| 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 | 37.9 | Very low | 54.2 | Low | 245 Ų | 245 | 140.6 Ų | 140.6 | 100% | 1.207 | 71% | 0.707 | S | S | * | * | 0 | 98.9 | 0 | -62.9 | -177.6 | -176 | 0 | 0 | 107.5 | R3 | M1-R3 PolarHBondContact O-N 3.4Š| |||
| 2 | Q | 45.3 | Very low | 54.7 | Low | 202 Ų | 202 | 136.4 Ų | 136.4 | 94% | 0.944 | 68% | 0.681 | S | S | * | * | trans | -69.5 | 108.1 | 175.2 | -89.5 | 164.2 | -41.3 | 0 | 0 | 107.5 | E4 | Q2-E4 PolarHBondContact O-N 3.4Š| ||
| 3 | R | 53.1 | Low | 55.4 | Low | 233 Ų | 233 | 131.3 Ų | 131.3 | 88% | 0.879 | 66% | 0.662 | S | S | * | * | trans | -65.5 | 101.4 | 164.5 | -95.8 | 177.9 | 155 | 112 | -3.8 | 106.4 | M1 S5 | M1-R3 PolarHBondContact O-N 3.4Å; R3-S5 PolarHBondContact O-N 3.1Å; R3-S5 PolarHBondContact O-OG 3.06Å | ||
| 4 | E | 48.4 | Very low | 56.1 | Low | 192 Ų | 192 | 126.5 Ų | 126.5 | 90% | 0.897 | 64% | 0.643 | S | S | * | * | trans | -50.3 | 107.7 | 158.8 | -105.4 | 174.7 | 103.9 | 0 | 0 | 106.5 | Q2 | Q2-E4 PolarHBondContact O-N 3.4Š| ||
| 5 | S | 55.7 | Low | 56.7 | Low | 79 Ų | 79 | 122.3 Ų | 122.3 | 55% | 0.552 | 62% | 0.621 | S | S | * | * | trans | -86.8 | 114.8 | 179.2 | -57.8 | 0 | 0 | 0 | 0 | 105.8 | R3 | R3-S5 PolarHBondContact O-N 3.1Å; R3-S5 PolarHBondContact O-OG 3.06Å | ||
| 6 | D | 58.6 | Low | 57.1 | Low | 118 Ų | 118 | 116.3 Ų | 116.3 | 63% | 0.631 | 59% | 0.593 | S | S | * | * | trans | -46.4 | 133.6 | 178.9 | -62.4 | -65.3 | 0 | 0 | 0 | 110 | V8 S9 V10 | D6-V8 PolarHBondContact O-N 3.09Å; D6-S9 WeakPolarHBondContact O-CA 3.47Å; D6-S9 VanDerWaalsContact O-CB 3.26Å; D6-S9 WeakPolarHBondContact O-CB 3.29Å; D6-S9 PolarHBondContact O-N 3.39Å; D6-V10 PolarHBondContact O-N 3.37Å | ||
| 7 | P | 58.2 | Low | 57.5 | Low | 105 Ų | 105 | 113.9 Ų | 113.9 | 68% | 0.682 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -57.5 | -25.9 | -174.6 | 21.8 | -33.3 | 0 | 0 | 0 | 112.5 | V10 Y11 | P7-V10 PolarHBondContact O-N 2.87Å; P7-Y11 PolarHBondContact O-N 3.48Å |
| 8 | V | 57.7 | Low | 57.8 | Low | 88 Ų | 88 | 115.6 Ų | 115.6 | 53% | 0.533 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -63.9 | -42.7 | 173.6 | 177.6 | 0 | 0 | 0 | 0 | 111.4 | D6 Y11 F12 | D6-V8 PolarHBondContact O-N 3.09Å; V8-Y11 PolarHBondContact O-N 2.88Å; V8-F12 HydrophobicContact CG1-CD2 3.64Å; V8-F12 HydrophobicContact CG1-CE2 3.23Å; V8-F12 HydrophobicContact CG1-CZ 4.31Å; V8-F12 WeakPolarHBondContact O-CD2 3.25Å; V8-F12 PolarHBondContact O-N 2.94Å |
| 9 | S | 59.1 | Low | 57.9 | Low | 60 Ų | 60 | 116.7 Ų | 116.7 | 42% | 0.42 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -64.7 | -40 | 175.1 | -178.9 | 0 | 0 | 0 | 0 | 111.7 | D6 Y11 F12 T13 | D6-S9 WeakPolarHBondContact O-CA 3.47Å; D6-S9 VanDerWaalsContact O-CB 3.26Å; D6-S9 WeakPolarHBondContact O-CB 3.29Å; D6-S9 PolarHBondContact O-N 3.39Å; S9-Y11 VanDerWaalsContact C-N 3.34Å; S9-Y11 PolarHBondContact O-N 3.44Å; S9-F12 PolarHBondContact O-N 2.94Å; S9-T13 WeakPolarHBondContact O-CB 3.48Å; S9-T13 VanDerWaalsContact O-CG2 3.25Å; S9-T13 WeakPolarHBondContact O-CG2 3.31Å; S9-T13 PolarHBondContact O-N 3.31Å; S9-T13 PolarHBondContact O-OG1 3.48Å |
| 10 | V | 58.7 | Low | 57.9 | Low | 71 Ų | 71 | 114.4 Ų | 114.4 | 43% | 0.43 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -64.3 | -39.7 | 175.1 | -176.2 | 0 | 0 | 0 | 0 | 111.1 | D6 P7 T13 T14 | D6-V10 PolarHBondContact O-N 3.37Å; P7-V10 PolarHBondContact O-N 2.87Å; V10-T13 VanDerWaalsContact CA-OG1 3.28Å; V10-T13 WeakPolarHBondContact CA-OG1 3.37Å; V10-T13 PolarHBondContact O-OG1 3.32Å; V10-T14 VanDerWaalsContact O-CB 3.3Å; V10-T14 WeakPolarHBondContact O-CB 3.49Å; V10-T14 PolarHBondContact O-N 3.09Å; V10-T14 PolarHBondContact O-OG1 3.14Å |
