| 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 | 42.6 | Very low | 49.9 | Very low | 204 Ų | 204 | 134.7 Ų | 134.7 | 100% | 1.005 | 63% | 0.632 | S | S | * | * | 0 | 112.6 | 0 | -73.5 | -90 | -173 | 0 | 0 | 109.7 | R3 | M1-R3 PolarHBondContact O-N 3.08Š| |||
| 2 | P | 45.3 | Very low | 50.1 | Low | 102 Ų | 102 | 133.9 Ų | 133.9 | 66% | 0.662 | 63% | 0.634 | S | S | * | * | trans | -70.2 | 124.4 | 165.8 | 26.5 | -29.4 | 0 | 0 | 0 | 109.9 | R4 T5 | P2-R4 PolarHBondContact O-N 2.69Å; P2-T5 PolarHBondContact O-N 3.18Å; P2-T5 PolarHBondContact O-OG1 2.76Å; P2-T5 VanDerWaalsContact O-OG1 3.1Å | ||
| 3 | R | 52.8 | Low | 50.1 | Low | 230 Ų | 230 | 128.2 Ų | 128.2 | 87% | 0.868 | 62% | 0.616 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -50 | -18.9 | -171.6 | -160.4 | 173 | -175.9 | 171.6 | 0.8 | 115.8 | M1 T7 | M1-R3 PolarHBondContact O-N 3.08Å; R3-T7 PolarHBondContact O-OG1 2.73Å |
| 4 | R | 49.4 | Very low | 50.3 | Low | 226 Ų | 226 | 126.1 Ų | 126.1 | 85% | 0.853 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -70.9 | -29.6 | -178.8 | -88.5 | -173.8 | 174.5 | 175.3 | -0.8 | 115 | P2 | P2-R4 PolarHBondContact O-N 2.69Å |
| 5 | T | 49.5 | Very low | 50.2 | Low | 73 Ų | 73 | 129.9 Ų | 129.9 | 45% | 0.448 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -78 | -34.9 | -178.3 | 23.6 | 0 | 0 | 0 | 0 | 112.7 | P2 R8 I9 | P2-T5 PolarHBondContact O-N 3.18Å; P2-T5 PolarHBondContact O-OG1 2.76Å; P2-T5 VanDerWaalsContact O-OG1 3.1Å; T5-R8 PolarHBondContact O-N 3.44Å; T5-I9 WeakPolarHBondContact O-CG1 3.37Å; T5-I9 PolarHBondContact O-N 2.81Å |
| 6 | Q | 47.5 | Very low | 50.4 | Low | 89 Ų | 89 | 125.8 Ų | 125.8 | 42% | 0.416 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -63.3 | -48 | 178.9 | -168.4 | 59.8 | 49.9 | 0 | 0 | 111.5 | R8 I9 D10 | Q6-R8 PolarHBondContact O-N 2.83Å; Q6-R8 VanDerWaalsContact O-N 3.16Å; Q6-I9 WeakPolarHBondContact O-CA 2.92Å; Q6-I9 WeakPolarHBondContact O-CB 3.27Å; Q6-I9 PolarHBondContact O-N 3.04Å; Q6-D10 PolarHBondContact NE2-OD1 3.46Å; Q6-D10 PolarHBondContact O-N 2.95Å |
| 7 | T | 52.7 | Low | 50.3 | Low | 74 Ų | 74 | 125.6 Ų | 125.6 | 45% | 0.454 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -59.4 | -32.1 | 178.4 | -46.3 | 0 | 0 | 0 | 0 | 113.1 | R3 N11 | R3-T7 PolarHBondContact O-OG1 2.73Å; T7-N11 WeakPolarHBondContact O-CB 3.27Å; T7-N11 PolarHBondContact O-N 2.94Å |
| 8 | R | 50.3 | Low | 50.2 | Low | 205 Ų | 205 | 126.7 Ų | 126.7 | 77% | 0.774 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -68.8 | -40.4 | 174.1 | -95.3 | -177 | 160.4 | -178.3 | -5.2 | 112.1 | T5 Q6 L12 | T5-R8 PolarHBondContact O-N 3.44Å; Q6-R8 PolarHBondContact O-N 2.83Å; Q6-R8 VanDerWaalsContact O-N 3.16Å; R8-L12 WeakPolarHBondContact O-CB 3.39Å; R8-L12 PolarHBondContact O-N 3.41Å |
| 9 | I | 54.1 | Low | 50.2 | Low | 97 Ų | 97 | 124.2 Ų | 124.2 | 50% | 0.497 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -67.5 | -43.8 | 176.9 | -64.9 | 166.8 | 0 | 0 | 0 | 109.8 | T5 Q6 N11 L12 C13 | T5-I9 WeakPolarHBondContact O-CG1 3.37Å; T5-I9 PolarHBondContact O-N 2.81Å; Q6-I9 WeakPolarHBondContact O-CA 2.92Å; Q6-I9 WeakPolarHBondContact O-CB 3.27Å; Q6-I9 PolarHBondContact O-N 3.04Å; I9-N11 PolarHBondContact O-N 2.83Å; I9-L12 PolarHBondContact O-N 3.15Å; I9-C13 WeakPolarHBondContact O-CB 3.46Å; I9-C13 PolarHBondContact O-N 2.97Å |
| 10 | D | 53.1 | Low | 50.1 | Low | 73 Ų | 73 | 122.5 Ų | 122.5 | 39% | 0.39 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -61.2 | -46.3 | 177.8 | -56.7 | -27.7 | 0 | 0 | 0 | 110.6 | Q6 L12 C13 V14 | Q6-D10 PolarHBondContact NE2-OD1 3.46Å; Q6-D10 PolarHBondContact O-N 2.95Å; D10-L12 VanDerWaalsContact C-N 3.33Å; D10-L12 PolarHBondContact O-N 2.92Å; D10-C13 PolarHBondContact O-N 3.1Å; D10-V14 WeakPolarHBondContact O-CG2 3.2Å; D10-V14 PolarHBondContact O-N 2.75Å |
| 11 | N | 51.6 | Low | 49.8 | Very low | 109 Ų | 109 | 118.3 Ų | 118.3 | 58% | 0.583 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -64.5 | -34.9 | 176.2 | -80.6 | -12.9 | 0 | 0 | 0 | 113 | T7 I9 R15 | T7-N11 WeakPolarHBondContact O-CB 3.27Å; T7-N11 PolarHBondContact O-N 2.94Å; I9-N11 PolarHBondContact O-N 2.83Å; N11-R15 VanDerWaalsContact O-CB 3.24Å; N11-R15 WeakPolarHBondContact O-CB 2.93Å; N11-R15 PolarHBondContact O-N 3.21Å |
| 12 | L | 52.5 | Low | 50 | Low | 125 Ų | 125 | 113.3 Ų | 113.3 | 65% | 0.654 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -68.7 | -42.1 | 176.2 | -152.3 | 96.2 | 0 | 0 | 0 | 110.7 | R8 I9 D10 R15 T16 | R8-L12 WeakPolarHBondContact O-CB 3.39Å; R8-L12 PolarHBondContact O-N 3.41Å; I9-L12 PolarHBondContact O-N 3.15Å; D10-L12 VanDerWaalsContact C-N 3.33Å; D10-L12 PolarHBondContact O-N 2.92Å; L12-R15 PolarHBondContact O-N 3.23Å; L12-T16 WeakPolarHBondContact O-CG2 3.2Å; L12-T16 PolarHBondContact O-N 3.1Å; L12-T16 PolarHBondContact O-OG1 3.07Å |
