.7 | 0 | 0 | 0 | 0 | 112.5 | F131 N132 K178 T179 | F131-S153 WeakPolarHBondContact CA-O 3.47Å; N132-S153 PolarHBondContact N-O 2.94Å; N132-S153 PolarHBondContact ND2-OG 3.48Å; N132-S153 PolarHBondContact O-N 2.79Å; N132-S153 PolarHBondContact OD1-O 3.25Å; N132-S153 PolarHBondContact OD1-OG 2.76Å; S153-K178 CarbonylContact C-O 3.59Å; S153-K178 WeakPolarHBondContact CA-O 3.34Å; S153-K178 VanDerWaalsContact CB-O 3.26Å; S153-K178 WeakPolarHBondContact CB-O 3.5Å; S153-T179 WeakPolarHBondContact CB-OG1 3.26Å |
| 154 | L | 90.3 | Very high | 91.6 | Very high | 20 Ų | 20 | 59.3 Ų | 59.3 | 11% | 0.105 | 30% | 0.295 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.7 | 123.9 | 176.7 | 179.6 | 70.8 | 0 | 0 | 0 | 108.3 | G130 F131 K178 F197 L230 | G130-L154 CarbonylContact O-C 3.54Å; G130-L154 WeakPolarHBondContact O-CA 3.44Å; F131-L154 HydrophobicContact CB-CD1 4.01Å; F131-L154 HydrophobicContact CD2-CD1 4.42Å; L154-K178 PolarHBondContact N-O 2.77Å; L154-K178 PolarHBondContact O-N 2.63Å; L154-F197 HydrophobicContact CB-CD1 3.89Å; L154-F197 HydrophobicContact CB-CE1 4.16Å; L154-F197 HydrophobicContact CB-CG 4.25Å; L154-F197 HydrophobicContact CD2-CB 3.85Å; L154-F197 HydrophobicContact CD2-CD1 4.44Å; L154-F197 HydrophobicContact CD2-CG 4.26Å; L154-L230 HydrophobicContact CD1-CD1 3.91Å; L154-L230 HydrophobicContact CD2-CD1 3.57Å; L154-L230 HydrophobicContact CD2-CG 4.37Å; L154-L230 HydrophobicContact CG-CD1 4.3Å |
| 155 | S | 90.7 | Very high | 91.1 | Very high | 20 Ų | 20 | 57.9 Ų | 57.9 | 14% | 0.14 | 30% | 0.298 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.3 | 135 | 170.1 | -59.8 | 0 | 0 | 0 | 0 | 110.3 | G130 D176 L177 | G130-S155 PolarHBondContact N-O 2.76Å; G130-S155 PolarHBondContact O-N 2.94Å; S155-D176 VanDerWaalsContact CA-O 3.3Å; S155-D176 WeakPolarHBondContact CA-O 3.26Å; S155-L177 WeakPolarHBondContact OG-CD1 3.4Å |
| 156 | D | 87.4 | Confident | 90.2 | Very high | 27 Ų | 27 | 60.6 Ų | 60.6 | 14% | 0.144 | 33% | 0.331 | C | S | . | . | P | Polyproline II helix | trans | -68.9 | 167.3 | 168.7 | -76.3 | 4.2 | 0 | 0 | 0 | 110.5 | T129 D176 Q199 | T129-D156 WeakPolarHBondContact CB-O 3.39Å; T129-D156 WeakPolarHBondContact CG2-O 3.35Å; D156-D176 HydrophobicContact CB-CB 4.43Å; D156-D176 PolarHBondContact N-O 2.88Å; D156-Q199 PolarHBondContact OD1-NE2 3.02Å; D156-Q199 PolarHBondContact OD2-NE2 2.87Å |
| 157 | K | 88.3 | Confident | 89.2 | Confident | 174 Ų | 174 | 63.6 Ų | 63.6 | 76% | 0.757 | 36% | 0.362 | S | S | * | . | P | Polyproline II helix | trans | -63.4 | 140.4 | 172.3 | -71.6 | -174.7 | 179.1 | -179.1 | 0 | 109.6 | V159 | K157-V159 PolarHBondContact O-N 2.81Š|
| 158 | P | 91.4 | Very high | 88.5 | Confident | 15 Ų | 15 | 61.6 Ų | 61.6 | 10% | 0.097 | 36% | 0.356 | C | S | . | . | P | Polyproline II helix | trans | -66.1 | 134.2 | -178.1 | 28.6 | -34.4 | 0 | 0 | 0 | 111.3 | Q102 I127 T129 I160 P173 N174 V175 | Q102-P158 VanDerWaalsContact OE1-CG 3.3Å; I127-P158 HydrophobicContact CD1-CB 4.41Å; I127-P158 HydrophobicContact CG2-CB 4.29Å; I127-P158 HydrophobicContact CG2-CG 4.06Å; T129-P158 HydrophobicContact CG2-CG 4.42Å; P158-I160 HydrophobicContact CB-CD1 3.95Å; P158-I160 HydrophobicContact CG-CD1 4.32Å; P158-P173 HydrophobicContact CB-CB 4.19Å; P158-N174 CarbonylContact C-O 3.58Å; P158-N174 WeakPolarHBondContact CA-O 3.07Å; P158-V175 HydrophobicContact CB-CG2 3.59Å |
| 159 | V | 91.7 | Very high | 88 | Confident | 94 Ų | 94 | 67.2 Ų | 67.2 | 57% | 0.57 | 38% | 0.381 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -88 | 113.4 | 164.8 | -179.1 | 0 | 0 | 0 | 0 | 106.9 | K157 N174 | K157-V159 PolarHBondContact O-N 2.81Å; V159-N174 PolarHBondContact N-O 3.43Å; V159-N174 PolarHBondContact O-N 2.85Å |
| 160 | I | 92.1 | Very high | 87.6 | Confident | 39 Ų | 39 | 64.6 Ų | 64.6 | 20% | 0.2 | 37% | 0.37 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -92.8 | 115 | -179.3 | -52.3 | -58.5 | 0 | 0 | 0 | 109.4 | P158 Q171 P173 | P158-I160 HydrophobicContact CB-CD1 3.95Å; P158-I160 HydrophobicContact CG-CD1 4.32Å; I160-Q171 HydrophobicContact CG2-CB 3.61Å; I160-Q171 HydrophobicContact CG2-CG 3.76Å; I160-P173 HydrophobicContact CD1-CB 3.49Å; I160-P173 VanDerWaalsContact CD1-CB 3.49Å |
| 161 | E | 91.6 | Very high | 87.6 | Confident | 126 Ų | 126 | 67.2 Ų | 67.2 | 59% | 0.589 | 38% | 0.383 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -93.8 | 133.6 | 170.1 | -64.4 | -174.9 | 173.4 | 0 | 0 | 109.7 | Q171 L172 | E161-Q171 CarbonylContact O-C 3.6Å; E161-Q171 WeakPolarHBondContact O-CA 3.27Å; E161-L172 PolarHBondContact N-O 2.85Å; E161-L172 PolarHBondContact O-N 3.4Å |
| 162 | N | 91.2 | Very high | 87.5 | Confident | 109 Ų | 109 | 69.7 Ų | 69.7 | 58% | 0.583 | 39% | 0.392 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -94.8 | 124.3 | 175.9 | -58.4 | -78.6 | 0 | 0 | 0 | 108.6 | A170 Q171 | N162-A170 CarbonylContact C-O 3.59Å; N162-A170 WeakPolarHBondContact CA-O 3.18Å; N162-Q171 VanDerWaalsContact OD1-CG 3.28Å; N162-Q171 WeakPolarHBondContact OD1-CG 3.3Å; N162-Q171 PolarHBondContact OD1-NE2 2.69Å |
| 163 | Y | 86.4 | Confident | 87.6 | Confident | 158 Ų | 158 | 71.4 Ų | 71.4 | 62% | 0.62 | 40% | 0.403 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -110 | 129.3 | 173.1 | -166.8 | -95 | 0 | 0 | 0 | 109.7 | K169 A170 | Y163-K169 CarbonylContact O-C 3.42Å; Y163-K169 WeakPolarHBondContact O-CA 3.35Å; Y163-A170 PolarHBondContact N-O 2.85Å; Y163-A170 PolarHBondContact O-N 2.83Å |
| 164 | E | 86.4 | Confident | 87.6 | Confident | 110 Ų | 110 | 75.2 Ų | 75.2 | 51% | 0.514 | 42% | 0.422 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114 | 131.5 | -179.4 | -173.3 | 170.4 | -178.9 | 0 | 0 | 110.5 | S168 K169 | E164-S168 VanDerWaalsContact CA-O 3.3Å; E164-S168 WeakPolarHBondContact CA-O 3.38Å; E164-K169 HydrophobicContact CB-CG 4.13Å; E164-K169 HydrophobicContact CG-CG 3.97Å; E164-K169 WeakPolarHBondContact OE2-CE 3.48Å; E164-K169 IonicContact OE2-NZ 3.52Å |