| 11 | Y | 62.9 | Low | 58 | Low | 154 Ų | 154 | 115.5 Ų | 115.5 | 60% | 0.604 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -64.7 | -47.4 | 177 | -175.5 | -106.6 | 0 | 0 | 0 | 112 | P7 V8 S9 T14 I15 | P7-Y11 PolarHBondContact O-N 3.48Å; V8-Y11 PolarHBondContact O-N 2.88Å; S9-Y11 VanDerWaalsContact C-N 3.34Å; S9-Y11 PolarHBondContact O-N 3.44Å; Y11-T14 PolarHBondContact O-N 3.14Å; Y11-I15 HydrophobicContact CD1-CD1 3.64Å; Y11-I15 HydrophobicContact CD2-CD1 4.45Å; Y11-I15 HydrophobicContact CE1-CD1 3.17Å; Y11-I15 HydrophobicContact CE1-CG1 4.39Å; Y11-I15 HydrophobicContact CE2-CD1 4.06Å; Y11-I15 HydrophobicContact CG-CD1 4.26Å; Y11-I15 VanDerWaalsContact CZ-CD1 3.41Å; Y11-I15 WeakPolarHBondContact O-CG1 3.33Å; Y11-I15 PolarHBondContact O-N 3.4Å |
| 12 | F | 60.9 | Low | 58.9 | Low | 90 Ų | 90 | 108.4 Ų | 108.4 | 40% | 0.395 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -65.7 | -41.7 | 178.6 | -72.7 | -59.2 | 0 | 0 | 0 | 112.8 | V8 S9 T14 I15 C16 V41 | V8-F12 HydrophobicContact CG1-CD2 3.64Å; V8-F12 HydrophobicContact CG1-CE2 3.23Å; V8-F12 HydrophobicContact CG1-CZ 4.31Å; V8-F12 WeakPolarHBondContact O-CD2 3.25Å; V8-F12 PolarHBondContact O-N 2.94Å; S9-F12 PolarHBondContact O-N 2.94Å; F12-T14 VanDerWaalsContact C-N 3.33Å; F12-T14 PolarHBondContact O-N 3.41Å; F12-I15 PolarHBondContact O-N 3.44Å; F12-C16 VanDerWaalsContact O-CB 3.28Å; F12-C16 WeakPolarHBondContact O-CB 3.37Å; F12-C16 PolarHBondContact O-N 3.34Å; F12-V41 HydrophobicContact CD1-CG1 3.96Å; F12-V41 HydrophobicContact CE1-CG1 3.79Å; F12-V41 HydrophobicContact CZ-CG1 4.42Å |
| 13 | T | 64 | Low | 59.3 | Low | 70 Ų | 70 | 103.5 Ų | 103.5 | 43% | 0.429 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -62.9 | -40.1 | 174.9 | 49.6 | 0 | 0 | 0 | 0 | 111.4 | S9 V10 C16 D17 | S9-T13 WeakPolarHBondContact O-CB 3.48Å; S9-T13 VanDerWaalsContact O-CG2 3.25Å; S9-T13 WeakPolarHBondContact O-CG2 3.31Å; S9-T13 PolarHBondContact O-N 3.31Å; S9-T13 PolarHBondContact O-OG1 3.48Å; V10-T13 VanDerWaalsContact CA-OG1 3.28Å; V10-T13 WeakPolarHBondContact CA-OG1 3.37Å; V10-T13 PolarHBondContact O-OG1 3.32Å; T13-C16 PolarHBondContact O-N 3.5Å; T13-D17 WeakPolarHBondContact O-CB 3.46Å; T13-D17 PolarHBondContact O-N 3.41Å |
| 14 | T | 65.3 | Low | 59.3 | Low | 64 Ų | 64 | 100.1 Ų | 100.1 | 39% | 0.393 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -66.5 | -43.1 | 177.8 | -56.7 | 0 | 0 | 0 | 0 | 112.5 | V10 Y11 F12 C16 K18 | V10-T14 VanDerWaalsContact O-CB 3.3Å; V10-T14 WeakPolarHBondContact O-CB 3.49Å; V10-T14 PolarHBondContact O-N 3.09Å; V10-T14 PolarHBondContact O-OG1 3.14Å; Y11-T14 PolarHBondContact O-N 3.14Å; F12-T14 VanDerWaalsContact C-N 3.33Å; F12-T14 PolarHBondContact O-N 3.41Å; T14-C16 VanDerWaalsContact C-N 3.29Å; T14-C16 PolarHBondContact O-N 2.94Å; T14-K18 WeakPolarHBondContact O-CB 2.99Å; T14-K18 WeakPolarHBondContact O-CG 3.44Å; T14-K18 PolarHBondContact O-N 3Å |