| 13 | C | 50.3 | Low | 50 | Low | 60 Ų | 60 | 116 Ų | 116 | 41% | 0.405 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -65.2 | -42.6 | 178.1 | -168 | 0 | 0 | 0 | 0 | 111.9 | I9 D10 T16 H17 | I9-C13 WeakPolarHBondContact O-CB 3.46Å; I9-C13 PolarHBondContact O-N 2.97Å; D10-C13 PolarHBondContact O-N 3.1Å; C13-T16 WeakPolarHBondContact CA-OG1 3.29Å; C13-T16 PolarHBondContact O-N 2.7Å; C13-T16 PolarHBondContact O-OG1 2.94Å; C13-H17 WeakPolarHBondContact O-CB 3.46Å; C13-H17 PolarHBondContact O-N 3.02Å; C13-H17 PolarHBondContact O-ND1 3.35Å |
| 14 | V | 52.3 | Low | 49.4 | Very low | 98 Ų | 98 | 108.4 Ų | 108.4 | 59% | 0.594 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -65.6 | -40.8 | 174.7 | 174.1 | 0 | 0 | 0 | 0 | 110.6 | D10 H17 Y18 | D10-V14 WeakPolarHBondContact O-CG2 3.2Å; D10-V14 PolarHBondContact O-N 2.75Å; V14-H17 CarbonylContact O-C 3.57Å; V14-H17 PolarHBondContact O-N 3.43Å; V14-Y18 PolarHBondContact O-N 2.94Å |
| 15 | R | 48.2 | Very low | 49 | Very low | 184 Ų | 184 | 104.6 Ų | 104.6 | 69% | 0.694 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -68.5 | -36.7 | 178.8 | -170.3 | 172 | 169.3 | 164.2 | -2.5 | 112.4 | N11 L12 Y18 I19 | N11-R15 VanDerWaalsContact O-CB 3.24Å; N11-R15 WeakPolarHBondContact O-CB 2.93Å; N11-R15 PolarHBondContact O-N 3.21Å; L12-R15 PolarHBondContact O-N 3.23Å; R15-Y18 PolarHBondContact O-N 3.34Å; R15-I19 HydrophobicContact CG-CD1 4.25Å; R15-I19 VanDerWaalsContact O-CG1 3.3Å; R15-I19 WeakPolarHBondContact O-CG1 3.06Å; R15-I19 PolarHBondContact O-N 2.91Å |
| 16 | T | 53.8 | Low | 48.6 | Very low | 63 Ų | 63 | 111.1 Ų | 111.1 | 39% | 0.387 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -67.8 | -38.8 | 171.2 | 51.8 | 0 | 0 | 0 | 0 | 111.1 | L12 C13 Y18 I19 I20 | L12-T16 WeakPolarHBondContact O-CG2 3.2Å; L12-T16 PolarHBondContact O-N 3.1Å; L12-T16 PolarHBondContact O-OG1 3.07Å; C13-T16 WeakPolarHBondContact CA-OG1 3.29Å; C13-T16 PolarHBondContact O-N 2.7Å; C13-T16 PolarHBondContact O-OG1 2.94Å; T16-Y18 VanDerWaalsContact C-N 3.33Å; T16-Y18 PolarHBondContact O-N 3.26Å; T16-I19 PolarHBondContact O-N 3.49Å; T16-I20 VanDerWaalsContact O-CB 3.3Å; T16-I20 WeakPolarHBondContact O-CB 3.36Å; T16-I20 WeakPolarHBondContact O-CD1 3.31Å; T16-I20 WeakPolarHBondContact O-CG1 3.43Å; T16-I20 PolarHBondContact O-N 2.96Å |
| 17 | H | 49.4 | Very low | 48.3 | Very low | 124 Ų | 124 | 110.8 Ų | 110.8 | 57% | 0.574 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -63.6 | -34.4 | 172.8 | -81.3 | 78.7 | 0 | 0 | 0 | 112.9 | C13 V14 G21 | C13-H17 WeakPolarHBondContact O-CB 3.46Å; C13-H17 PolarHBondContact O-N 3.02Å; C13-H17 PolarHBondContact O-ND1 3.35Å; V14-H17 CarbonylContact O-C 3.57Å; V14-H17 PolarHBondContact O-N 3.43Å; H17-G21 VanDerWaalsContact O-CA 3.28Å; H17-G21 WeakPolarHBondContact O-CA 3.42Å; H17-G21 PolarHBondContact O-N 3.13Å |
| 18 | Y | 47.9 | Very low | 47.6 | Very low | 144 Ų | 144 | 113.1 Ų | 113.1 | 57% | 0.565 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -71.7 | -39.9 | 175 | -168.9 | -95.8 | 0 | 0 | 0 | 111.6 | V14 R15 T16 G21 E22 | V14-Y18 PolarHBondContact O-N 2.94Å; R15-Y18 PolarHBondContact O-N 3.34Å; T16-Y18 VanDerWaalsContact C-N 3.33Å; T16-Y18 PolarHBondContact O-N 3.26Å; Y18-G21 PolarHBondContact O-N 3.22Å; Y18-E22 HydrophobicContact CD1-CG 4.21Å; Y18-E22 HydrophobicContact CE1-CG 3.7Å; Y18-E22 VanDerWaalsContact CE1-OE1 3.32Å; Y18-E22 WeakPolarHBondContact CE1-OE1 3.3Å; Y18-E22 WeakPolarHBondContact CE1-OE2 3.27Å; Y18-E22 HydrophobicContact CE2-CG 4.44Å; Y18-E22 VanDerWaalsContact CZ-CD 3.48Å; Y18-E22 WeakPolarHBondContact O-CB 3.33Å; Y18-E22 PolarHBondContact O-N 2.78Å; Y18-E22 PolarHBondContact OH-OE1 2.86Å |
| 19 | I | 49.6 | Very low | 47.3 | Very low | 80 Ų | 80 | 109.2 Ų | 109.2 | 41% | 0.41 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -68.6 | -38.9 | 175.6 | -65.1 | 165.2 | 0 | 0 | 0 | 111.1 | R15 T16 R23 | R15-I19 HydrophobicContact CG-CD1 4.25Å; R15-I19 VanDerWaalsContact O-CG1 3.3Å; R15-I19 WeakPolarHBondContact O-CG1 3.06Å; R15-I19 PolarHBondContact O-N 2.91Å; T16-I19 PolarHBondContact O-N 3.49Å; I19-R23 WeakPolarHBondContact O-CB 3.19Å; I19-R23 VanDerWaalsContact O-CG 3.25Å; I19-R23 WeakPolarHBondContact O-CG 3.32Å; I19-R23 PolarHBondContact O-N 2.78Å |
| 20 | I | 49.8 | Very low | 46.6 | Very low | 90 Ų | 90 | 112.7 Ų | 112.7 | 46% | 0.462 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -70.2 | -39.1 | 174.1 | -65.1 | 162.7 | 0 | 0 | 0 | 109.6 | T16 R23 N24 | T16-I20 VanDerWaalsContact O-CB 3.3Å; T16-I20 WeakPolarHBondContact O-CB 3.36Å; T16-I20 WeakPolarHBondContact O-CD1 3.31Å; T16-I20 WeakPolarHBondContact O-CG1 3.43Å; T16-I20 PolarHBondContact O-N 2.96Å; I20-R23 CarbonylContact O-C 3.59Å; I20-R23 PolarHBondContact O-N 3.34Å; I20-N24 WeakPolarHBondContact O-CA 3.28Å; I20-N24 WeakPolarHBondContact O-CB 3.45Å; I20-N24 PolarHBondContact O-N 2.8Å; I20-N24 PolarHBondContact O-OD1 3.44Å |