| 165 | S | 78.6 | Confident | 87.7 | Confident | 84 Ų | 84 | 76.2 Ų | 76.2 | 59% | 0.587 | 43% | 0.429 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -147.5 | 130.3 | 172.3 | -172.9 | 0 | 0 | 0 | 0 | 109.7 | G167 S168 | S165-G167 VanDerWaalsContact C-N 3.25Å; S165-G167 PolarHBondContact O-N 2.83Å; S165-S168 PolarHBondContact N-O 2.82Å; S165-S168 WeakPolarHBondContact O-CB 3.14Å; S165-S168 PolarHBondContact O-N 3.39Å |
| 166 | G | 75.8 | Confident | 87.7 | Confident | 86 Ų | 86 | 80.1 Ų | 80.1 | 89% | 0.887 | 45% | 0.448 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 61.8 | 25.8 | 177 | 0 | 0 | 0 | 0 | 0 | 115.3 | S168 | G166-S168 VanDerWaalsContact C-N 3.28Š|
| 167 | G | 74.9 | Confident | 87.7 | Confident | 63 Ų | 63 | 83.9 Ų | 83.9 | 65% | 0.649 | 47% | 0.468 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 82.8 | -0.6 | -175.2 | 0 | 0 | 0 | 0 | 0 | 114.7 | S165 | S165-G167 VanDerWaalsContact C-N 3.25Å; S165-G167 PolarHBondContact O-N 2.83Å |
| 168 | S | 80.8 | Confident | 87.7 | Confident | 34 Ų | 34 | 79 Ų | 79 | 24% | 0.238 | 45% | 0.447 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.8 | 137.4 | 175.1 | -71.6 | 0 | 0 | 0 | 0 | 110.9 | V108 E164 S165 G166 | V108-S168 WeakPolarHBondContact CG1-OG 3.36Å; E164-S168 VanDerWaalsContact CA-O 3.3Å; E164-S168 WeakPolarHBondContact CA-O 3.38Å; S165-S168 PolarHBondContact N-O 2.82Å; S165-S168 WeakPolarHBondContact O-CB 3.14Å; S165-S168 PolarHBondContact O-N 3.39Å; G166-S168 VanDerWaalsContact C-N 3.28Å |
| 169 | K | 84.2 | Confident | 87.6 | Confident | 119 Ų | 119 | 81.7 Ų | 81.7 | 52% | 0.517 | 46% | 0.463 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.7 | 121.2 | 178.6 | -64.8 | -175.9 | 177.1 | -171.4 | 0 | 110.6 | V108 Y163 E164 | V108-K169 WeakPolarHBondContact CG2-O 3.4Å; Y163-K169 CarbonylContact O-C 3.42Å; Y163-K169 WeakPolarHBondContact O-CA 3.35Å; E164-K169 HydrophobicContact CB-CG 4.13Å; E164-K169 HydrophobicContact CG-CG 3.97Å; E164-K169 WeakPolarHBondContact OE2-CE 3.48Å; E164-K169 IonicContact OE2-NZ 3.52Å |
| 170 | A | 87.9 | Confident | 87.3 | Confident | 21 Ų | 21 | 78.8 Ų | 78.8 | 17% | 0.174 | 44% | 0.444 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -105 | 153.8 | 169 | 0 | 0 | 0 | 0 | 0 | 110 | N162 Y163 L172 | N162-A170 CarbonylContact C-O 3.59Å; N162-A170 WeakPolarHBondContact CA-O 3.18Å; Y163-A170 PolarHBondContact N-O 2.85Å; Y163-A170 PolarHBondContact O-N 2.83Å; A170-L172 HydrophobicContact CB-CD1 4.18Å |
| 171 | Q | 93.2 | Very high | 87.2 | Confident | 55 Ų | 55 | 81.6 Ų | 81.6 | 26% | 0.257 | 46% | 0.459 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.9 | 123.5 | 178.6 | -75.3 | -177 | -34.1 | 0 | 0 | 109 | Y104 I105 I160 E161 N162 P173 | Y104-Q171 HydrophobicContact CD2-CB 4.13Å; Y104-Q171 WeakPolarHBondContact CD2-O 3.26Å; Y104-Q171 WeakPolarHBondContact CE2-O 2.83Å; I105-Q171 WeakPolarHBondContact O-CB 3.47Å; I105-Q171 PolarHBondContact O-N 2.89Å; I160-Q171 HydrophobicContact CG2-CB 3.61Å; I160-Q171 HydrophobicContact CG2-CG 3.76Å; E161-Q171 CarbonylContact O-C 3.6Å; E161-Q171 WeakPolarHBondContact O-CA 3.27Å; N162-Q171 VanDerWaalsContact OD1-CG 3.28Å; N162-Q171 WeakPolarHBondContact OD1-CG 3.3Å; N162-Q171 PolarHBondContact OD1-NE2 2.69Å; Q171-P173 WeakPolarHBondContact O-CD 3.36Å |
| 172 | L | 90.9 | Very high | 87.1 | Confident | 95 Ų | 95 | 79.6 Ų | 79.6 | 50% | 0.497 | 45% | 0.45 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.9 | 102.7 | 179.9 | -82 | 67.6 | 0 | 0 | 0 | 108.1 | E161 A170 | E161-L172 PolarHBondContact N-O 2.85Å; E161-L172 PolarHBondContact O-N 3.4Å; A170-L172 HydrophobicContact CB-CD1 4.18Å |
| 173 | P | 93.7 | Very high | 87.1 | Confident | 36 Ų | 36 | 77.7 Ų | 77.7 | 23% | 0.234 | 44% | 0.442 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -72.9 | 133.5 | 174.7 | 28.2 | -32.9 | 0 | 0 | 0 | 111.2 | Y104 I127 P158 I160 Q171 | Y104-P173 HydrophobicContact CD1-CG 4.1Å; Y104-P173 HydrophobicContact CD2-CG 4.17Å; Y104-P173 HydrophobicContact CE1-CG 3.84Å; Y104-P173 HydrophobicContact CE2-CG 3.91Å; Y104-P173 HydrophobicContact CG-CG 4.25Å; I127-P173 HydrophobicContact CD1-CB 3.64Å; I127-P173 HydrophobicContact CD1-CG 3.88Å; I127-P173 HydrophobicContact CG2-CB 4.44Å; P158-P173 HydrophobicContact CB-CB 4.19Å; I160-P173 HydrophobicContact CD1-CB 3.49Å; I160-P173 VanDerWaalsContact CD1-CB 3.49Å; Q171-P173 WeakPolarHBondContact O-CD 3.36Å |
| 174 | N | 93 | Very high | 87.4 | Confident | 95 Ų | 95 | 71 Ų | 71 | 51% | 0.508 | 42% | 0.417 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.4 | 133.2 | 166.4 | -170 | -41.9 | 0 | 0 | 0 | 109.4 | P158 V159 | P158-N174 CarbonylContact C-O 3.58Å; P158-N174 WeakPolarHBondContact CA-O 3.07Å; V159-N174 PolarHBondContact N-O 3.43Å; V159-N174 PolarHBondContact O-N 2.85Å |
| 175 | V | 91.9 | Very high | 87.7 | Confident | 40 Ų | 40 | 70 Ų | 70 | 24% | 0.242 | 42% | 0.416 | C | S | . | . | trans | -137.1 | 125.7 | -177 | 175.8 | 0 | 0 | 0 | 0 | 109.8 | I127 T129 P158 | I127-V175 HydrophobicContact CD1-CG2 3.46Å; I127-V175 VanDerWaalsContact CD1-CG2 3.46Å; I127-V175 HydrophobicContact CG1-CG2 4.42Å; T129-V175 HydrophobicContact CG2-CB 4.46Å; T129-V175 HydrophobicContact CG2-CG1 3.87Å; T129-V175 HydrophobicContact CG2-CG2 3.66Å; P158-V175 HydrophobicContact CB-CG2 3.59Å | ||
| 176 | D | 90 | Very high | 88.3 | Confident | 103 Ų | 103 | 66 Ų | 66 | 55% | 0.551 | 39% | 0.388 | S | S | * | . | trans | -78 | 129.9 | 167.4 | -73.4 | -35.1 | 0 | 0 | 0 | 110.4 | S155 D156 | S155-D176 VanDerWaalsContact CA-O 3.3Å; S155-D176 WeakPolarHBondContact CA-O 3.26Å; D156-D176 HydrophobicContact CB-CB 4.43Å; D156-D176 PolarHBondContact N-O 2.88Å | ||
| 177 | L | 88.1 | Confident | 89.2 | Confident | 106 Ų | 106 | 67.8 Ų | 67.8 | 56% | 0.555 | 37% | 0.371 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -117.8 | 130.5 | 178.8 | -176.8 | 73.6 | 0 | 0 | 0 | 110.1 | S155 | S155-L177 WeakPolarHBondContact OG-CD1 3.4Å |