| 15 | I | 64.9 | Low | 59.6 | Low | 63 Ų | 63 | 96.3 Ų | 96.3 | 32% | 0.323 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -63.2 | -42.3 | 176.4 | -70.4 | 167.4 | 0 | 0 | 0 | 110.3 | Y11 F12 K18 Q19 | Y11-I15 HydrophobicContact CD1-CD1 3.64Å; Y11-I15 HydrophobicContact CD2-CD1 4.45Å; Y11-I15 HydrophobicContact CE1-CD1 3.17Å; Y11-I15 HydrophobicContact CE1-CG1 4.39Å; Y11-I15 HydrophobicContact CE2-CD1 4.06Å; Y11-I15 HydrophobicContact CG-CD1 4.26Å; Y11-I15 VanDerWaalsContact CZ-CD1 3.41Å; Y11-I15 WeakPolarHBondContact O-CG1 3.33Å; Y11-I15 PolarHBondContact O-N 3.4Å; F12-I15 PolarHBondContact O-N 3.44Å; I15-K18 WeakPolarHBondContact O-CB 3.36Å; I15-K18 PolarHBondContact O-N 2.99Å; I15-Q19 PolarHBondContact O-N 3.46Å |
| 16 | C | 62.5 | Low | 59.4 | Low | 26 Ų | 26 | 95 Ų | 95 | 18% | 0.176 | 52% | 0.521 | C | S | . | . | H | α-helix | trans | -75.9 | -32.3 | -175.4 | -155.4 | 0 | 0 | 0 | 0 | 112.4 | F12 T13 T14 Q19 M20 C37 | F12-C16 VanDerWaalsContact O-CB 3.28Å; F12-C16 WeakPolarHBondContact O-CB 3.37Å; F12-C16 PolarHBondContact O-N 3.34Å; T13-C16 PolarHBondContact O-N 3.5Å; T14-C16 VanDerWaalsContact C-N 3.29Å; T14-C16 PolarHBondContact O-N 2.94Å; C16-Q19 PolarHBondContact O-N 3.31Å; C16-M20 WeakPolarHBondContact O-CB 3.49Å; C16-M20 WeakPolarHBondContact O-CG 3.29Å; C16-M20 PolarHBondContact O-N 3.33Å; C16-C37 HydrophobicContact CB-CB 3.29Å; C16-C37 WeakPolarHBondContact CB-SG 3.46Å; C16-C37 WeakPolarHBondContact SG-CA 3.28Å; C16-C37 WeakPolarHBondContact SG-CB 3.3Å; C16-C37 CovalentContact SG-SG 1.99Å; C16-C37 PolarHBondContact SG-SG 3.47Å |
| 17 | D | 64.7 | Low | 59.1 | Low | 76 Ų | 76 | 99 Ų | 99 | 41% | 0.406 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -61.9 | -41.9 | 166.8 | -173.9 | 71.3 | 0 | 0 | 0 | 111.6 | T13 Q19 M20 K21 | T13-D17 WeakPolarHBondContact O-CB 3.46Å; T13-D17 PolarHBondContact O-N 3.41Å; D17-Q19 PolarHBondContact O-N 3.28Å; D17-M20 PolarHBondContact O-N 2.88Å; D17-K21 WeakPolarHBondContact O-CB 3.43Å; D17-K21 PolarHBondContact O-N 3.07Å; D17-K21 IonicContact OD1-NZ 3.94Å; D17-K21 WeakPolarHBondContact OD2-CE 3.29Å; D17-K21 IonicContact OD2-NZ 2.76Å; D17-K21 PolarHBondContact OD2-NZ 3.46Å |
| 18 | K | 63.1 | Low | 58.8 | Low | 145 Ų | 145 | 103.9 Ų | 103.9 | 63% | 0.63 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -61.6 | -42.5 | 174.2 | -77.5 | 179.8 | -179.8 | -176.7 | 0 | 112.1 | T14 I15 K21 S22 | T14-K18 WeakPolarHBondContact O-CB 2.99Å; T14-K18 WeakPolarHBondContact O-CG 3.44Å; T14-K18 PolarHBondContact O-N 3Å; I15-K18 WeakPolarHBondContact O-CB 3.36Å; I15-K18 PolarHBondContact O-N 2.99Å; K18-K21 PolarHBondContact O-N 3.38Å; K18-S22 WeakPolarHBondContact O-CB 3.04Å; K18-S22 PolarHBondContact O-N 3.5Å |
| 19 | Q | 59.5 | Low | 58.2 | Low | 136 Ų | 136 | 110.1 Ų | 110.1 | 64% | 0.636 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -69.1 | -39.2 | 176.7 | -72.3 | -146 | 1.5 | 0 | 0 | 112.5 | I15 C16 D17 S22 S23 | I15-Q19 PolarHBondContact O-N 3.46Å; C16-Q19 PolarHBondContact O-N 3.31Å; D17-Q19 PolarHBondContact O-N 3.28Å; Q19-S22 PolarHBondContact O-N 3.17Å; Q19-S23 PolarHBondContact O-N 3.02Å; Q19-S23 VanDerWaalsContact O-N 3.08Å; Q19-S23 PolarHBondContact O-OG 2.92Å |
| 20 | M | 58.1 | Low | 57.6 | Low | 71 Ų | 71 | 111.2 Ų | 111.2 | 35% | 0.35 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -62 | -44.1 | 173.7 | -76.1 | -175.5 | 169.6 | 0 | 0 | 111.4 | C16 D17 S23 Y24 A34 C37 | C16-M20 WeakPolarHBondContact O-CB 3.49Å; C16-M20 WeakPolarHBondContact O-CG 3.29Å; C16-M20 PolarHBondContact O-N 3.33Å; D17-M20 PolarHBondContact O-N 2.88Å; M20-S23 PolarHBondContact O-N 3.5Å; M20-Y24 WeakPolarHBondContact O-CD2 3.32Å; M20-Y24 PolarHBondContact O-N 3.48Å; M20-Y24 VanDerWaalsContact O-N 3.14Å; M20-A34 HydrophobicContact CE-CB 3.93Å; M20-C37 WeakPolarHBondContact CE-SG 3.4Å |