| 21 | G | 42.5 | Very low | 45.9 | Very low | 34 Ų | 34 | 112.2 Ų | 112.2 | 35% | 0.351 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -66.2 | -48 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | H17 Y18 N24 E25 | H17-G21 VanDerWaalsContact O-CA 3.28Å; H17-G21 WeakPolarHBondContact O-CA 3.42Å; H17-G21 PolarHBondContact O-N 3.13Å; Y18-G21 PolarHBondContact O-N 3.22Å; G21-N24 CarbonylContact O-C 3.58Å; G21-N24 PolarHBondContact O-N 3.36Å; G21-E25 WeakPolarHBondContact O-CB 3.38Å; G21-E25 PolarHBondContact O-N 3.4Å |
| 22 | E | 47.1 | Very low | 45.8 | Very low | 100 Ų | 100 | 110.4 Ų | 110.4 | 47% | 0.467 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -67.3 | -35.9 | 172.8 | -82.5 | -172.3 | 142.2 | 0 | 0 | 111.9 | Y18 N24 R26 | Y18-E22 HydrophobicContact CD1-CG 4.21Å; Y18-E22 HydrophobicContact CE1-CG 3.7Å; Y18-E22 VanDerWaalsContact CE1-OE1 3.32Å; Y18-E22 WeakPolarHBondContact CE1-OE1 3.3Å; Y18-E22 WeakPolarHBondContact CE1-OE2 3.27Å; Y18-E22 HydrophobicContact CE2-CG 4.44Å; Y18-E22 VanDerWaalsContact CZ-CD 3.48Å; Y18-E22 WeakPolarHBondContact O-CB 3.33Å; Y18-E22 PolarHBondContact O-N 2.78Å; Y18-E22 PolarHBondContact OH-OE1 2.86Å; E22-N24 VanDerWaalsContact C-N 3.32Å; E22-R26 PolarHBondContact O-N 2.83Å; E22-R26 VanDerWaalsContact O-N 3.1Å |
| 23 | R | 44.4 | Very low | 45.2 | Very low | 159 Ų | 159 | 109.9 Ų | 109.9 | 60% | 0.6 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -67.6 | -35.8 | 171.6 | -79.5 | -177.3 | 164 | -165.3 | -5 | 111.5 | I19 I20 R26 T27 | I19-R23 WeakPolarHBondContact O-CB 3.19Å; I19-R23 VanDerWaalsContact O-CG 3.25Å; I19-R23 WeakPolarHBondContact O-CG 3.32Å; I19-R23 PolarHBondContact O-N 2.78Å; I20-R23 CarbonylContact O-C 3.59Å; I20-R23 PolarHBondContact O-N 3.34Å; R23-R26 CarbonylContact O-C 3.49Å; R23-R26 PolarHBondContact O-N 3.24Å; R23-T27 PolarHBondContact O-N 2.92Å; R23-T27 PolarHBondContact O-OG1 2.69Å; R23-T27 VanDerWaalsContact O-OG1 3.07Å |
| 24 | N | 40.8 | Very low | 45 | Very low | 70 Ų | 70 | 111.6 Ų | 111.6 | 37% | 0.374 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -73.7 | -29.9 | 176.9 | -79.2 | 0.8 | 0 | 0 | 0 | 112.5 | I20 G21 E22 R26 T27 H28 | I20-N24 WeakPolarHBondContact O-CA 3.28Å; I20-N24 WeakPolarHBondContact O-CB 3.45Å; I20-N24 PolarHBondContact O-N 2.8Å; I20-N24 PolarHBondContact O-OD1 3.44Å; G21-N24 CarbonylContact O-C 3.58Å; G21-N24 PolarHBondContact O-N 3.36Å; E22-N24 VanDerWaalsContact C-N 3.32Å; N24-R26 VanDerWaalsContact C-N 3.26Å; N24-T27 VanDerWaalsContact CA-OG1 3.31Å; N24-T27 WeakPolarHBondContact CA-OG1 3.41Å; N24-T27 CarbonylContact O-C 3.55Å; N24-T27 PolarHBondContact O-N 3.32Å; N24-H28 WeakPolarHBondContact O-CB 3.3Å; N24-H28 PolarHBondContact O-CD2 2.78Å; N24-H28 PolarHBondContact O-N 3.02Å |
| 25 | E | 40.5 | Very low | 44.7 | Very low | 146 Ų | 146 | 113.8 Ų | 113.8 | 68% | 0.682 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -70.8 | -28.7 | 169.7 | -151.8 | -179.6 | 157.4 | 0 | 0 | 110.5 | G21 H28 | G21-E25 WeakPolarHBondContact O-CB 3.38Å; G21-E25 PolarHBondContact O-N 3.4Å; E25-H28 WeakPolarHBondContact O-CB 3.13Å |
| 26 | R | 42.1 | Very low | 44.5 | Very low | 209 Ų | 209 | 107.9 Ų | 107.9 | 79% | 0.789 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -81.7 | -28.7 | 172.9 | -139.6 | 174.7 | -167.3 | 175.3 | 3.7 | 113.6 | E22 R23 N24 | E22-R26 PolarHBondContact O-N 2.83Å; E22-R26 VanDerWaalsContact O-N 3.1Å; R23-R26 CarbonylContact O-C 3.49Å; R23-R26 PolarHBondContact O-N 3.24Å; N24-R26 VanDerWaalsContact C-N 3.26Å |
| 27 | T | 41.9 | Very low | 44.4 | Very low | 83 Ų | 83 | 108.4 Ų | 108.4 | 51% | 0.509 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -91.1 | -2 | 172.3 | 54.9 | 0 | 0 | 0 | 0 | 113.4 | R23 N24 I29 | R23-T27 PolarHBondContact O-N 2.92Å; R23-T27 PolarHBondContact O-OG1 2.69Å; R23-T27 VanDerWaalsContact O-OG1 3.07Å; N24-T27 VanDerWaalsContact CA-OG1 3.31Å; N24-T27 WeakPolarHBondContact CA-OG1 3.41Å; N24-T27 CarbonylContact O-C 3.55Å; N24-T27 PolarHBondContact O-N 3.32Å; T27-I29 PolarHBondContact O-N 2.95Å |
| 28 | H | 38.1 | Very low | 44.6 | Very low | 123 Ų | 123 | 111.7 Ų | 111.7 | 57% | 0.569 | 56% | 0.559 | S | S | * | * | trans | -59.7 | 10.9 | 153.4 | -117.4 | -109.2 | 0 | 0 | 0 | 113.2 | N24 E25 | N24-H28 WeakPolarHBondContact O-CB 3.3Å; N24-H28 PolarHBondContact O-CD2 2.78Å; N24-H28 PolarHBondContact O-N 3.02Å; E25-H28 WeakPolarHBondContact O-CB 3.13Å | ||
| 29 | I | 42.3 | Very low | 44.7 | Very low | 122 Ų | 122 | 114.3 Ų | 114.3 | 63% | 0.626 | 57% | 0.568 | S | S | * | * | S | Bend | trans | -109.9 | 81 | 167.8 | -48.4 | 175.5 | 0 | 0 | 0 | 107.5 | T27 | T27-I29 PolarHBondContact O-N 2.95Š|