| 178 | K | 87.4 | Confident | 90 | Very high | 71 Ų | 71 | 66.5 Ų | 66.5 | 31% | 0.309 | 35% | 0.352 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.1 | 133.9 | 172.2 | -58.3 | 168.7 | -159.9 | -96.2 | 0 | 108 | S153 L154 F197 Q198 | S153-K178 CarbonylContact C-O 3.59Å; S153-K178 WeakPolarHBondContact CA-O 3.34Å; S153-K178 VanDerWaalsContact CB-O 3.26Å; S153-K178 WeakPolarHBondContact CB-O 3.5Å; L154-K178 PolarHBondContact N-O 2.77Å; L154-K178 PolarHBondContact O-N 2.63Å; K178-F197 HydrophobicContact CB-CD1 3.5Å; K178-F197 HydrophobicContact CB-CE1 3.68Å; K178-F197 HydrophobicContact CD-CD1 4.13Å; K178-F197 HydrophobicContact CG-CD1 4.46Å; K178-F197 WeakPolarHBondContact O-CE1 3.39Å; K178-Q198 VanDerWaalsContact CE-O 3.29Å; K178-Q198 WeakPolarHBondContact CE-O 3.4Å; K178-Q198 PolarHBondContact NZ-O 2.8Å |
| 179 | T | 89.5 | Confident | 90.6 | Very high | 71 Ų | 71 | 65.7 Ų | 65.7 | 44% | 0.436 | 35% | 0.35 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.5 | 136.5 | -177.5 | -56 | 0 | 0 | 0 | 0 | 110.8 | M152 S153 | M152-T179 CarbonylContact O-C 3.59Å; M152-T179 WeakPolarHBondContact O-CA 3.29Å; S153-T179 WeakPolarHBondContact CB-OG1 3.26Å |
| 180 | I | 86.6 | Confident | 90.9 | Very high | 33 Ų | 33 | 61.1 Ų | 61.1 | 17% | 0.169 | 33% | 0.33 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.9 | 126.6 | 174.8 | -56.8 | 174.9 | 0 | 0 | 0 | 108.4 | Y150 M152 Q182 F197 | Y150-I180 HydrophobicContact CE2-CG2 4.14Å; M152-I180 HydrophobicContact CG-CB 3.85Å; M152-I180 WeakPolarHBondContact CG-O 3.36Å; M152-I180 PolarHBondContact N-O 2.79Å; M152-I180 PolarHBondContact O-N 2.85Å; M152-I180 HydrophobicContact SD-CB 4.27Å; I180-Q182 HydrophobicContact CG2-CG 4.28Å; I180-F197 HydrophobicContact CB-CZ 4.14Å; I180-F197 HydrophobicContact CD1-CD1 4.39Å; I180-F197 HydrophobicContact CD1-CD2 4.22Å; I180-F197 HydrophobicContact CD1-CE1 3.92Å; I180-F197 HydrophobicContact CD1-CE2 3.74Å; I180-F197 HydrophobicContact CD1-CZ 3.57Å; I180-F197 HydrophobicContact CG1-CE1 3.89Å; I180-F197 HydrophobicContact CG1-CE2 4.33Å; I180-F197 HydrophobicContact CG1-CZ 3.67Å |
| 181 | N | 89.7 | Confident | 91 | Very high | 99 Ų | 99 | 60.1 Ų | 60.1 | 53% | 0.529 | 32% | 0.322 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.5 | 118.9 | 176 | -58.9 | -64.3 | 0 | 0 | 0 | 108.9 | Y150 S151 | Y150-N181 WeakPolarHBondContact O-CA 3.09Å; S151-N181 WeakPolarHBondContact CA-OD1 3.33Å; S151-N181 WeakPolarHBondContact CB-OD1 3.39Å; S151-N181 PolarHBondContact OG-OD1 2.72Å |
| 182 | Q | 88.5 | Confident | 90.9 | Very high | 84 Ų | 84 | 57.5 Ų | 57.5 | 39% | 0.393 | 31% | 0.31 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -153.6 | 165.8 | -178.8 | -71.6 | -173.7 | 77.6 | 0 | 0 | 110.7 | V55 Y150 I180 | V55-Q182 VanDerWaalsContact CG2-NE2 3.32Å; Y150-Q182 WeakPolarHBondContact CD1-O 3.41Å; Y150-Q182 HydrophobicContact CE1-CB 3.95Å; Y150-Q182 HydrophobicContact CE2-CB 3.74Å; Y150-Q182 HydrophobicContact CE2-CG 4.49Å; Y150-Q182 VanDerWaalsContact CZ-CB 3.41Å; Y150-Q182 PolarHBondContact N-O 3.08Å; Y150-Q182 PolarHBondContact O-N 3.14Å; Y150-Q182 VanDerWaalsContact O-N 3.08Å; Y150-Q182 VanDerWaalsContact OH-CB 3.29Å; Y150-Q182 WeakPolarHBondContact OH-CB 3.4Å; Y150-Q182 PolarHBondContact OH-NE2 3.28Å; I180-Q182 HydrophobicContact CG2-CG 4.28Å |
| 183 | T | 92.3 | Very high | 90.8 | Very high | 69 Ų | 69 | 53.1 Ų | 53.1 | 42% | 0.423 | 29% | 0.287 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.7 | 135.8 | 178.1 | -56.7 | 0 | 0 | 0 | 0 | 108.8 | Q147 L148 L149 | Q147-T183 HydrophobicContact CG-CG2 3.21Å; L148-T183 WeakPolarHBondContact O-CA 3.35Å; L149-T183 WeakPolarHBondContact CD1-OG1 3.47Å |
| 184 | V | 91.4 | Very high | 90.5 | Very high | 16 Ų | 16 | 51.5 Ų | 51.5 | 10% | 0.097 | 28% | 0.276 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.5 | 144.7 | 178.1 | -67.5 | 0 | 0 | 0 | 0 | 111 | V55 Q147 L148 Y150 L186 V192 | V55-V184 HydrophobicContact CG1-CG1 3.85Å; Q147-V184 CarbonylContact C-O 3.54Å; Q147-V184 WeakPolarHBondContact CA-O 3.47Å; L148-V184 HydrophobicContact CB-CG2 4.13Å; L148-V184 PolarHBondContact N-O 2.84Å; L148-V184 PolarHBondContact O-N 3.33Å; Y150-V184 HydrophobicContact CD1-CG2 4.36Å; Y150-V184 HydrophobicContact CE1-CG1 3.99Å; Y150-V184 HydrophobicContact CE1-CG2 3.98Å; V184-L186 HydrophobicContact CG2-CD1 3.87Å; V184-L186 HydrophobicContact CG2-CG 4.02Å; V184-V192 HydrophobicContact CG1-CG2 4.41Å; V184-V192 HydrophobicContact CG2-CB 4.45Å; V184-V192 HydrophobicContact CG2-CG1 4.42Å; V184-V192 HydrophobicContact CG2-CG2 4.23Å |
| 185 | D | 93 | Very high | 89.9 | Confident | 90 Ų | 90 | 47.3 Ų | 47.3 | 48% | 0.481 | 25% | 0.254 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.1 | 128.4 | 171.2 | -64.7 | -29 | 0 | 0 | 0 | 109.6 | I57 L146 Q147 | I57-D185 WeakPolarHBondContact CD1-O 3.49Å; L146-D185 WeakPolarHBondContact O-CA 3Å; Q147-D185 VanDerWaalsContact CB-OD1 3.27Å; Q147-D185 WeakPolarHBondContact CB-OD1 3.38Å; Q147-D185 VanDerWaalsContact CG-OD1 3.29Å; Q147-D185 WeakPolarHBondContact CG-OD1 3.18Å; Q147-D185 PolarHBondContact NE2-OD1 2.83Å |
| 186 | L | 92.6 | Very high | 88.9 | Confident | 0 Ų | 0 | 46.8 Ų | 46.8 | 0% | 0 | 26% | 0.257 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.1 | 134.5 | -175 | -65.3 | 168.6 | 0 | 0 | 0 | 110.5 | I57 T145 L146 L148 V184 Q190 V192 P236 | I57-L186 HydrophobicContact CB-CD2 4.29Å; I57-L186 HydrophobicContact CD1-CD2 3.78Å; I57-L186 HydrophobicContact CG1-CD2 3.8Å; I57-L186 HydrophobicContact CG2-CD2 3.58Å; T145-L186 CarbonylContact C-O 3.48Å; T145-L186 WeakPolarHBondContact CA-O 3.3Å; T145-L186 WeakPolarHBondContact CG2-O 3.11Å; L146-L186 PolarHBondContact N-O 2.79Å; L146-L186 PolarHBondContact O-N 2.82Å; L148-L186 HydrophobicContact CB-CD1 4.27Å; L148-L186 HydrophobicContact CD2-CD1 4.05Å; V184-L186 HydrophobicContact CG2-CD1 3.87Å; V184-L186 HydrophobicContact CG2-CG 4.02Å; L186-Q190 HydrophobicContact CD2-CB 4.26Å; L186-V192 HydrophobicContact CD1-CB 3.97Å; L186-V192 HydrophobicContact CD1-CG1 3.76Å; L186-V192 HydrophobicContact CD2-CB 3.93Å; L186-P236 HydrophobicContact CB-CG 4.04Å; L186-P236 HydrophobicContact CD1-CG 3.93Å |