| 21 | K | 58.8 | Low | 57.2 | Low | 138 Ų | 138 | 119.4 Ų | 119.4 | 60% | 0.6 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -64.6 | -37.8 | 175.6 | -84.5 | 173.6 | -179.8 | 148.9 | 0 | 113 | D17 K18 S23 Y24 | D17-K21 WeakPolarHBondContact O-CB 3.43Å; D17-K21 PolarHBondContact O-N 3.07Å; D17-K21 IonicContact OD1-NZ 3.94Å; D17-K21 WeakPolarHBondContact OD2-CE 3.29Å; D17-K21 IonicContact OD2-NZ 2.76Å; D17-K21 PolarHBondContact OD2-NZ 3.46Å; K18-K21 PolarHBondContact O-N 3.38Å; K21-S23 VanDerWaalsContact C-N 3.29Å; K21-S23 PolarHBondContact O-N 3.01Å; K21-Y24 PolarHBondContact O-N 2.95Å; K21-Y24 VanDerWaalsContact O-N 3.16Å |
| 22 | S | 56.5 | Low | 56.4 | Low | 95 Ų | 95 | 118.6 Ų | 118.6 | 66% | 0.664 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -63.9 | -35.1 | 175.9 | -166.5 | 0 | 0 | 0 | 0 | 112.1 | K18 Q19 Y24 | K18-S22 WeakPolarHBondContact O-CB 3.04Å; K18-S22 PolarHBondContact O-N 3.5Å; Q19-S22 PolarHBondContact O-N 3.17Å; S22-Y24 VanDerWaalsContact C-N 3.34Å |
| 23 | S | 53.9 | Low | 55.9 | Low | 100 Ų | 100 | 124 Ų | 124 | 70% | 0.699 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -79.1 | -13.7 | 175.5 | -67 | 0 | 0 | 0 | 0 | 113.9 | Q19 M20 K21 S25 | Q19-S23 PolarHBondContact O-N 3.02Å; Q19-S23 VanDerWaalsContact O-N 3.08Å; Q19-S23 PolarHBondContact O-OG 2.92Å; M20-S23 PolarHBondContact O-N 3.5Å; K21-S23 VanDerWaalsContact C-N 3.29Å; K21-S23 PolarHBondContact O-N 3.01Å; S23-S25 VanDerWaalsContact C-N 3.34Å |
| 24 | Y | 53.7 | Low | 55.2 | Low | 162 Ų | 162 | 124.1 Ų | 124.1 | 64% | 0.635 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -82 | -11.1 | 177.6 | -106 | -93.8 | 0 | 0 | 0 | 113.6 | M20 K21 S22 G26 | M20-Y24 WeakPolarHBondContact O-CD2 3.32Å; M20-Y24 PolarHBondContact O-N 3.48Å; M20-Y24 VanDerWaalsContact O-N 3.14Å; K21-Y24 PolarHBondContact O-N 2.95Å; K21-Y24 VanDerWaalsContact O-N 3.16Å; S22-Y24 VanDerWaalsContact C-N 3.34Å; Y24-G26 PolarHBondContact O-N 3.44Å |
| 25 | S | 53.7 | Low | 54.7 | Low | 111 Ų | 111 | 124.4 Ų | 124.4 | 78% | 0.776 | 63% | 0.627 | S | S | * | * | S | Bend | trans | -86.8 | 70.4 | 174 | 178.5 | 0 | 0 | 0 | 0 | 111.2 | S23 | S23-S25 VanDerWaalsContact C-N 3.34Š|
| 26 | G | 52.4 | Low | 54.3 | Low | 51 Ų | 51 | 125.6 Ų | 125.6 | 53% | 0.526 | 64% | 0.638 | S | S | . | * | S | Bend | trans | 143.6 | 97.7 | 166.9 | 0 | 0 | 0 | 0 | 0 | 116 | Y24 Y28 | Y24-G26 PolarHBondContact O-N 3.44Å; G26-Y28 PolarHBondContact O-N 3.11Å |
| 27 | K | 52.4 | Low | 54.1 | Low | 203 Ų | 203 | 125.4 Ų | 125.4 | 88% | 0.883 | 64% | 0.638 | S | S | * | * | S | Bend | trans | 70.3 | -12.3 | 144.6 | -69.1 | -172.2 | 173.7 | -179.1 | 0 | 122.2 | ||
| 28 | Y | 52 | Low | 53.8 | Low | 207 Ų | 207 | 125.8 Ų | 125.8 | 81% | 0.812 | 64% | 0.644 | S | S | * | * | trans | -138.7 | 91.4 | 177.8 | -73.5 | -88.3 | 0 | 0 | 0 | 113.5 | G26 S30 | G26-Y28 PolarHBondContact O-N 3.11Å; Y28-S30 PolarHBondContact O-N 2.99Å | ||
| 29 | R | 44.7 | Very low | 53.2 | Low | 219 Ų | 219 | 121 Ų | 121 | 83% | 0.826 | 63% | 0.631 | S | S | * | * | trans | -73.1 | 67.5 | 162.2 | -148.8 | -177.6 | -171.8 | -168.8 | 1.4 | 108.5 | R31 | R29-R31 PolarHBondContact O-N 3.47Š| ||