| 30 | K | 39.9 | Very low | 44.9 | Very low | 171 Ų | 171 | 117.6 Ų | 117.6 | 74% | 0.743 | 58% | 0.576 | S | S | * | * | trans | 61.2 | 107.1 | 136.4 | -60.5 | 174.2 | -179.5 | 178.9 | 0 | 118.5 | ||||
| 31 | N | 38.5 | Very low | 45.2 | Very low | 63 Ų | 63 | 117.1 Ų | 117.1 | 34% | 0.337 | 58% | 0.575 | S | S | . | * | S | Bend | -42.9 | 145 | 88.3 | -80.1 | 0.9 | 0 | 0 | 0 | 113 | T33 D36 | N31-T33 VanDerWaalsContact C-N 3.27Å; N31-T33 WeakPolarHBondContact CB-O 3.48Å; N31-T33 PolarHBondContact O-N 3.36Å; N31-D36 VanDerWaalsContact CG-CG 3.44Å; N31-D36 VanDerWaalsContact ND2-CB 3.27Å; N31-D36 WeakPolarHBondContact ND2-CB 3.25Å; N31-D36 PolarHBondContact ND2-OD1 3.19Å; N31-D36 VanDerWaalsContact OD1-CG 3.26Å; N31-D36 PolarHBondContact OD1-OD2 3.48Å | |
| 32 | G | 49.9 | Very low | 46.1 | Very low | 71 Ų | 71 | 118.9 Ų | 118.9 | 73% | 0.732 | 58% | 0.58 | S | S | * | * | S | Bend | trans | -49 | 109.4 | 151.4 | 0 | 0 | 0 | 0 | 0 | 106.1 | ||
| 33 | T | 38.9 | Very low | 46.8 | Very low | 113 Ų | 113 | 119.7 Ų | 119.7 | 69% | 0.693 | 59% | 0.588 | S | S | * | * | S | Bend | trans | 63.1 | 140.7 | -170.1 | 46.4 | 0 | 0 | 0 | 0 | 119.3 | N31 D35 | N31-T33 VanDerWaalsContact C-N 3.27Å; N31-T33 WeakPolarHBondContact CB-O 3.48Å; N31-T33 PolarHBondContact O-N 3.36Å; T33-D35 PolarHBondContact O-N 2.85Å; T33-D35 VanDerWaalsContact O-N 3.08Å |
| 34 | D | 46.4 | Very low | 47.6 | Very low | 96 Ų | 96 | 116.6 Ų | 116.6 | 51% | 0.513 | 58% | 0.583 | S | S | . | * | S | Bend | trans | -69.9 | 34 | -155.6 | -61.6 | -81.1 | 0 | 0 | 0 | 121.8 | I37 | D34-I37 HydrophobicContact CB-CD1 4.34Š|
| 35 | D | 47.1 | Very low | 48.6 | Very low | 144 Ų | 144 | 115.5 Ų | 115.5 | 77% | 0.77 | 58% | 0.575 | S | S | * | * | trans | -92.7 | -7.5 | -175.1 | -74.5 | -49.1 | 0 | 0 | 0 | 116.9 | T33 | T33-D35 PolarHBondContact O-N 2.85Å; T33-D35 VanDerWaalsContact O-N 3.08Å | ||
| 36 | D | 43.2 | Very low | 49.7 | Very low | 61 Ų | 61 | 114.3 Ų | 114.3 | 33% | 0.326 | 57% | 0.57 | S | S | . | * | trans | -93 | 4.7 | -176.1 | -97.3 | 30.3 | 0 | 0 | 0 | 115 | N31 F38 R39 | N31-D36 VanDerWaalsContact CG-CG 3.44Å; N31-D36 VanDerWaalsContact ND2-CB 3.27Å; N31-D36 WeakPolarHBondContact ND2-CB 3.25Å; N31-D36 PolarHBondContact ND2-OD1 3.19Å; N31-D36 VanDerWaalsContact OD1-CG 3.26Å; N31-D36 PolarHBondContact OD1-OD2 3.48Å; D36-F38 PolarHBondContact O-N 3.18Å; D36-R39 WeakPolarHBondContact O-CG 3.27Å; D36-R39 PolarHBondContact O-N 3.4Å; D36-R39 IonicContact OD2-CZ 3.76Å; D36-R39 IonicContact OD2-NH1 2.76Å; D36-R39 PolarHBondContact OD2-NH1 3.43Å | ||
| 37 | I | 52.9 | Low | 51 | Low | 74 Ų | 74 | 110.7 Ų | 110.7 | 38% | 0.379 | 56% | 0.563 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -58.7 | -20.1 | -173.6 | -65.7 | 172.3 | 0 | 0 | 0 | 112.6 | D34 R39 | D34-I37 HydrophobicContact CB-CD1 4.34Å; I37-R39 VanDerWaalsContact C-N 3.34Å; I37-R39 PolarHBondContact O-N 2.89Å |
| 38 | F | 53.3 | Low | 52.5 | Low | 192 Ų | 192 | 111.2 Ų | 111.2 | 84% | 0.842 | 56% | 0.563 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.4 | 31.3 | 176.3 | -59.4 | -77.5 | 0 | 0 | 0 | 114.1 | D36 Y40 | D36-F38 PolarHBondContact O-N 3.18Å; F38-Y40 PolarHBondContact O-N 3.49Å |
| 39 | R | 49.9 | Very low | 54.3 | Low | 200 Ų | 200 | 108.4 Ų | 108.4 | 76% | 0.755 | 55% | 0.551 | S | S | * | * | trans | -66.8 | 83.6 | 165.7 | -75.2 | 176.1 | 100.3 | 128.3 | -0.2 | 109.9 | D36 I37 D41 | D36-R39 WeakPolarHBondContact O-CG 3.27Å; D36-R39 PolarHBondContact O-N 3.4Å; D36-R39 IonicContact OD2-CZ 3.76Å; D36-R39 IonicContact OD2-NH1 2.76Å; D36-R39 PolarHBondContact OD2-NH1 3.43Å; I37-R39 VanDerWaalsContact C-N 3.34Å; I37-R39 PolarHBondContact O-N 2.89Å; R39-D41 PolarHBondContact O-N 2.75Å; R39-D41 VanDerWaalsContact O-N 3.15Å | ||
| 40 | Y | 53.2 | Low | 55.9 | Low | 149 Ų | 149 | 107.7 Ų | 107.7 | 58% | 0.584 | 55% | 0.547 | S | S | * | . | trans | -52.5 | 108.8 | 168.2 | -179.1 | -86.8 | 0 | 0 | 0 | 109.6 | F38 P42 H45 | F38-Y40 PolarHBondContact O-N 3.49Å; Y40-P42 VanDerWaalsContact O-CD 3.29Å; Y40-P42 WeakPolarHBondContact O-CD 3.49Å; Y40-H45 HydrophobicContact CD1-CB 4.48Å; Y40-H45 AromaticContact CD2-ND1 3.85Å; Y40-H45 HydrophobicContact CE1-CB 3.8Å; Y40-H45 AromaticContact CE1-CG 3.73Å; Y40-H45 AromaticContact CE1-ND1 3.96Å; Y40-H45 HydrophobicContact CE2-CB 4.3Å; Y40-H45 AromaticContact CE2-CE1 3.27Å; Y40-H45 WeakPolarHBondContact CE2-CE1 3.42Å; Y40-H45 AromaticContact CE2-CG 3.61Å; Y40-H45 AromaticContact CE2-ND1 2.93Å; Y40-H45 WeakPolarHBondContact CE2-ND1 3.46Å; Y40-H45 AromaticContact CZ-CD2 3.59Å; Y40-H45 AromaticContact CZ-CE1 3.36Å; Y40-H45 AromaticContact CZ-CG 3.15Å; Y40-H45 AromaticContact CZ-ND1 3.03Å; Y40-H45 AromaticContact CZ-NE2 3.73Å; Y40-H45 PolarHBondContact OH-CD2 2.94Å; Y40-H45 PolarHBondContact OH-CE1 2.89Å; Y40-H45 PolarHBondContact OH-ND1 2.76Å; Y40-H45 VanDerWaalsContact OH-ND1 3.1Å; Y40-H45 PolarHBondContact OH-NE2 2.87Å | ||