| 187 | K | 92.9 | Very high | 88 | Confident | 123 Ų | 123 | 42 Ų | 42 | 54% | 0.535 | 23% | 0.232 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -75.2 | 152.7 | 162.8 | -60.4 | -179.7 | -179 | 179.3 | 0 | 109.9 | Q144 G189 Q190 | Q144-K187 CarbonylContact O-C 3.57Å; Q144-K187 WeakPolarHBondContact O-CA 3.39Å; K187-G189 PolarHBondContact O-N 2.8Å; K187-Q190 HydrophobicContact CB-CG 3.97Å; K187-Q190 WeakPolarHBondContact O-CB 3.26Å; K187-Q190 PolarHBondContact O-N 3.28Å |
| 188 | S | 93.7 | Very high | 87.1 | Confident | 36 Ų | 36 | 39 Ų | 39 | 25% | 0.252 | 22% | 0.215 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -53.2 | 128.3 | 172.7 | -166.8 | 0 | 0 | 0 | 0 | 110.1 | Q144 Q190 I238 | Q144-S188 PolarHBondContact O-N 3.49Å; S188-Q190 VanDerWaalsContact C-N 3.3Å; S188-Q190 PolarHBondContact O-N 3.04Å; S188-I238 PolarHBondContact OG-N 3.14Å |
| 189 | G | 91.3 | Very high | 86.2 | Confident | 18 Ų | 18 | 39.7 Ų | 39.7 | 19% | 0.186 | 22% | 0.219 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 82.1 | -6.8 | -177.5 | 0 | 0 | 0 | 0 | 0 | 115.5 | G60 K187 P236 | G60-G189 CarbonylContact C-O 3.54Å; G60-G189 WeakPolarHBondContact CA-O 3.2Å; G60-G189 PolarHBondContact N-O 2.89Å; K187-G189 PolarHBondContact O-N 2.8Å; G189-P236 PolarHBondContact N-O 2.86Å |
| 190 | Q | 91.1 | Very high | 85.2 | Confident | 23 Ų | 23 | 40.2 Ų | 40.2 | 11% | 0.107 | 23% | 0.226 | C | C | . | . | P | Polyproline II helix | trans | -72.2 | 143.1 | 168.7 | -72.3 | -176.1 | -36.6 | 0 | 0 | 110.1 | I57 V58 N59 L186 K187 S188 P236 | I57-Q190 HydrophobicContact CG2-CB 4.05Å; I57-Q190 HydrophobicContact CG2-CG 4.4Å; V58-Q190 WeakPolarHBondContact O-CA 3.11Å; N59-Q190 PolarHBondContact OD1-NE2 2.98Å; L186-Q190 HydrophobicContact CD2-CB 4.26Å; K187-Q190 HydrophobicContact CB-CG 3.97Å; K187-Q190 WeakPolarHBondContact O-CB 3.26Å; K187-Q190 PolarHBondContact O-N 3.28Å; S188-Q190 VanDerWaalsContact C-N 3.3Å; S188-Q190 PolarHBondContact O-N 3.04Å; Q190-P236 WeakPolarHBondContact O-CD 3.46Å |
| 191 | T | 90.8 | Very high | 84.1 | Confident | 0 Ų | 0 | 40.2 Ų | 40.2 | 0% | 0 | 23% | 0.234 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -102.7 | 125.9 | 173.8 | -49.9 | 0 | 0 | 0 | 0 | 109.4 | I57 V58 G60 L62 L233 I234 T235 | I57-T191 WeakPolarHBondContact CA-O 3.27Å; V58-T191 PolarHBondContact N-O 3.33Å; V58-T191 PolarHBondContact O-N 3.45Å; G60-T191 PolarHBondContact O-N 3.31Å; G60-T191 PolarHBondContact O-OG1 2.81Å; L62-T191 HydrophobicContact CB-CG2 3.99Å; L62-T191 HydrophobicContact CD1-CG2 4.42Å; L62-T191 HydrophobicContact CG-CG2 4.5Å; L62-T191 PolarHBondContact N-OG1 2.91Å; T191-L233 HydrophobicContact CG2-CB 4.04Å; T191-I234 WeakPolarHBondContact CA-O 3.33Å; T191-T235 WeakPolarHBondContact CG2-OG1 3.49Å; T191-T235 PolarHBondContact OG1-OG1 2.83Å |
| 192 | V | 91.1 | Very high | 82.6 | Confident | 0 Ų | 0 | 45 Ų | 45 | 0% | 0 | 24% | 0.244 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -87.3 | 134.9 | 162.2 | 63.3 | 0 | 0 | 0 | 0 | 109.5 | V55 S56 I57 V184 L186 I194 L233 I234 | V55-V192 HydrophobicContact CG1-CG2 3.49Å; V55-V192 VanDerWaalsContact CG1-CG2 3.49Å; S56-V192 CarbonylContact O-C 3.54Å; S56-V192 WeakPolarHBondContact O-CA 3.39Å; I57-V192 HydrophobicContact CG1-CG2 4.39Å; V184-V192 HydrophobicContact CG1-CG2 4.41Å; V184-V192 HydrophobicContact CG2-CB 4.45Å; V184-V192 HydrophobicContact CG2-CG1 4.42Å; V184-V192 HydrophobicContact CG2-CG2 4.23Å; L186-V192 HydrophobicContact CD1-CB 3.97Å; L186-V192 HydrophobicContact CD1-CG1 3.76Å; L186-V192 HydrophobicContact CD2-CB 3.93Å; V192-I194 HydrophobicContact CG1-CD1 4.31Å; V192-I194 HydrophobicContact CG2-CD1 4.37Å; V192-I194 HydrophobicContact CG2-CG1 3.94Å; V192-L233 CarbonylContact O-C 3.55Å; V192-L233 WeakPolarHBondContact O-CA 3.19Å; V192-I234 HydrophobicContact CG1-CB 3.66Å; V192-I234 HydrophobicContact CG1-CD1 4.22Å; V192-I234 HydrophobicContact CG1-CG1 4.25Å; V192-I234 PolarHBondContact N-O 2.79Å; V192-I234 PolarHBondContact O-N 2.87Å |
| 193 | I | 89 | Confident | 81.1 | Confident | 2 Ų | 2 | 49.9 Ų | 49.9 | 1% | 0.01 | 26% | 0.259 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -111 | 123.5 | 176.6 | -49.2 | 179 | 0 | 0 | 0 | 106.6 | W26 F30 V55 S56 V58 L62 F68 V231 L233 | W26-I193 HydrophobicContact CH2-CG2 3.62Å; W26-I193 HydrophobicContact CZ2-CG2 4.14Å; W26-I193 HydrophobicContact CZ3-CG2 4.06Å; F30-I193 HydrophobicContact CE1-CD1 4.27Å; F30-I193 HydrophobicContact CE2-CD1 4.28Å; F30-I193 HydrophobicContact CZ-CD1 3.43Å; F30-I193 VanDerWaalsContact CZ-CD1 3.43Å; V55-I193 CarbonylContact C-O 3.48Å; V55-I193 VanDerWaalsContact CA-O 3.29Å; V55-I193 WeakPolarHBondContact CA-O 3.42Å; S56-I193 PolarHBondContact N-O 2.81Å; S56-I193 PolarHBondContact O-N 3.3Å; V58-I193 HydrophobicContact CG2-CD1 3.82Å; L62-I193 HydrophobicContact CD1-CD1 3.38Å; L62-I193 HydrophobicContact CD1-CG1 3.87Å; F68-I193 HydrophobicContact CZ-CD1 4.15Å; I193-V231 HydrophobicContact CG2-CG1 3.79Å; I193-L233 HydrophobicContact CB-CD2 4.08Å; I193-L233 HydrophobicContact CD1-CD2 4.46Å; I193-L233 HydrophobicContact CG1-CD2 3.77Å; I193-L233 HydrophobicContact CG2-CD2 3.81Å |
| 194 | I | 87.1 | Confident | 79.5 | Confident | 2 Ų | 2 | 50.3 Ų | 50.3 | 1% | 0.01 | 27% | 0.265 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.3 | 123.7 | -178.2 | -55.6 | 159.8 | 0 | 0 | 0 | 107.1 | V55 Y150 M152 V192 V231 V232 I234 | V55-I194 HydrophobicContact CG1-CG1 4.39Å; Y150-I194 HydrophobicContact CD1-CD1 4.11Å; Y150-I194 HydrophobicContact CD2-CD1 3.98Å; Y150-I194 HydrophobicContact CE1-CD1 3.76Å; Y150-I194 HydrophobicContact CE1-CG1 4.5Å; Y150-I194 HydrophobicContact CE2-CD1 3.6Å; Y150-I194 HydrophobicContact CE2-CG1 4.31Å; Y150-I194 HydrophobicContact CE2-CG2 4.27Å; Y150-I194 HydrophobicContact CG-CD1 4.19Å; Y150-I194 VanDerWaalsContact CZ-CD1 3.46Å; M152-I194 HydrophobicContact CE-CB 4.46Å; M152-I194 HydrophobicContact CE-CD1 3.66Å; M152-I194 HydrophobicContact CE-CG2 4.18Å; M152-I194 HydrophobicContact SD-CG2 3.9Å; V192-I194 HydrophobicContact CG1-CD1 4.31Å; V192-I194 HydrophobicContact CG2-CD1 4.37Å; V192-I194 HydrophobicContact CG2-CG1 3.94Å; I194-V231 CarbonylContact O-C 3.13Å; I194-V231 WeakPolarHBondContact O-CA 3.42Å; I194-V232 HydrophobicContact CB-CB 4.38Å; I194-V232 PolarHBondContact N-O 3.02Å; I194-V232 PolarHBondContact O-N 2.93Å; I194-I234 HydrophobicContact CD1-CD1 3.82Å |