| 30 | S | 46.6 | Very low | 53 | Low | 84 Ų | 84 | 116.5 Ų | 116.5 | 59% | 0.587 | 62% | 0.617 | S | S | * | * | trans | -66.5 | 120.1 | 173 | 176.4 | 0 | 0 | 0 | 0 | 108.3 | Y28 N32 | Y28-S30 PolarHBondContact O-N 2.99Å; S30-N32 PolarHBondContact O-N 3.25Å | ||
| 31 | R | 49.6 | Very low | 53 | Low | 242 Ų | 242 | 116 Ų | 116 | 91% | 0.913 | 62% | 0.619 | S | S | * | * | trans | -71.1 | 23.6 | 179.1 | -71 | -178.2 | 177.9 | 174.9 | -1 | 113.5 | R29 F33 | R29-R31 PolarHBondContact O-N 3.47Å; R31-F33 PolarHBondContact O-N 2.95Å | ||
| 32 | N | 47.9 | Very low | 53.1 | Low | 138 Ų | 138 | 116.4 Ų | 116.4 | 74% | 0.738 | 62% | 0.62 | S | S | * | * | S | Bend | trans | -89.7 | 92.8 | 167.1 | -77.1 | -8.6 | 0 | 0 | 0 | 108.5 | S30 A34 | S30-N32 PolarHBondContact O-N 3.25Å; N32-A34 PolarHBondContact O-N 3.33Å |
| 33 | F | 50 | Low | 53.7 | Low | 202 Ų | 202 | 114.6 Ų | 114.6 | 89% | 0.886 | 61% | 0.605 | S | S | * | * | trans | 11.4 | 82.2 | 142.6 | -113.8 | -101.1 | 0 | 0 | 0 | 113.2 | R31 S35 | R31-F33 PolarHBondContact O-N 2.95Å; F33-S35 PolarHBondContact O-N 3.16Å | ||
| 34 | A | 49.7 | Very low | 54.5 | Low | 73 Ų | 73 | 116.2 Ų | 116.2 | 60% | 0.603 | 60% | 0.602 | S | S | * | * | trans | -61 | 111 | 163.7 | 0 | 0 | 0 | 0 | 0 | 105.2 | M20 N32 | M20-A34 HydrophobicContact CE-CB 3.93Å; N32-A34 PolarHBondContact O-N 3.33Å | ||
| 35 | S | 53.7 | Low | 55.5 | Low | 70 Ų | 70 | 111 Ų | 111 | 49% | 0.49 | 59% | 0.592 | S | S | . | * | trans | -51.7 | 139.6 | 176.3 | 41 | 0 | 0 | 0 | 0 | 108.5 | F33 C37 | F33-S35 PolarHBondContact O-N 3.16Å; S35-C37 PolarHBondContact O-N 3.43Å; S35-C37 VanDerWaalsContact O-N 3.11Å | ||
| 36 | P | 57.4 | Low | 56.5 | Low | 88 Ų | 88 | 110.5 Ų | 110.5 | 57% | 0.571 | 58% | 0.577 | S | S | * | * | trans | -54.5 | 127.6 | -174 | 22.3 | -32.5 | 0 | 0 | 0 | 108.4 | P38 A39 | P36-P38 WeakPolarHBondContact O-CD 3.25Å; P36-A39 HydrophobicContact CG-CB 4.33Å; P36-A39 WeakPolarHBondContact O-CB 3.48Å; P36-A39 PolarHBondContact O-N 3.28Å | ||
| 37 | C | 57.3 | Low | 57.7 | Low | 23 Ų | 23 | 114.8 Ų | 114.8 | 16% | 0.155 | 58% | 0.582 | C | S | . | * | H | α-helix | trans | -35.8 | -27.4 | -179.4 | -89.6 | 0 | 0 | 0 | 0 | 119.5 | C16 M20 S35 | C16-C37 HydrophobicContact CB-CB 3.29Å; C16-C37 WeakPolarHBondContact CB-SG 3.46Å; C16-C37 WeakPolarHBondContact SG-CA 3.28Å; C16-C37 WeakPolarHBondContact SG-CB 3.3Å; C16-C37 CovalentContact SG-SG 1.99Å; C16-C37 PolarHBondContact SG-SG 3.47Å; M20-C37 WeakPolarHBondContact CE-SG 3.4Å; S35-C37 PolarHBondContact O-N 3.43Å; S35-C37 VanDerWaalsContact O-N 3.11Å |
| 38 | P | 57.9 | Low | 59.1 | Low | 84 Ų | 84 | 112.4 Ų | 112.4 | 55% | 0.545 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -77.7 | -27.1 | 169.4 | 26.2 | -35.8 | 0 | 0 | 0 | 115 | P36 A40 V41 F42 | P36-P38 WeakPolarHBondContact O-CD 3.25Å; P38-A40 PolarHBondContact O-N 3.14Å; P38-V41 PolarHBondContact O-N 3.08Å; P38-F42 WeakPolarHBondContact O-CB 3.39Å; P38-F42 PolarHBondContact O-N 2.93Å |
| 39 | A | 51.8 | Low | 60.7 | Low | 43 Ų | 43 | 107.3 Ų | 107.3 | 36% | 0.355 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -68.6 | -39.8 | -170.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | P36 T43 | P36-A39 HydrophobicContact CG-CB 4.33Å; P36-A39 WeakPolarHBondContact O-CB 3.48Å; P36-A39 PolarHBondContact O-N 3.28Å; A39-T43 VanDerWaalsContact O-CG2 3.29Å; A39-T43 WeakPolarHBondContact O-CG2 3.22Å; A39-T43 PolarHBondContact O-N 3.19Å; A39-T43 VanDerWaalsContact O-N 3.11Å; A39-T43 PolarHBondContact O-OG1 2.87Å |