| 41 | D | 57.4 | Low | 57.7 | Low | 79 Ų | 79 | 103.6 Ų | 103.6 | 42% | 0.422 | 54% | 0.537 | S | S | . | . | trans | -82.6 | 112 | 174.3 | -169 | -45.1 | 0 | 0 | 0 | 109 | R39 N43 N44 H45 | R39-D41 PolarHBondContact O-N 2.75Å; R39-D41 VanDerWaalsContact O-N 3.15Å; D41-N43 PolarHBondContact O-N 3.47Å; D41-N43 WeakPolarHBondContact OD1-CB 3.17Å; D41-N43 PolarHBondContact OD1-N 2.9Å; D41-N43 PolarHBondContact OD1-ND2 2.99Å; D41-N44 HydrophobicContact CB-CB 4.28Å; D41-N44 PolarHBondContact O-N 3.33Å; D41-H45 WeakPolarHBondContact O-CB 3.42Å; D41-H45 PolarHBondContact O-N 3.15Å | ||
| 42 | P | 61.4 | Low | 59.7 | Low | 72 Ų | 72 | 104.6 Ų | 104.6 | 47% | 0.468 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -63.5 | -24.5 | -177.2 | 25.3 | -33.5 | 0 | 0 | 0 | 113.2 | Y40 H45 H46 | Y40-P42 VanDerWaalsContact O-CD 3.29Å; Y40-P42 WeakPolarHBondContact O-CD 3.49Å; P42-H45 PolarHBondContact O-N 2.95Å; P42-H46 PolarHBondContact O-N 2.83Å |
| 43 | N | 61.4 | Low | 61 | Low | 117 Ų | 117 | 106.7 Ų | 106.7 | 63% | 0.626 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -73.6 | -40.2 | 178.4 | -62 | -56.8 | 0 | 0 | 0 | 111.4 | D41 H45 | D41-N43 PolarHBondContact O-N 3.47Å; D41-N43 WeakPolarHBondContact OD1-CB 3.17Å; D41-N43 PolarHBondContact OD1-N 2.9Å; D41-N43 PolarHBondContact OD1-ND2 2.99Å; N43-H45 VanDerWaalsContact C-N 3.27Å |
| 44 | N | 60.1 | Low | 62.8 | Low | 94 Ų | 94 | 104.3 Ų | 104.3 | 50% | 0.503 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -69.3 | -32.1 | 171 | -71.3 | 8.7 | 0 | 0 | 0 | 110.9 | D41 M47 L48 | D41-N44 HydrophobicContact CB-CB 4.28Å; D41-N44 PolarHBondContact O-N 3.33Å; N44-M47 PolarHBondContact O-N 3.27Å; N44-L48 PolarHBondContact O-N 2.89Å |
| 45 | H | 62.4 | Low | 64.4 | Low | 46 Ų | 46 | 107.3 Ų | 107.3 | 21% | 0.213 | 53% | 0.526 | C | S | . | . | H | α-helix | trans | -68.7 | -40.3 | 179.5 | -162.1 | 88.8 | 0 | 0 | 0 | 112.9 | Y40 D41 P42 N43 M47 L48 I49 | Y40-H45 HydrophobicContact CD1-CB 4.48Å; Y40-H45 AromaticContact CD2-ND1 3.85Å; Y40-H45 HydrophobicContact CE1-CB 3.8Å; Y40-H45 AromaticContact CE1-CG 3.73Å; Y40-H45 AromaticContact CE1-ND1 3.96Å; Y40-H45 HydrophobicContact CE2-CB 4.3Å; Y40-H45 AromaticContact CE2-CE1 3.27Å; Y40-H45 WeakPolarHBondContact CE2-CE1 3.42Å; Y40-H45 AromaticContact CE2-CG 3.61Å; Y40-H45 AromaticContact CE2-ND1 2.93Å; Y40-H45 WeakPolarHBondContact CE2-ND1 3.46Å; Y40-H45 AromaticContact CZ-CD2 3.59Å; Y40-H45 AromaticContact CZ-CE1 3.36Å; Y40-H45 AromaticContact CZ-CG 3.15Å; Y40-H45 AromaticContact CZ-ND1 3.03Å; Y40-H45 AromaticContact CZ-NE2 3.73Å; Y40-H45 PolarHBondContact OH-CD2 2.94Å; Y40-H45 PolarHBondContact OH-CE1 2.89Å; Y40-H45 PolarHBondContact OH-ND1 2.76Å; Y40-H45 VanDerWaalsContact OH-ND1 3.1Å; Y40-H45 PolarHBondContact OH-NE2 2.87Å; D41-H45 WeakPolarHBondContact O-CB 3.42Å; D41-H45 PolarHBondContact O-N 3.15Å; P42-H45 PolarHBondContact O-N 2.95Å; N43-H45 VanDerWaalsContact C-N 3.27Å; H45-M47 VanDerWaalsContact C-N 3.28Å; H45-M47 PolarHBondContact O-N 3.42Å; H45-L48 CarbonylContact O-C 3.51Å; H45-L48 WeakPolarHBondContact O-CB 3.3Å; H45-L48 PolarHBondContact O-N 3.3Å; H45-L48 VanDerWaalsContact O-N 3.13Å; H45-I49 WeakPolarHBondContact CD2-CD1 3.46Å; H45-I49 WeakPolarHBondContact CD2-CG1 3.46Å; H45-I49 VanDerWaalsContact NE2-CD1 3.3Å; H45-I49 WeakPolarHBondContact NE2-CD1 3.36Å; H45-I49 VanDerWaalsContact NE2-CG1 3.27Å; H45-I49 WeakPolarHBondContact NE2-CG1 3.48Å; H45-I49 WeakPolarHBondContact O-CG1 3.44Å; H45-I49 PolarHBondContact O-N 2.72Å |
| 46 | H | 64 | Low | 65.9 | Low | 122 Ų | 122 | 105 Ų | 105 | 57% | 0.565 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -57.1 | -43.4 | 172.8 | -82 | 141.6 | 0 | 0 | 0 | 111.7 | P42 L48 I49 I50 | P42-H46 PolarHBondContact O-N 2.83Å; H46-L48 VanDerWaalsContact C-N 3.35Å; H46-L48 PolarHBondContact O-N 3.33Å; H46-I49 PolarHBondContact O-N 3.46Å; H46-I50 WeakPolarHBondContact O-CB 3.23Å; H46-I50 WeakPolarHBondContact O-CD1 3.09Å; H46-I50 WeakPolarHBondContact O-CG1 3.32Å; H46-I50 PolarHBondContact O-N 3.47Å |
| 47 | M | 69.2 | Low | 67.7 | Low | 133 Ų | 133 | 107.8 Ų | 107.8 | 66% | 0.655 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -65.5 | -38.5 | 176.4 | -166.5 | 179.4 | -65.4 | 0 | 0 | 112 | N44 H45 I50 T51 | N44-M47 PolarHBondContact O-N 3.27Å; H45-M47 VanDerWaalsContact C-N 3.28Å; H45-M47 PolarHBondContact O-N 3.42Å; M47-I50 PolarHBondContact O-N 2.71Å; M47-T51 WeakPolarHBondContact O-CB 3.32Å; M47-T51 PolarHBondContact O-N 3.42Å; M47-T51 PolarHBondContact O-OG1 2.87Å |