| 195 | S | 80.1 | Confident | 78.2 | Confident | 7 Ų | 7 | 51.4 Ų | 51.4 | 5% | 0.049 | 28% | 0.28 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -127 | 152.6 | 173.3 | 59.2 | 0 | 0 | 0 | 0 | 109.1 | G53 G54 | G53-S195 CarbonylContact C-O 3.54Å; G53-S195 WeakPolarHBondContact CA-O 3.47Å; G54-S195 PolarHBondContact N-O 3.18Å; G54-S195 PolarHBondContact N-OG 3.15Å; G54-S195 PolarHBondContact O-N 3.19Å; G54-S195 PolarHBondContact O-OG 3.28Å |
| 196 | G | 71.7 | Confident | 77.2 | Confident | 30 Ų | 30 | 54.2 Ų | 54.2 | 31% | 0.309 | 29% | 0.288 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | 157.7 | -12.7 | 178.6 | 0 | 0 | 0 | 0 | 0 | 115.1 | T52 Q198 | T52-G196 WeakPolarHBondContact O-CA 3.36Å; G196-Q198 PolarHBondContact O-N 3.44Å |
| 197 | F | 70 | Confident | 76.1 | Confident | 3 Ų | 3 | 60.6 Ų | 60.6 | 1% | 0.013 | 32% | 0.317 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.3 | 105 | 172.3 | -55.5 | -71.4 | 0 | 0 | 0 | 109.4 | F131 M152 L154 K178 I180 I229 L230 | F131-F197 HydrophobicContact CE2-CE2 4.44Å; M152-F197 HydrophobicContact CB-CE2 4.42Å; M152-F197 HydrophobicContact CB-CZ 4.25Å; M152-F197 HydrophobicContact CG-CE2 3.92Å; M152-F197 HydrophobicContact CG-CZ 3.77Å; M152-F197 HydrophobicContact SD-CE2 3.47Å; M152-F197 WeakPolarHBondContact SD-CE2 3.43Å; M152-F197 HydrophobicContact SD-CZ 3.94Å; L154-F197 HydrophobicContact CB-CD1 3.89Å; L154-F197 HydrophobicContact CB-CE1 4.16Å; L154-F197 HydrophobicContact CB-CG 4.25Å; L154-F197 HydrophobicContact CD2-CB 3.85Å; L154-F197 HydrophobicContact CD2-CD1 4.44Å; L154-F197 HydrophobicContact CD2-CG 4.26Å; K178-F197 HydrophobicContact CB-CD1 3.5Å; K178-F197 HydrophobicContact CB-CE1 3.68Å; K178-F197 HydrophobicContact CD-CD1 4.13Å; K178-F197 HydrophobicContact CG-CD1 4.46Å; K178-F197 WeakPolarHBondContact O-CE1 3.39Å; I180-F197 HydrophobicContact CB-CZ 4.14Å; I180-F197 HydrophobicContact CD1-CD1 4.39Å; I180-F197 HydrophobicContact CD1-CD2 4.22Å; I180-F197 HydrophobicContact CD1-CE1 3.92Å; I180-F197 HydrophobicContact CD1-CE2 3.74Å; I180-F197 HydrophobicContact CD1-CZ 3.57Å; I180-F197 HydrophobicContact CG1-CE1 3.89Å; I180-F197 HydrophobicContact CG1-CE2 4.33Å; I180-F197 HydrophobicContact CG1-CZ 3.67Å; F197-I229 CarbonylContact O-C 3.48Å; F197-I229 WeakPolarHBondContact O-CA 3.48Å; F197-L230 HydrophobicContact CB-CB 4.11Å; F197-L230 HydrophobicContact CB-CD1 4.4Å; F197-L230 HydrophobicContact CB-CG 4.39Å; F197-L230 HydrophobicContact CD2-CB 4.48Å; F197-L230 PolarHBondContact O-N 2.86Å |
| 198 | Q | 69.8 | Low | 74.6 | Confident | 43 Ų | 43 | 56.1 Ų | 56.1 | 20% | 0.201 | 31% | 0.306 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.3 | 131.3 | 169 | -176.2 | 177.3 | -58.2 | 0 | 0 | 109.5 | K178 G196 T228 I229 | K178-Q198 VanDerWaalsContact CE-O 3.29Å; K178-Q198 WeakPolarHBondContact CE-O 3.4Å; K178-Q198 PolarHBondContact NZ-O 2.8Å; G196-Q198 PolarHBondContact O-N 3.44Å; Q198-T228 CarbonylContact C-O 3.57Å; Q198-T228 WeakPolarHBondContact CA-O 2.97Å; Q198-I229 HydrophobicContact CG-CG1 4.25Å |
| 199 | Q | 67.6 | Low | 73.4 | Confident | 84 Ų | 84 | 59.3 Ų | 59.3 | 39% | 0.393 | 32% | 0.324 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -113 | 122.3 | 168.3 | -171.2 | 177.9 | 8.5 | 0 | 0 | 108.1 | D156 T228 | D156-Q199 PolarHBondContact OD1-NE2 3.02Å; D156-Q199 PolarHBondContact OD2-NE2 2.87Å; Q199-T228 PolarHBondContact N-O 3.4Å; Q199-T228 PolarHBondContact O-N 3.08Å |
| 200 | S | 68.8 | Low | 72.5 | Confident | 83 Ų | 83 | 62.1 Ų | 62.1 | 58% | 0.58 | 35% | 0.353 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -101.8 | 125.1 | 178.4 | 59.1 | 0 | 0 | 0 | 0 | 110.4 | D227 | S200-D227 VanDerWaalsContact CA-OD1 3.26Å; S200-D227 WeakPolarHBondContact CA-OD1 3.33Å; S200-D227 WeakPolarHBondContact CB-OD1 3.46Å |
| 201 | G | 63.3 | Low | 71.5 | Confident | 33 Ų | 33 | 65.4 Ų | 65.4 | 34% | 0.34 | 38% | 0.375 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.4 | 114.6 | 172.6 | 0 | 0 | 0 | 0 | 0 | 110.5 | D226 | G201-D226 PolarHBondContact N-O 2.83Å; G201-D226 PolarHBondContact O-N 3.26Å |
| 202 | R | 58.3 | Low | 70.3 | Confident | 198 Ų | 198 | 67.5 Ų | 67.5 | 75% | 0.747 | 39% | 0.389 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -101.4 | 118.4 | 173.5 | -170.4 | 177.6 | -65.5 | 137.1 | 0.5 | 110 | ||
| 203 | R | 58.4 | Low | 69.4 | Low | 188 Ų | 188 | 70.3 Ų | 70.3 | 71% | 0.709 | 42% | 0.418 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -110.4 | 118.8 | 169.9 | -67.5 | -179.3 | 179.6 | 169.6 | 1.4 | 108.5 | S223 E224 | R203-S223 CarbonylContact O-C 3.58Å; R203-S223 WeakPolarHBondContact O-CA 3.43Å; R203-E224 HydrophobicContact CB-CB 4.45Å; R203-E224 PolarHBondContact N-O 2.82Å; R203-E224 PolarHBondContact O-N 2.91Å; R203-E224 VanDerWaalsContact O-O 3.14Å |
| 204 | S | 57.3 | Low | 68.9 | Low | 78 Ų | 78 | 75.8 Ų | 75.8 | 55% | 0.545 | 44% | 0.441 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.5 | 117.1 | 174 | -172.5 | 0 | 0 | 0 | 0 | 109.5 | ||
| 205 | G | 64.5 | Low | 68.2 | Low | 39 Ų | 39 | 82.5 Ų | 82.5 | 40% | 0.402 | 47% | 0.471 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.9 | 146.2 | 170.5 | 0 | 0 | 0 | 0 | 0 | 110.4 | N222 | G205-N222 PolarHBondContact N-O 2.85Å; G205-N222 PolarHBondContact O-N 3.35Å; G205-N222 VanDerWaalsContact O-O 3.13Å |
| 206 | K | 71.7 | Confident | 68 | Low | 149 Ų | 149 | 85.2 Ų | 85.2 | 65% | 0.648 | 50% | 0.5 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -115.5 | 129.3 | 172.1 | -58.1 | -174.7 | 179.2 | 176.6 | 0 | 108.1 | P212 I221 | K206-P212 HydrophobicContact CB-CB 3.58Å; K206-P212 HydrophobicContact CB-CG 3.96Å; K206-I221 HydrophobicContact CG-CG1 4.33Å |