| 40 | A | 55.3 | Low | 62.6 | Low | 42 Ų | 42 | 100.6 Ų | 100.6 | 35% | 0.347 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -72 | -36.8 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | P38 T43 H44 | P38-A40 PolarHBondContact O-N 3.14Å; A40-T43 PolarHBondContact O-OG1 2.87Å; A40-H44 PolarHBondContact O-CD2 3.49Å; A40-H44 PolarHBondContact O-N 3.41Å |
| 41 | V | 58.1 | Low | 64.6 | Low | 62 Ų | 62 | 104.2 Ų | 104.2 | 38% | 0.376 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -70.6 | -39.7 | 177.1 | -178.2 | 0 | 0 | 0 | 0 | 110.6 | F12 P38 H44 A45 | F12-V41 HydrophobicContact CD1-CG1 3.96Å; F12-V41 HydrophobicContact CE1-CG1 3.79Å; F12-V41 HydrophobicContact CZ-CG1 4.42Å; P38-V41 PolarHBondContact O-N 3.08Å; V41-H44 PolarHBondContact O-N 3.3Å; V41-A45 PolarHBondContact O-N 3.29Å; V41-A45 VanDerWaalsContact O-N 3.17Å |
| 42 | F | 61.2 | Low | 66.4 | Low | 145 Ų | 145 | 95.4 Ų | 95.4 | 64% | 0.636 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -65.5 | -40.2 | 178.7 | -164.9 | -94.4 | 0 | 0 | 0 | 112.2 | P38 A45 Q46 | P38-F42 WeakPolarHBondContact O-CB 3.39Å; P38-F42 PolarHBondContact O-N 2.93Å; F42-A45 PolarHBondContact O-N 3.37Å; F42-Q46 VanDerWaalsContact O-CB 3.32Å; F42-Q46 WeakPolarHBondContact O-CB 3.44Å; F42-Q46 PolarHBondContact O-N 3.2Å |
| 43 | T | 68.2 | Low | 68.4 | Low | 57 Ų | 57 | 94.2 Ų | 94.2 | 35% | 0.35 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -65.3 | -44.7 | 177.3 | 52.1 | 0 | 0 | 0 | 0 | 111.7 | A39 A40 A45 Q46 F47 | A39-T43 VanDerWaalsContact O-CG2 3.29Å; A39-T43 WeakPolarHBondContact O-CG2 3.22Å; A39-T43 PolarHBondContact O-N 3.19Å; A39-T43 VanDerWaalsContact O-N 3.11Å; A39-T43 PolarHBondContact O-OG1 2.87Å; A40-T43 PolarHBondContact O-OG1 2.87Å; T43-A45 PolarHBondContact O-N 3.27Å; T43-Q46 PolarHBondContact O-N 2.8Å; T43-F47 WeakPolarHBondContact O-CD2 3.38Å; T43-F47 PolarHBondContact O-N 2.98Å |
| 44 | H | 70.5 | Confident | 70.3 | Confident | 135 Ų | 135 | 88.8 Ų | 88.8 | 63% | 0.625 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -61.1 | -43.2 | 178.2 | -74.5 | -58.7 | 0 | 0 | 0 | 112.8 | A40 V41 F47 F48 | A40-H44 PolarHBondContact O-CD2 3.49Å; A40-H44 PolarHBondContact O-N 3.41Å; V41-H44 PolarHBondContact O-N 3.3Å; H44-F47 PolarHBondContact O-N 3.04Å; H44-F48 PolarHBondContact O-N 2.95Å; H44-F48 VanDerWaalsContact O-N 3.09Å |
| 45 | A | 74.2 | Confident | 72.2 | Confident | 53 Ų | 53 | 87 Ų | 87 | 44% | 0.438 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -63.6 | -42.8 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | V41 F42 T43 F48 I49 | V41-A45 PolarHBondContact O-N 3.29Å; V41-A45 VanDerWaalsContact O-N 3.17Å; F42-A45 PolarHBondContact O-N 3.37Å; T43-A45 PolarHBondContact O-N 3.27Å; A45-F48 PolarHBondContact O-N 3.48Å; A45-I49 WeakPolarHBondContact O-CG1 3.28Å; A45-I49 PolarHBondContact O-N 2.92Å; A45-I49 VanDerWaalsContact O-N 3.14Å |
| 46 | Q | 75 | Confident | 73.9 | Confident | 99 Ų | 99 | 89 Ų | 89 | 46% | 0.463 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -63.5 | -41.8 | 177.4 | -172 | 176.3 | 0.1 | 0 | 0 | 112.1 | F42 T43 F48 I49 I50 | F42-Q46 VanDerWaalsContact O-CB 3.32Å; F42-Q46 WeakPolarHBondContact O-CB 3.44Å; F42-Q46 PolarHBondContact O-N 3.2Å; T43-Q46 PolarHBondContact O-N 2.8Å; Q46-F48 PolarHBondContact O-N 2.91Å; Q46-I49 PolarHBondContact O-N 3.45Å; Q46-I50 HydrophobicContact CG-CD1 3.96Å; Q46-I50 VanDerWaalsContact O-CG1 3.29Å; Q46-I50 WeakPolarHBondContact O-CG1 2.81Å; Q46-I50 PolarHBondContact O-N 2.87Å |