| 48 | L | 73.9 | Confident | 68.8 | Low | 94 Ų | 94 | 113.8 Ų | 113.8 | 49% | 0.492 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -63.8 | -47.1 | 174.8 | -168.2 | 77.2 | 0 | 0 | 0 | 111.4 | N44 H45 H46 I50 T51 I52 | N44-L48 PolarHBondContact O-N 2.89Å; H45-L48 CarbonylContact O-C 3.51Å; H45-L48 WeakPolarHBondContact O-CB 3.3Å; H45-L48 PolarHBondContact O-N 3.3Å; H45-L48 VanDerWaalsContact O-N 3.13Å; H46-L48 VanDerWaalsContact C-N 3.35Å; H46-L48 PolarHBondContact O-N 3.33Å; L48-I50 PolarHBondContact O-N 3.46Å; L48-T51 WeakPolarHBondContact O-CB 3.4Å; L48-T51 PolarHBondContact O-N 3.18Å; L48-I52 HydrophobicContact CD2-CD1 4.23Å; L48-I52 HydrophobicContact CG-CD1 3.87Å; L48-I52 WeakPolarHBondContact O-CB 3.45Å; L48-I52 VanDerWaalsContact O-CG1 3.27Å; L48-I52 WeakPolarHBondContact O-CG1 3.28Å; L48-I52 PolarHBondContact O-N 3.48Å |
| 49 | I | 75.4 | Confident | 70 | Confident | 63 Ų | 63 | 106.5 Ų | 106.5 | 32% | 0.323 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -58.2 | -48.8 | 174.4 | -69.8 | 177.2 | 0 | 0 | 0 | 109.8 | H45 H46 T51 I52 M53 | H45-I49 WeakPolarHBondContact CD2-CD1 3.46Å; H45-I49 WeakPolarHBondContact CD2-CG1 3.46Å; H45-I49 VanDerWaalsContact NE2-CD1 3.3Å; H45-I49 WeakPolarHBondContact NE2-CD1 3.36Å; H45-I49 VanDerWaalsContact NE2-CG1 3.27Å; H45-I49 WeakPolarHBondContact NE2-CG1 3.48Å; H45-I49 WeakPolarHBondContact O-CG1 3.44Å; H45-I49 PolarHBondContact O-N 2.72Å; H46-I49 PolarHBondContact O-N 3.46Å; I49-T51 PolarHBondContact O-N 3.02Å; I49-I52 PolarHBondContact O-N 2.77Å; I49-M53 HydrophobicContact CG2-CE 4.28Å; I49-M53 HydrophobicContact CG2-CG 3.82Å; I49-M53 VanDerWaalsContact O-CB 3.32Å; I49-M53 WeakPolarHBondContact O-CB 3.32Å; I49-M53 VanDerWaalsContact O-CG 3.23Å; I49-M53 WeakPolarHBondContact O-CG 3.21Å; I49-M53 PolarHBondContact O-N 2.85Å |
| 50 | I | 75.7 | Confident | 71.1 | Confident | 107 Ų | 107 | 104.5 Ų | 104.5 | 55% | 0.549 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -58.2 | -41.2 | 179.4 | -69.4 | 163 | 0 | 0 | 0 | 110.4 | H46 M47 L48 S54 | H46-I50 WeakPolarHBondContact O-CB 3.23Å; H46-I50 WeakPolarHBondContact O-CD1 3.09Å; H46-I50 WeakPolarHBondContact O-CG1 3.32Å; H46-I50 PolarHBondContact O-N 3.47Å; M47-I50 PolarHBondContact O-N 2.71Å; L48-I50 PolarHBondContact O-N 3.46Å; I50-S54 WeakPolarHBondContact O-CB 3.25Å; I50-S54 PolarHBondContact O-N 3.41Å; I50-S54 PolarHBondContact O-OG 3.02Å |
| 51 | T | 77.2 | Confident | 72 | Confident | 86 Ų | 86 | 100.7 Ų | 100.7 | 53% | 0.528 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -65.3 | -46.1 | 177.6 | -55.2 | 0 | 0 | 0 | 0 | 111.4 | M47 L48 I49 S54 Y55 | M47-T51 WeakPolarHBondContact O-CB 3.32Å; M47-T51 PolarHBondContact O-N 3.42Å; M47-T51 PolarHBondContact O-OG1 2.87Å; L48-T51 WeakPolarHBondContact O-CB 3.4Å; L48-T51 PolarHBondContact O-N 3.18Å; I49-T51 PolarHBondContact O-N 3.02Å; T51-S54 PolarHBondContact O-N 2.87Å; T51-Y55 WeakPolarHBondContact O-CB 3.35Å; T51-Y55 PolarHBondContact O-N 2.84Å |
| 52 | I | 80.3 | Confident | 72.9 | Confident | 83 Ų | 83 | 104.8 Ų | 104.8 | 43% | 0.426 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -64.9 | -46.6 | 178.6 | -68.2 | 167.7 | 0 | 0 | 0 | 110.5 | L48 I49 S54 Y55 L56 | L48-I52 HydrophobicContact CD2-CD1 4.23Å; L48-I52 HydrophobicContact CG-CD1 3.87Å; L48-I52 WeakPolarHBondContact O-CB 3.45Å; L48-I52 VanDerWaalsContact O-CG1 3.27Å; L48-I52 WeakPolarHBondContact O-CG1 3.28Å; L48-I52 PolarHBondContact O-N 3.48Å; I49-I52 PolarHBondContact O-N 2.77Å; I52-S54 VanDerWaalsContact C-N 3.34Å; I52-S54 PolarHBondContact O-N 2.89Å; I52-Y55 WeakPolarHBondContact O-CB 3.46Å; I52-Y55 PolarHBondContact O-N 3.16Å; I52-L56 HydrophobicContact CG2-CD1 3.98Å; I52-L56 HydrophobicContact CG2-CG 4.35Å; I52-L56 WeakPolarHBondContact O-CG 3.47Å; I52-L56 PolarHBondContact O-N 3.17Å |
| 53 | M | 77.4 | Confident | 73.6 | Confident | 116 Ų | 116 | 109.1 Ų | 109.1 | 57% | 0.571 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -63.3 | -40.1 | 177.5 | -68.9 | -63.1 | 176.9 | 0 | 0 | 111.5 | I49 Y55 L56 H57 | I49-M53 HydrophobicContact CG2-CE 4.28Å; I49-M53 HydrophobicContact CG2-CG 3.82Å; I49-M53 VanDerWaalsContact O-CB 3.32Å; I49-M53 WeakPolarHBondContact O-CB 3.32Å; I49-M53 VanDerWaalsContact O-CG 3.23Å; I49-M53 WeakPolarHBondContact O-CG 3.21Å; I49-M53 PolarHBondContact O-N 2.85Å; M53-Y55 VanDerWaalsContact C-N 3.32Å; M53-Y55 PolarHBondContact O-N 3.48Å; M53-L56 PolarHBondContact O-N 3Å; M53-H57 VanDerWaalsContact O-CB 3.25Å; M53-H57 WeakPolarHBondContact O-CB 3.5Å; M53-H57 PolarHBondContact O-N 2.95Å |
| 54 | S | 77.9 | Confident | 74 | Confident | 62 Ų | 62 | 109.7 Ų | 109.7 | 43% | 0.434 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -63.4 | -39.8 | 174.5 | -62.5 | 0 | 0 | 0 | 0 | 111.7 | I50 T51 I52 R58 | I50-S54 WeakPolarHBondContact O-CB 3.25Å; I50-S54 PolarHBondContact O-N 3.41Å; I50-S54 PolarHBondContact O-OG 3.02Å; T51-S54 PolarHBondContact O-N 2.87Å; I52-S54 VanDerWaalsContact C-N 3.34Å; I52-S54 PolarHBondContact O-N 2.89Å; S54-R58 WeakPolarHBondContact O-CB 3.23Å; S54-R58 WeakPolarHBondContact O-CG 3.24Å; S54-R58 PolarHBondContact O-N 3.19Å |