| 207 | Q | 69.2 | Low | 68.5 | Low | 133 Ų | 133 | 88.7 Ų | 88.7 | 62% | 0.621 | 51% | 0.511 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -124.1 | 149.6 | 178 | -173.6 | 169.4 | 13.5 | 0 | 0 | 110 | P212 G219 G220 | Q207-P212 WeakPolarHBondContact O-CA 3.42Å; Q207-G219 CarbonylContact O-C 3.59Å; Q207-G219 VanDerWaalsContact O-CA 3.26Å; Q207-G219 WeakPolarHBondContact O-CA 3.28Å; Q207-G220 PolarHBondContact N-O 2.76Å; Q207-G220 PolarHBondContact O-N 3.45Å; Q207-G220 VanDerWaalsContact O-O 3.12Å |
| 208 | G | 61.4 | Low | 68.5 | Low | 30 Ų | 30 | 91.3 Ų | 91.3 | 31% | 0.309 | 54% | 0.539 | S | S | . | . | trans | 168.3 | 156 | 172 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 209 | V | 68.7 | Low | 68.9 | Low | 102 Ų | 102 | 89.7 Ų | 89.7 | 62% | 0.618 | 53% | 0.533 | S | S | * | . | S | Bend | trans | -80.9 | 122.8 | 170.2 | -176.5 | 0 | 0 | 0 | 0 | 108.5 | T211 L217 | V209-T211 PolarHBondContact O-N 3.45Å; V209-T211 VanDerWaalsContact O-N 3.1Å; V209-L217 HydrophobicContact CB-CB 4.13Å |
| 210 | G | 73.4 | Confident | 69.1 | Low | 78 Ų | 78 | 86.4 Ų | 86.4 | 80% | 0.804 | 52% | 0.522 | S | S | * | . | S | Bend | trans | 82 | -73.9 | -177.5 | 0 | 0 | 0 | 0 | 0 | 113 | ||
| 211 | T | 69.9 | Low | 69.3 | Low | 92 Ų | 92 | 87.3 Ų | 87.3 | 56% | 0.564 | 52% | 0.519 | S | S | * | . | trans | -134.2 | 129.2 | 178.4 | -52.6 | 0 | 0 | 0 | 0 | 110.3 | V209 G213 F214 | V209-T211 PolarHBondContact O-N 3.45Å; V209-T211 VanDerWaalsContact O-N 3.1Å; T211-G213 PolarHBondContact O-N 2.86Å; T211-F214 PolarHBondContact O-N 2.79Å | ||
| 212 | P | 65.4 | Low | 69.3 | Low | 44 Ų | 44 | 90.7 Ų | 90.7 | 29% | 0.286 | 53% | 0.53 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60.1 | -18.9 | -179 | -24.4 | 32.6 | 0 | 0 | 0 | 115.4 | K206 Q207 F214 G220 | K206-P212 HydrophobicContact CB-CB 3.58Å; K206-P212 HydrophobicContact CB-CG 3.96Å; Q207-P212 WeakPolarHBondContact O-CA 3.42Å; P212-F214 VanDerWaalsContact C-N 3.32Å; P212-G220 PolarHBondContact O-N 2.81Å |
| 213 | G | 72.6 | Confident | 69.6 | Low | 59 Ų | 59 | 84.8 Ų | 84.8 | 61% | 0.608 | 52% | 0.519 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.4 | -10.9 | 174.3 | 0 | 0 | 0 | 0 | 0 | 114.6 | T211 F215 | T211-G213 PolarHBondContact O-N 2.86Å; G213-F215 PolarHBondContact O-N 2.89Å |
| 214 | F | 76.8 | Confident | 69.9 | Low | 116 Ų | 116 | 80.4 Ų | 80.4 | 51% | 0.509 | 51% | 0.506 | S | S | . | . | trans | -91.7 | 86.6 | 179.5 | -166.6 | -96.8 | 0 | 0 | 0 | 111 | T211 P212 G216 L217 G219 | T211-F214 PolarHBondContact O-N 2.79Å; P212-F214 VanDerWaalsContact C-N 3.32Å; F214-G216 PolarHBondContact O-N 3.01Å; F214-G216 VanDerWaalsContact O-N 3.14Å; F214-L217 HydrophobicContact CD1-CB 3.79Å; F214-L217 HydrophobicContact CD1-CD1 4.16Å; F214-L217 HydrophobicContact CD1-CG 3.57Å; F214-L217 VanDerWaalsContact CD1-N 3.27Å; F214-L217 HydrophobicContact CE1-CB 4.18Å; F214-L217 HydrophobicContact CE1-CD1 4.34Å; F214-L217 HydrophobicContact CE1-CD2 4.34Å; F214-L217 HydrophobicContact CE1-CG 3.57Å; F214-L217 PolarHBondContact O-N 2.87Å; F214-G219 WeakPolarHBondContact O-CA 3.48Å; F214-G219 PolarHBondContact O-N 2.85Å; F214-G219 VanDerWaalsContact O-N 3.08Å | ||
| 215 | F | 72.4 | Confident | 70.5 | Confident | 144 Ų | 144 | 78 Ų | 78 | 63% | 0.632 | 49% | 0.488 | S | S | * | . | G | 310 helix | trans | -57.3 | -26.8 | 178.8 | -72.5 | -86.3 | 0 | 0 | 0 | 113.5 | G213 L217 G218 G219 | G213-F215 PolarHBondContact O-N 2.89Å; F215-L217 VanDerWaalsContact C-N 3.29Å; F215-L217 PolarHBondContact O-N 3.1Å; F215-G218 PolarHBondContact O-N 2.84Å; F215-G218 VanDerWaalsContact O-N 3.08Å; F215-G219 WeakPolarHBondContact CD1-O 3.22Å |
| 216 | G | 77.2 | Confident | 70.9 | Confident | 64 Ų | 64 | 78.3 Ų | 78.3 | 66% | 0.66 | 48% | 0.48 | S | S | * | . | G | 310 helix | trans | -65.6 | -22.4 | -178.8 | 0 | 0 | 0 | 0 | 0 | 115.6 | F214 | F214-G216 PolarHBondContact O-N 3.01Å; F214-G216 VanDerWaalsContact O-N 3.14Å |
| 217 | L | 80.8 | Confident | 71.3 | Confident | 103 Ų | 103 | 71.8 Ų | 71.8 | 54% | 0.539 | 45% | 0.452 | S | S | . | . | G | 310 helix | trans | -107.4 | 26.3 | 172.9 | -63.3 | -178.5 | 0 | 0 | 0 | 111.8 | V209 F214 F215 | V209-L217 HydrophobicContact CB-CB 4.13Å; F214-L217 HydrophobicContact CD1-CB 3.79Å; F214-L217 HydrophobicContact CD1-CD1 4.16Å; F214-L217 HydrophobicContact CD1-CG 3.57Å; F214-L217 VanDerWaalsContact CD1-N 3.27Å; F214-L217 HydrophobicContact CE1-CB 4.18Å; F214-L217 HydrophobicContact CE1-CD1 4.34Å; F214-L217 HydrophobicContact CE1-CD2 4.34Å; F214-L217 HydrophobicContact CE1-CG 3.57Å; F214-L217 PolarHBondContact O-N 2.87Å; F215-L217 VanDerWaalsContact C-N 3.29Å; F215-L217 PolarHBondContact O-N 3.1Å |
| 218 | G | 71.3 | Confident | 72 | Confident | 58 Ų | 58 | 67.1 Ų | 67.1 | 60% | 0.598 | 43% | 0.433 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 79.7 | 25.6 | -178.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | F215 | F215-G218 PolarHBondContact O-N 2.84Å; F215-G218 VanDerWaalsContact O-N 3.08Å |
| 219 | G | 77.3 | Confident | 73.2 | Confident | 8 Ų | 8 | 65.7 Ų | 65.7 | 8% | 0.082 | 42% | 0.418 | C | S | . | . | trans | -63.2 | 144.3 | 166.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q207 F214 F215 | Q207-G219 CarbonylContact O-C 3.59Å; Q207-G219 VanDerWaalsContact O-CA 3.26Å; Q207-G219 WeakPolarHBondContact O-CA 3.28Å; F214-G219 WeakPolarHBondContact O-CA 3.48Å; F214-G219 PolarHBondContact O-N 2.85Å; F214-G219 VanDerWaalsContact O-N 3.08Å; F215-G219 WeakPolarHBondContact CD1-O 3.22Å | ||
| 220 | G | 72 | Confident | 74.2 | Confident | 16 Ų | 16 | 61.8 Ų | 61.8 | 17% | 0.165 | 39% | 0.394 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -167.6 | 151.2 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q207 P212 | Q207-G220 PolarHBondContact N-O 2.76Å; Q207-G220 PolarHBondContact O-N 3.45Å; Q207-G220 VanDerWaalsContact O-O 3.12Å; P212-G220 PolarHBondContact O-N 2.81Å |