| 47 | F | 77.9 | Confident | 75.4 | Confident | 141 Ų | 141 | 93.9 Ų | 93.9 | 62% | 0.618 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -62.3 | -41.9 | 175.9 | -83.3 | -66.7 | 0 | 0 | 0 | 112.3 | T43 H44 I50 F51 | T43-F47 WeakPolarHBondContact O-CD2 3.38Å; T43-F47 PolarHBondContact O-N 2.98Å; H44-F47 PolarHBondContact O-N 3.04Å; F47-I50 PolarHBondContact O-N 2.68Å; F47-F51 WeakPolarHBondContact O-CB 3.21Å; F47-F51 PolarHBondContact O-N 2.96Å |
| 48 | F | 82.7 | Confident | 76.6 | Confident | 153 Ų | 153 | 100.8 Ų | 100.8 | 67% | 0.671 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -63.5 | -42.4 | 178.3 | -171.8 | -96.1 | 0 | 0 | 0 | 112 | H44 A45 Q46 F51 S52 | H44-F48 PolarHBondContact O-N 2.95Å; H44-F48 VanDerWaalsContact O-N 3.09Å; A45-F48 PolarHBondContact O-N 3.48Å; Q46-F48 PolarHBondContact O-N 2.91Å; F48-F51 PolarHBondContact O-N 2.78Å; F48-S52 VanDerWaalsContact O-CB 3.31Å; F48-S52 WeakPolarHBondContact O-CB 3.27Å; F48-S52 PolarHBondContact O-N 2.85Å |
| 49 | I | 84.7 | Confident | 77.6 | Confident | 100 Ų | 100 | 106.8 Ų | 106.8 | 51% | 0.513 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -62.2 | -47.8 | 177.2 | -66.3 | 164.5 | 0 | 0 | 0 | 110.8 | A45 Q46 F51 S52 L53 | A45-I49 WeakPolarHBondContact O-CG1 3.28Å; A45-I49 PolarHBondContact O-N 2.92Å; A45-I49 VanDerWaalsContact O-N 3.14Å; Q46-I49 PolarHBondContact O-N 3.45Å; I49-F51 PolarHBondContact O-N 3.01Å; I49-S52 PolarHBondContact O-N 2.76Å; I49-L53 HydrophobicContact CG2-CD1 4.04Å; I49-L53 WeakPolarHBondContact O-CG 3.35Å; I49-L53 PolarHBondContact O-N 2.77Å |
| 50 | I | 85.3 | Confident | 78.9 | Confident | 79 Ų | 79 | 110 Ų | 110 | 41% | 0.405 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -62.2 | -45.2 | 179.6 | -66.4 | 165.6 | 0 | 0 | 0 | 110.7 | Q46 F47 S52 L53 L54 | Q46-I50 HydrophobicContact CG-CD1 3.96Å; Q46-I50 VanDerWaalsContact O-CG1 3.29Å; Q46-I50 WeakPolarHBondContact O-CG1 2.81Å; Q46-I50 PolarHBondContact O-N 2.87Å; F47-I50 PolarHBondContact O-N 2.68Å; I50-S52 VanDerWaalsContact C-N 3.34Å; I50-S52 PolarHBondContact O-N 3.5Å; I50-L53 PolarHBondContact O-N 2.97Å; I50-L54 HydrophobicContact CG2-CD1 3.92Å; I50-L54 WeakPolarHBondContact O-CB 3.44Å; I50-L54 WeakPolarHBondContact O-CG 2.86Å; I50-L54 PolarHBondContact O-N 2.91Å |
| 51 | F | 87.5 | Confident | 80.1 | Confident | 160 Ų | 160 | 113.6 Ų | 113.6 | 70% | 0.702 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -64.7 | -39.4 | 178.9 | -166.6 | -93.4 | 0 | 0 | 0 | 111.8 | F47 F48 I49 L54 G55 | F47-F51 WeakPolarHBondContact O-CB 3.21Å; F47-F51 PolarHBondContact O-N 2.96Å; F48-F51 PolarHBondContact O-N 2.78Å; I49-F51 PolarHBondContact O-N 3.01Å; F51-L54 PolarHBondContact O-N 3.37Å; F51-G55 PolarHBondContact O-N 2.94Å |
| 52 | S | 88.5 | Confident | 81.3 | Confident | 56 Ų | 56 | 116.4 Ų | 116.4 | 39% | 0.392 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -63.8 | -42.1 | 175.2 | -169.8 | 0 | 0 | 0 | 0 | 112 | F48 I49 I50 G55 I56 | F48-S52 VanDerWaalsContact O-CB 3.31Å; F48-S52 WeakPolarHBondContact O-CB 3.27Å; F48-S52 PolarHBondContact O-N 2.85Å; I49-S52 PolarHBondContact O-N 2.76Å; I50-S52 VanDerWaalsContact C-N 3.34Å; I50-S52 PolarHBondContact O-N 3.5Å; S52-G55 PolarHBondContact O-N 1.99Å; S52-I56 WeakPolarHBondContact O-CD1 3.36Å; S52-I56 VanDerWaalsContact O-CG1 3.29Å; S52-I56 WeakPolarHBondContact O-CG1 3.34Å; S52-I56 PolarHBondContact O-N 3.11Å; S52-I56 VanDerWaalsContact O-N 3.1Å |