| 55 | Y | 78.4 | Confident | 73.8 | Confident | 159 Ų | 159 | 109.9 Ų | 109.9 | 62% | 0.624 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -67.4 | -46.4 | 176.4 | 180 | -97.8 | 0 | 0 | 0 | 111.8 | T51 I52 M53 H57 R58 T59 | T51-Y55 WeakPolarHBondContact O-CB 3.35Å; T51-Y55 PolarHBondContact O-N 2.84Å; I52-Y55 WeakPolarHBondContact O-CB 3.46Å; I52-Y55 PolarHBondContact O-N 3.16Å; M53-Y55 VanDerWaalsContact C-N 3.32Å; M53-Y55 PolarHBondContact O-N 3.48Å; Y55-H57 VanDerWaalsContact C-N 3.33Å; Y55-H57 PolarHBondContact O-N 2.99Å; Y55-R58 PolarHBondContact O-N 3.2Å; Y55-T59 VanDerWaalsContact O-CB 3.28Å; Y55-T59 WeakPolarHBondContact O-CB 3.47Å; Y55-T59 PolarHBondContact O-N 3.38Å; Y55-T59 PolarHBondContact O-OG1 3.04Å |
| 56 | L | 79.5 | Confident | 73.2 | Confident | 96 Ų | 96 | 115 Ų | 115 | 50% | 0.503 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -62.1 | -41.1 | 176.6 | -70.9 | 175.2 | 0 | 0 | 0 | 111.1 | I52 M53 T59 W60 | I52-L56 HydrophobicContact CG2-CD1 3.98Å; I52-L56 HydrophobicContact CG2-CG 4.35Å; I52-L56 WeakPolarHBondContact O-CG 3.47Å; I52-L56 PolarHBondContact O-N 3.17Å; M53-L56 PolarHBondContact O-N 3Å; L56-T59 PolarHBondContact O-N 2.92Å; L56-W60 VanDerWaalsContact O-CB 3.23Å; L56-W60 WeakPolarHBondContact O-CB 3.42Å; L56-W60 PolarHBondContact O-N 2.87Å |
| 57 | H | 80.2 | Confident | 73.6 | Confident | 119 Ų | 119 | 114.6 Ų | 114.6 | 55% | 0.551 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -65.6 | -41.4 | 176.9 | -175.7 | -116.4 | 0 | 0 | 0 | 112.8 | M53 Y55 W60 N61 | M53-H57 VanDerWaalsContact O-CB 3.25Å; M53-H57 WeakPolarHBondContact O-CB 3.5Å; M53-H57 PolarHBondContact O-N 2.95Å; Y55-H57 VanDerWaalsContact C-N 3.33Å; Y55-H57 PolarHBondContact O-N 2.99Å; H57-W60 PolarHBondContact O-N 3.46Å; H57-N61 PolarHBondContact CE1-ND2 3.31Å; H57-N61 PolarHBondContact NE2-ND2 3.2Å; H57-N61 WeakPolarHBondContact O-CB 3.34Å; H57-N61 PolarHBondContact O-N 3.29Å |
| 58 | R | 76.6 | Confident | 73.9 | Confident | 201 Ų | 201 | 113.6 Ų | 113.6 | 76% | 0.758 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -65.6 | -42.2 | 174.5 | -74.6 | 178.9 | 107.4 | -173.3 | 6.9 | 111.8 | S54 Y55 N61 Y62 | S54-R58 WeakPolarHBondContact O-CB 3.23Å; S54-R58 WeakPolarHBondContact O-CG 3.24Å; S54-R58 PolarHBondContact O-N 3.19Å; Y55-R58 PolarHBondContact O-N 3.2Å; R58-N61 PolarHBondContact O-N 3.47Å; R58-Y62 WeakPolarHBondContact O-CB 3.46Å; R58-Y62 PolarHBondContact O-N 3.43Å |
| 59 | T | 77.9 | Confident | 73.9 | Confident | 38 Ų | 38 | 114.7 Ų | 114.7 | 23% | 0.233 | 56% | 0.558 | C | S | . | * | H | α-helix | trans | -64.2 | -44.3 | 177.5 | -56.4 | 0 | 0 | 0 | 0 | 110.3 | Y55 L56 Y62 Y63 | Y55-T59 VanDerWaalsContact O-CB 3.28Å; Y55-T59 WeakPolarHBondContact O-CB 3.47Å; Y55-T59 PolarHBondContact O-N 3.38Å; Y55-T59 PolarHBondContact O-OG1 3.04Å; L56-T59 PolarHBondContact O-N 2.92Å; T59-Y62 WeakPolarHBondContact O-CB 3.48Å; T59-Y62 PolarHBondContact O-N 3.31Å; T59-Y63 HydrophobicContact CG2-CD2 3.62Å; T59-Y63 HydrophobicContact CG2-CE2 3.44Å; T59-Y63 VanDerWaalsContact CG2-CE2 3.44Å; T59-Y63 WeakPolarHBondContact O-CD2 3.48Å; T59-Y63 PolarHBondContact O-N 3.27Å |
| 60 | W | 74.5 | Confident | 73.8 | Confident | 158 Ų | 158 | 117.8 Ų | 117.8 | 60% | 0.598 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -60.2 | -49.8 | 174.6 | -172.9 | -86.2 | 0 | 0 | 0 | 112.1 | L56 H57 Y62 Y63 F64 | L56-W60 VanDerWaalsContact O-CB 3.23Å; L56-W60 WeakPolarHBondContact O-CB 3.42Å; L56-W60 PolarHBondContact O-N 2.87Å; H57-W60 PolarHBondContact O-N 3.46Å; W60-Y62 PolarHBondContact O-N 3.1Å; W60-Y63 PolarHBondContact O-N 3.48Å; W60-Y63 VanDerWaalsContact O-N 3.17Å; W60-F64 AromaticContact CD2-CD2 3.44Å; W60-F64 HydrophobicContact CD2-CD2 3.44Å; W60-F64 VanDerWaalsContact CD2-CD2 3.44Å; W60-F64 AromaticContact CD2-CE2 3.63Å; W60-F64 HydrophobicContact CD2-CE2 3.63Å; W60-F64 HydrophobicContact CD2-CG 4.33Å; W60-F64 AromaticContact CE2-CD2 3.42Å; W60-F64 VanDerWaalsContact CE2-CD2 3.42Å; W60-F64 AromaticContact CE2-CE2 3.72Å; W60-F64 AromaticContact CE2-CG 3.87Å; W60-F64 AromaticContact CE3-CD2 3.77Å; W60-F64 HydrophobicContact CE3-CD2 3.77Å; W60-F64 AromaticContact CE3-CE2 3.43Å; W60-F64 HydrophobicContact CE3-CE2 3.43Å; W60-F64 VanDerWaalsContact CE3-CE2 3.43Å; W60-F64 HydrophobicContact CE3-CZ 4.33Å; W60-F64 AromaticContact CG-CD2 3.91Å; W60-F64 HydrophobicContact CG-CD2 3.91Å; W60-F64 HydrophobicContact CG-CE2 4.49Å; W60-F64 HydrophobicContact CH2-CD2 4.04Å; W60-F64 HydrophobicContact CH2-CE1 4.2Å; W60-F64 AromaticContact CH2-CE2 3.46Å; W60-F64 HydrophobicContact CH2-CE2 3.46Å; W60-F64 VanDerWaalsContact CH2-CE2 3.46Å; W60-F64 AromaticContact CH2-CZ 3.54Å; W60-F64 HydrophobicContact CH2-CZ 3.54Å; W60-F64 HydrophobicContact CZ2-CD1 4.26Å; W60-F64 AromaticContact CZ2-CD2 3.74Å; W60-F64 HydrophobicContact CZ2-CD2 3.74Å; W60-F64 HydrophobicContact CZ2-CE1 4.17Å; W60-F64 AromaticContact CZ2-CE2 3.65Å; W60-F64 HydrophobicContact CZ2-CE2 3.65Å; W60-F64 HydrophobicContact CZ2-CG 4.05Å; W60-F64 AromaticContact CZ2-CZ 3.88Å; W60-F64 HydrophobicContact CZ2-CZ 3.88Å; W60-F64 HydrophobicContact CZ3-CD2 4.06Å; W60-F64 AromaticContact CZ3-CE2 3.34Å; W60-F64 HydrophobicContact CZ3-CE2 3.34Å; W60-F64 AromaticContact CZ3-CZ 3.8Å; W60-F64 HydrophobicContact CZ3-CZ 3.8Å; W60-F64 AromaticContact NE1-CD2 3.82Å; W60-F64 AromaticContact NE1-CG 3.99Å; W60-F64 WeakPolarHBondContact O-CB 3.12Å; W60-F64 WeakPolarHBondContact O-CD2 3.47Å; W60-F64 PolarHBondContact O-N 2.92Å |