| 221 | I | 72.4 | Confident | 75 | Confident | 101 Ų | 101 | 58.1 Ų | 58.1 | 52% | 0.518 | 36% | 0.355 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.9 | 117.7 | 170.8 | -57.5 | 176.1 | 0 | 0 | 0 | 106.8 | K206 | K206-I221 HydrophobicContact CG-CG1 4.33Å |
| 222 | N | 65.2 | Low | 76 | Confident | 104 Ų | 104 | 53.7 Ų | 53.7 | 56% | 0.556 | 33% | 0.328 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -99.1 | 105.8 | 171.7 | -68.8 | -15.8 | 0 | 0 | 0 | 107.2 | G205 | G205-N222 PolarHBondContact N-O 2.85Å; G205-N222 PolarHBondContact O-N 3.35Å; G205-N222 VanDerWaalsContact O-O 3.13Å |
| 223 | S | 63.4 | Low | 77.4 | Confident | 74 Ų | 74 | 51.6 Ų | 51.6 | 52% | 0.517 | 32% | 0.315 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.4 | 117.2 | 170.3 | -168.9 | 0 | 0 | 0 | 0 | 108.6 | R203 | R203-S223 CarbonylContact O-C 3.58Å; R203-S223 WeakPolarHBondContact O-CA 3.43Å |
| 224 | E | 65.7 | Low | 78.5 | Confident | 96 Ų | 96 | 48.8 Ų | 48.8 | 45% | 0.449 | 29% | 0.286 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.9 | 124.2 | 169.9 | -171.7 | 173.4 | -160.8 | 0 | 0 | 107.5 | R203 | R203-E224 HydrophobicContact CB-CB 4.45Å; R203-E224 PolarHBondContact N-O 2.82Å; R203-E224 PolarHBondContact O-N 2.91Å; R203-E224 VanDerWaalsContact O-O 3.14Å |
| 225 | N | 68.4 | Low | 79.4 | Confident | 29 Ų | 29 | 43.3 Ų | 43.3 | 16% | 0.155 | 26% | 0.262 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.9 | 117.9 | 171.2 | -162.9 | 66.1 | 0 | 0 | 0 | 106.7 | T17 D227 | T17-N225 CarbonylContact C-O 3.6Å; N225-D227 PolarHBondContact ND2-OD2 3.08Å; N225-D227 VanDerWaalsContact ND2-OD2 3.15Å |
| 226 | D | 74.1 | Confident | 80.5 | Confident | 44 Ų | 44 | 36.4 Ų | 36.4 | 24% | 0.235 | 23% | 0.232 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -111.1 | 110.1 | 179 | -169.1 | 37.8 | 0 | 0 | 0 | 108.8 | R15 K16 G201 | R15-D226 VanDerWaalsContact CD-OD1 3.26Å; R15-D226 WeakPolarHBondContact CD-OD1 3.4Å; R15-D226 VanDerWaalsContact CD-OD2 3.3Å; R15-D226 WeakPolarHBondContact CD-OD2 3.49Å; R15-D226 WeakPolarHBondContact CG-OD1 3.27Å; K16-D226 WeakPolarHBondContact O-CA 3.11Å; G201-D226 PolarHBondContact N-O 2.83Å; G201-D226 PolarHBondContact O-N 3.26Å |
| 227 | D | 79.4 | Confident | 81.3 | Confident | 13 Ų | 13 | 35.8 Ų | 35.8 | 7% | 0.07 | 21% | 0.213 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -102.1 | 121.7 | 175.2 | -71.3 | -44 | 0 | 0 | 0 | 109.1 | R15 K16 S200 N225 | R15-D227 CarbonylContact C-O 3.47Å; R15-D227 WeakPolarHBondContact CA-O 3.3Å; K16-D227 PolarHBondContact N-O 2.89Å; K16-D227 PolarHBondContact O-N 2.94Å; S200-D227 VanDerWaalsContact CA-OD1 3.26Å; S200-D227 WeakPolarHBondContact CA-OD1 3.33Å; S200-D227 WeakPolarHBondContact CB-OD1 3.46Å; N225-D227 PolarHBondContact ND2-OD2 3.08Å; N225-D227 VanDerWaalsContact ND2-OD2 3.15Å |
| 228 | T | 84.6 | Confident | 82 | Confident | 34 Ų | 34 | 31.7 Ų | 31.7 | 21% | 0.209 | 19% | 0.192 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -105 | 120.9 | 174.2 | -62.9 | 0 | 0 | 0 | 0 | 109.7 | I14 Q198 Q199 | I14-T228 WeakPolarHBondContact O-CA 3.12Å; Q198-T228 CarbonylContact C-O 3.57Å; Q198-T228 WeakPolarHBondContact CA-O 2.97Å; Q199-T228 PolarHBondContact N-O 3.4Å; Q199-T228 PolarHBondContact O-N 3.08Å |
| 229 | I | 86.2 | Confident | 82.9 | Confident | 1 Ų | 1 | 35.4 Ų | 35.4 | 1% | 0.005 | 20% | 0.196 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -108.4 | 127.3 | 177.5 | -56.9 | 169.3 | 0 | 0 | 0 | 108.6 | S13 I14 K16 I24 F197 Q198 | S13-I229 CarbonylContact C-O 3.57Å; S13-I229 WeakPolarHBondContact CA-O 3.34Å; I14-I229 PolarHBondContact N-O 3.48Å; I14-I229 PolarHBondContact O-N 3.41Å; K16-I229 HydrophobicContact CD-CD1 4.38Å; I24-I229 HydrophobicContact CD1-CB 4.45Å; I24-I229 HydrophobicContact CD1-CD1 4.49Å; I24-I229 HydrophobicContact CD1-CG2 3.86Å; I24-I229 HydrophobicContact CG1-CD1 3.9Å; I24-I229 HydrophobicContact CG1-CG2 4.39Å; F197-I229 CarbonylContact O-C 3.48Å; F197-I229 WeakPolarHBondContact O-CA 3.48Å; Q198-I229 HydrophobicContact CG-CG1 4.25Å |
| 230 | L | 88.9 | Confident | 83.2 | Confident | 20 Ų | 20 | 36.8 Ų | 36.8 | 11% | 0.105 | 20% | 0.202 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -90.2 | 133.7 | 169 | -57.6 | -176.8 | 0 | 0 | 0 | 111.2 | L12 V81 L154 F197 | L12-L230 CarbonylContact O-C 3.48Å; L12-L230 WeakPolarHBondContact O-CA 3.41Å; V81-L230 HydrophobicContact CG2-CD2 4.42Å; L154-L230 HydrophobicContact CD1-CD1 3.91Å; L154-L230 HydrophobicContact CD2-CD1 3.57Å; L154-L230 HydrophobicContact CD2-CG 4.37Å; L154-L230 HydrophobicContact CG-CD1 4.3Å; F197-L230 HydrophobicContact CB-CB 4.11Å; F197-L230 HydrophobicContact CB-CD1 4.4Å; F197-L230 HydrophobicContact CB-CG 4.39Å; F197-L230 HydrophobicContact CD2-CB 4.48Å; F197-L230 PolarHBondContact O-N 2.86Å |
| 231 | V | 90.5 | Very high | 83.8 | Confident | 0 Ų | 0 | 37.8 Ų | 37.8 | 0% | 0 | 20% | 0.204 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -119.4 | 125.3 | 172.1 | 172.4 | 0 | 0 | 0 | 0 | 108.4 | L12 I14 I24 W26 I193 I194 L233 | L12-V231 HydrophobicContact CB-CB 4.36Å; L12-V231 PolarHBondContact N-O 2.94Å; L12-V231 PolarHBondContact O-N 3.22Å; I14-V231 HydrophobicContact CD1-CB 3.84Å; I14-V231 HydrophobicContact CD1-CG2 3.4Å; I24-V231 HydrophobicContact CD1-CG2 3.48Å; I24-V231 VanDerWaalsContact CD1-CG2 3.48Å; W26-V231 HydrophobicContact CH2-CG1 3.87Å; W26-V231 HydrophobicContact CH2-CG2 3.87Å; W26-V231 HydrophobicContact CZ2-CG1 4.45Å; W26-V231 HydrophobicContact CZ2-CG2 3.9Å; I193-V231 HydrophobicContact CG2-CG1 3.79Å; I194-V231 CarbonylContact O-C 3.13Å; I194-V231 WeakPolarHBondContact O-CA 3.42Å; V231-L233 HydrophobicContact CG1-CD2 4Å |