| 53 | L | 89.5 | Confident | 82.5 | Confident | 113 Ų | 113 | 114.8 Ų | 114.8 | 59% | 0.592 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -66.3 | -41.8 | 177.1 | -73.2 | 171 | 0 | 0 | 0 | 112 | I49 I50 I56 Y57 | I49-L53 HydrophobicContact CG2-CD1 4.04Å; I49-L53 WeakPolarHBondContact O-CG 3.35Å; I49-L53 PolarHBondContact O-N 2.77Å; I50-L53 PolarHBondContact O-N 2.97Å; L53-I56 PolarHBondContact O-N 3.3Å; L53-Y57 PolarHBondContact O-N 3.06Å |
| 54 | L | 90.7 | Very high | 83.4 | Confident | 88 Ų | 88 | 118.4 Ų | 118.4 | 46% | 0.461 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -61.9 | -44.3 | 173.7 | -78 | 164.6 | 0 | 0 | 0 | 111.2 | I50 F51 I56 Y57 F58 | I50-L54 HydrophobicContact CG2-CD1 3.92Å; I50-L54 WeakPolarHBondContact O-CB 3.44Å; I50-L54 WeakPolarHBondContact O-CG 2.86Å; I50-L54 PolarHBondContact O-N 2.91Å; F51-L54 PolarHBondContact O-N 3.37Å; L54-I56 VanDerWaalsContact C-N 3.3Å; L54-I56 PolarHBondContact O-N 3.33Å; L54-Y57 WeakPolarHBondContact O-CB 3.26Å; L54-Y57 PolarHBondContact O-N 3.24Å; L54-Y57 VanDerWaalsContact O-N 3.09Å; L54-F58 HydrophobicContact CD2-CE2 4.35Å; L54-F58 VanDerWaalsContact O-CD2 3.25Å; L54-F58 WeakPolarHBondContact O-CD2 3.43Å; L54-F58 PolarHBondContact O-N 2.95Å; L54-F58 VanDerWaalsContact O-N 3.14Å |
| 55 | G | 88.8 | Confident | 84.3 | Confident | 36 Ų | 36 | 117.3 Ų | 117.3 | 37% | 0.371 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -59.9 | -37.9 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | F51 S52 | F51-G55 PolarHBondContact O-N 2.94Å; S52-G55 PolarHBondContact O-N 1.99Å |
| 56 | I | 89.3 | Confident | 85 | Confident | 113 Ų | 113 | 121.9 Ų | 121.9 | 58% | 0.579 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -70.5 | -35.1 | 174.5 | -64.5 | 162.3 | 0 | 0 | 0 | 111.4 | S52 L53 L54 F58 L59 | S52-I56 WeakPolarHBondContact O-CD1 3.36Å; S52-I56 VanDerWaalsContact O-CG1 3.29Å; S52-I56 WeakPolarHBondContact O-CG1 3.34Å; S52-I56 PolarHBondContact O-N 3.11Å; S52-I56 VanDerWaalsContact O-N 3.1Å; L53-I56 PolarHBondContact O-N 3.3Å; L54-I56 VanDerWaalsContact C-N 3.3Å; L54-I56 PolarHBondContact O-N 3.33Å; I56-F58 VanDerWaalsContact C-N 3.35Å; I56-L59 PolarHBondContact O-N 3.18Å |
| 57 | Y | 88.8 | Confident | 85.8 | Confident | 190 Ų | 190 | 123.6 Ų | 123.6 | 75% | 0.745 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -69 | -31.2 | 180 | -178.6 | -94.4 | 0 | 0 | 0 | 113.4 | L53 L54 | L53-Y57 PolarHBondContact O-N 3.06Å; L54-Y57 WeakPolarHBondContact O-CB 3.26Å; L54-Y57 PolarHBondContact O-N 3.24Å; L54-Y57 VanDerWaalsContact O-N 3.09Å |
| 58 | F | 83.2 | Confident | 86.4 | Confident | 168 Ų | 168 | 122.2 Ų | 122.2 | 74% | 0.737 | 61% | 0.606 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.3 | -6.2 | 178.1 | -79.2 | -75.3 | 0 | 0 | 0 | 114 | L54 I56 | L54-F58 HydrophobicContact CD2-CE2 4.35Å; L54-F58 VanDerWaalsContact O-CD2 3.25Å; L54-F58 WeakPolarHBondContact O-CD2 3.43Å; L54-F58 PolarHBondContact O-N 2.95Å; L54-F58 VanDerWaalsContact O-N 3.14Å; I56-F58 VanDerWaalsContact C-N 3.35Å |
| 59 | L | 78.4 | Confident | 86.8 | Confident | 210 Ų | 210 | 119.4 Ų | 119.4 | 100% | 1.099 | 60% | 0.6 | S | S | * | * | trans | -96.9 | 0 | -179 | -132.2 | 132.1 | 0 | 0 | 0 | 110.9 | I56 | I56-L59 PolarHBondContact O-N 3.18Š|
Retrieved 59 of 59 residues in 13.3 ms
(Link to these results)