| 61 | N | 71.6 | Confident | 73.7 | Confident | 69 Ų | 69 | 118.4 Ų | 118.4 | 37% | 0.369 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -59 | -37.5 | 175.1 | -103.9 | -78.3 | 0 | 0 | 0 | 112.1 | H57 R58 C65 | H57-N61 PolarHBondContact CE1-ND2 3.31Å; H57-N61 PolarHBondContact NE2-ND2 3.2Å; H57-N61 WeakPolarHBondContact O-CB 3.34Å; H57-N61 PolarHBondContact O-N 3.29Å; R58-N61 PolarHBondContact O-N 3.47Å; N61-C65 VanDerWaalsContact O-CB 3.27Å; N61-C65 WeakPolarHBondContact O-CB 3.27Å; N61-C65 PolarHBondContact O-N 3.45Å; N61-C65 PolarHBondContact OD1-SG 2.85Å |
| 62 | Y | 75.5 | Confident | 73.4 | Confident | 166 Ų | 166 | 120.6 Ų | 120.6 | 65% | 0.651 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -67.2 | -35.1 | 178.1 | -173.7 | -101.7 | 0 | 0 | 0 | 113 | R58 T59 W60 | R58-Y62 WeakPolarHBondContact O-CB 3.46Å; R58-Y62 PolarHBondContact O-N 3.43Å; T59-Y62 WeakPolarHBondContact O-CB 3.48Å; T59-Y62 PolarHBondContact O-N 3.31Å; W60-Y62 PolarHBondContact O-N 3.1Å |
| 63 | Y | 76.5 | Confident | 73 | Confident | 162 Ų | 162 | 123.3 Ų | 123.3 | 64% | 0.635 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -90.2 | -26.1 | -179 | -74.6 | -67.1 | 0 | 0 | 0 | 114.7 | T59 W60 | T59-Y63 HydrophobicContact CG2-CD2 3.62Å; T59-Y63 HydrophobicContact CG2-CE2 3.44Å; T59-Y63 VanDerWaalsContact CG2-CE2 3.44Å; T59-Y63 WeakPolarHBondContact O-CD2 3.48Å; T59-Y63 PolarHBondContact O-N 3.27Å; W60-Y63 PolarHBondContact O-N 3.48Å; W60-Y63 VanDerWaalsContact O-N 3.17Å |
| 64 | F | 69.5 | Low | 72.6 | Confident | 130 Ų | 130 | 123.8 Ų | 123.8 | 57% | 0.57 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -111.8 | -11.6 | -174.6 | -70.9 | -86.5 | 0 | 0 | 0 | 114.8 | W60 | W60-F64 AromaticContact CD2-CD2 3.44Å; W60-F64 HydrophobicContact CD2-CD2 3.44Å; W60-F64 VanDerWaalsContact CD2-CD2 3.44Å; W60-F64 AromaticContact CD2-CE2 3.63Å; W60-F64 HydrophobicContact CD2-CE2 3.63Å; W60-F64 HydrophobicContact CD2-CG 4.33Å; W60-F64 AromaticContact CE2-CD2 3.42Å; W60-F64 VanDerWaalsContact CE2-CD2 3.42Å; W60-F64 AromaticContact CE2-CE2 3.72Å; W60-F64 AromaticContact CE2-CG 3.87Å; W60-F64 AromaticContact CE3-CD2 3.77Å; W60-F64 HydrophobicContact CE3-CD2 3.77Å; W60-F64 AromaticContact CE3-CE2 3.43Å; W60-F64 HydrophobicContact CE3-CE2 3.43Å; W60-F64 VanDerWaalsContact CE3-CE2 3.43Å; W60-F64 HydrophobicContact CE3-CZ 4.33Å; W60-F64 AromaticContact CG-CD2 3.91Å; W60-F64 HydrophobicContact CG-CD2 3.91Å; W60-F64 HydrophobicContact CG-CE2 4.49Å; W60-F64 HydrophobicContact CH2-CD2 4.04Å; W60-F64 HydrophobicContact CH2-CE1 4.2Å; W60-F64 AromaticContact CH2-CE2 3.46Å; W60-F64 HydrophobicContact CH2-CE2 3.46Å; W60-F64 VanDerWaalsContact CH2-CE2 3.46Å; W60-F64 AromaticContact CH2-CZ 3.54Å; W60-F64 HydrophobicContact CH2-CZ 3.54Å; W60-F64 HydrophobicContact CZ2-CD1 4.26Å; W60-F64 AromaticContact CZ2-CD2 3.74Å; W60-F64 HydrophobicContact CZ2-CD2 3.74Å; W60-F64 HydrophobicContact CZ2-CE1 4.17Å; W60-F64 AromaticContact CZ2-CE2 3.65Å; W60-F64 HydrophobicContact CZ2-CE2 3.65Å; W60-F64 HydrophobicContact CZ2-CG 4.05Å; W60-F64 AromaticContact CZ2-CZ 3.88Å; W60-F64 HydrophobicContact CZ2-CZ 3.88Å; W60-F64 HydrophobicContact CZ3-CD2 4.06Å; W60-F64 AromaticContact CZ3-CE2 3.34Å; W60-F64 HydrophobicContact CZ3-CE2 3.34Å; W60-F64 AromaticContact CZ3-CZ 3.8Å; W60-F64 HydrophobicContact CZ3-CZ 3.8Å; W60-F64 AromaticContact NE1-CD2 3.82Å; W60-F64 AromaticContact NE1-CG 3.99Å; W60-F64 WeakPolarHBondContact O-CB 3.12Å; W60-F64 WeakPolarHBondContact O-CD2 3.47Å; W60-F64 PolarHBondContact O-N 2.92Å |
| 65 | C | 57.1 | Low | 72.2 | Confident | 98 Ų | 98 | 129 Ų | 129 | 66% | 0.662 | 60% | 0.601 | S | S | * | * | trans | -107.9 | 19.8 | 172.8 | -72.5 | 0 | 0 | 0 | 0 | 113.4 | N61 | N61-C65 VanDerWaalsContact O-CB 3.27Å; N61-C65 WeakPolarHBondContact O-CB 3.27Å; N61-C65 PolarHBondContact O-N 3.45Å; N61-C65 PolarHBondContact OD1-SG 2.85Å | ||
| 66 | S | 48.7 | Very low | 71.6 | Confident | 152 Ų | 152 | 126.3 Ų | 126.3 | 100% | 1.063 | 60% | 0.599 | S | S | * | * | trans | -117.5 | 0 | 162.2 | -66.3 | 0 | 0 | 0 | 0 | 108.9 |
Retrieved 66 of 66 residues in 14.2 ms
(Link to these results)