| 232 | V | 92.4 | Very high | 84.4 | Confident | 0 Ų | 0 | 34.3 Ų | 34.3 | 0% | 0 | 19% | 0.186 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -107.8 | 124.6 | 177.5 | -173.8 | 0 | 0 | 0 | 0 | 109 | V9 I11 F131 M133 M152 I194 I234 | V9-V232 HydrophobicContact CG1-CG1 4.15Å; I11-V232 HydrophobicContact CG1-CG1 4.39Å; I11-V232 HydrophobicContact CG1-CG2 4.39Å; I11-V232 HydrophobicContact CG2-CG2 4.48Å; F131-V232 HydrophobicContact CE2-CG2 4.41Å; F131-V232 HydrophobicContact CZ-CG2 4.29Å; M133-V232 HydrophobicContact SD-CG1 4.3Å; M152-V232 HydrophobicContact CE-CB 4.32Å; M152-V232 HydrophobicContact CE-CG1 4.25Å; M152-V232 HydrophobicContact CE-CG2 4.33Å; M152-V232 HydrophobicContact SD-CG2 4.49Å; I194-V232 HydrophobicContact CB-CB 4.38Å; I194-V232 PolarHBondContact N-O 3.02Å; I194-V232 PolarHBondContact O-N 2.93Å; V232-I234 HydrophobicContact CG1-CD1 4.35Å; V232-I234 HydrophobicContact CG1-CG1 4.01Å |
| 233 | L | 94 | Very high | 85.5 | Confident | 0 Ų | 0 | 30.2 Ų | 30.2 | 0% | 0 | 16% | 0.164 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -106 | 127.2 | 174.3 | -53.2 | 179.6 | 0 | 0 | 0 | 108.9 | V9 E10 L12 L62 F68 T191 V192 I193 V231 | V9-L233 CarbonylContact C-O 3.52Å; V9-L233 VanDerWaalsContact CA-O 3.32Å; V9-L233 WeakPolarHBondContact CA-O 3.37Å; E10-L233 HydrophobicContact CB-CB 4.37Å; E10-L233 PolarHBondContact N-O 3Å; E10-L233 PolarHBondContact O-N 2.96Å; L12-L233 HydrophobicContact CD1-CD1 4.05Å; L62-L233 HydrophobicContact CB-CD1 4.33Å; F68-L233 HydrophobicContact CD1-CD1 4.06Å; F68-L233 HydrophobicContact CE1-CD1 3.78Å; F68-L233 HydrophobicContact CE1-CD2 3.88Å; F68-L233 HydrophobicContact CE1-CG 4.43Å; F68-L233 HydrophobicContact CZ-CD2 4.36Å; T191-L233 HydrophobicContact CG2-CB 4.04Å; V192-L233 CarbonylContact O-C 3.55Å; V192-L233 WeakPolarHBondContact O-CA 3.19Å; I193-L233 HydrophobicContact CB-CD2 4.08Å; I193-L233 HydrophobicContact CD1-CD2 4.46Å; I193-L233 HydrophobicContact CG1-CD2 3.77Å; I193-L233 HydrophobicContact CG2-CD2 3.81Å; V231-L233 HydrophobicContact CG1-CD2 4Å |
| 234 | I | 94.9 | Very high | 86.9 | Confident | 0 Ų | 0 | 27.5 Ų | 27.5 | 0% | 0 | 14% | 0.142 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -126.4 | 118.6 | 175.6 | -47.9 | 166.4 | 0 | 0 | 0 | 109.3 | N8 V9 M133 L135 L148 T191 V192 I194 V232 | N8-I234 CarbonylContact O-C 3.57Å; N8-I234 WeakPolarHBondContact O-CA 3.3Å; V9-I234 HydrophobicContact CG2-CG1 4.37Å; V9-I234 HydrophobicContact CG2-CG2 4.26Å; M133-I234 HydrophobicContact SD-CD1 4.27Å; L135-I234 HydrophobicContact CD1-CD1 4.29Å; L135-I234 HydrophobicContact CD1-CG2 4.08Å; L135-I234 HydrophobicContact CD2-CD1 3.69Å; L148-I234 HydrophobicContact CD2-CB 4.39Å; L148-I234 HydrophobicContact CD2-CD1 4.23Å; L148-I234 HydrophobicContact CD2-CG2 3.77Å; T191-I234 WeakPolarHBondContact CA-O 3.33Å; V192-I234 HydrophobicContact CG1-CB 3.66Å; V192-I234 HydrophobicContact CG1-CD1 4.22Å; V192-I234 HydrophobicContact CG1-CG1 4.25Å; V192-I234 PolarHBondContact N-O 2.79Å; V192-I234 PolarHBondContact O-N 2.87Å; I194-I234 HydrophobicContact CD1-CD1 3.82Å; V232-I234 HydrophobicContact CG1-CD1 4.35Å; V232-I234 HydrophobicContact CG1-CG1 4.01Å |
| 235 | T | 95.8 | Very high | 88.4 | Confident | 0 Ų | 0 | 22.9 Ų | 22.9 | 0% | 0 | 12% | 0.122 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -116.5 | 96.9 | 177 | -45.9 | 0 | 0 | 0 | 0 | 110.2 | N8 K61 T63 T191 N237 | N8-T235 PolarHBondContact N-O 2.9Å; N8-T235 PolarHBondContact ND2-O 2.79Å; N8-T235 PolarHBondContact O-N 3.11Å; K61-T235 HydrophobicContact CB-CG2 4.3Å; K61-T235 HydrophobicContact CG-CG2 4.19Å; T63-T235 PolarHBondContact OG1-OG1 2.82Å; T191-T235 WeakPolarHBondContact CG2-OG1 3.49Å; T191-T235 PolarHBondContact OG1-OG1 2.83Å; T235-N237 PolarHBondContact O-ND2 3.03Å |
| 236 | P | 95.7 | Very high | 89.8 | Confident | 0 Ų | 0 | 22.5 Ų | 22.5 | 0% | 0 | 12% | 0.12 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -72 | 138.9 | 170.6 | 30.7 | -37.5 | 0 | 0 | 0 | 111.7 | V5 V6 L7 L146 L186 G189 Q190 | V5-P236 HydrophobicContact CG2-CB 3.8Å; V6-P236 CarbonylContact O-C 3.53Å; V6-P236 WeakPolarHBondContact O-CA 3.48Å; L7-P236 HydrophobicContact CD2-CB 3.73Å; L146-P236 HydrophobicContact CD1-CB 3.93Å; L146-P236 HydrophobicContact CD1-CG 4.17Å; L146-P236 HydrophobicContact CD2-CB 3.53Å; L146-P236 HydrophobicContact CD2-CG 3.72Å; L146-P236 HydrophobicContact CG-CB 4.3Å; L146-P236 HydrophobicContact CG-CG 4.32Å; L186-P236 HydrophobicContact CB-CG 4.04Å; L186-P236 HydrophobicContact CD1-CG 3.93Å; G189-P236 PolarHBondContact N-O 2.86Å; Q190-P236 WeakPolarHBondContact O-CD 3.46Å |
| 237 | N | 95.3 | Very high | 91 | Very high | 50 Ų | 50 | 20.8 Ų | 20.8 | 27% | 0.267 | 11% | 0.111 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -128.2 | 109.2 | 169.3 | -61.6 | -86.5 | 0 | 0 | 0 | 108.4 | V5 V6 N8 T235 | V5-N237 CarbonylContact C-O 3.51Å; V5-N237 WeakPolarHBondContact CA-O 3.27Å; V6-N237 HydrophobicContact CB-CB 4.49Å; V6-N237 PolarHBondContact N-O 2.92Å; V6-N237 PolarHBondContact O-N 2.78Å; N8-N237 PolarHBondContact ND2-ND2 3.07Å; T235-N237 PolarHBondContact O-ND2 3.03Å |
| 238 | I | 94.3 | Very high | 92 | Very high | 18 Ų | 18 | 21.5 Ų | 21.5 | 9% | 0.092 | 11% | 0.114 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -70 | 134.2 | 177.5 | -57.8 | 169 | 0 | 0 | 0 | 108.4 | V5 I139 L146 S188 | V5-I238 HydrophobicContact CG2-CG1 4.38Å; I139-I238 HydrophobicContact CD1-CG2 4.47Å; I139-I238 HydrophobicContact CG2-CD1 4.01Å; I139-I238 HydrophobicContact CG2-CG2 4.43Å; L146-I238 HydrophobicContact CD2-CD1 3.91Å; L146-I238 HydrophobicContact CD2-CG1 3.81Å; S188-I238 PolarHBondContact OG-N 3.14Å |
| 239 | I | 90.9 | Very high | 92.6 | Very high | 135 Ų | 135 | 20.4 Ų | 20.4 | 69% | 0.692 | 11% | 0.106 | S | C | * | . | trans | -114.7 | 0 | 175.5 | 64.5 | 176.7 | 0 | 0 | 0 | 111.2 | Q4 V6 V87 | Q4-I239 HydrophobicContact CB-CD1 3.66Å; Q4-I239 HydrophobicContact CB-CG1 3.46Å; Q4-I239 VanDerWaalsContact CB-CG1 3.46Å; Q4-I239 PolarHBondContact O-N 3.38Å; V6-I239 HydrophobicContact CG2-CD1 4.42Å; V6-I239 HydrophobicContact CG2-CG2 3.98Å; V87-I239 HydrophobicContact CG1-CD1 4.09Å |
Retrieved 239 of 239 residues in 223.7 ms
(Link to these results)