| 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 | 61.6 | Low | 79.4 | Confident | 215 Ų | 215 | 131.1 Ų | 131.1 | 100% | 1.059 | 64% | 0.642 | S | S | * | * | 0 | -37 | 0 | -65.6 | -178 | 83.6 | 0 | 0 | 113.6 | R3 L4 | M1-R3 VanDerWaalsContact C-N 3.32Å; M1-R3 PolarHBondContact O-N 3.09Å; M1-L4 PolarHBondContact O-N 3.43Å; M1-L4 VanDerWaalsContact O-N 3.12Å | |||
| 2 | I | 74.5 | Confident | 79.5 | Confident | 144 Ų | 144 | 132.8 Ų | 132.8 | 74% | 0.738 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -54.8 | -39.5 | -177.4 | -63.8 | 154.9 | 0 | 0 | 0 | 114 | L4 L5 T6 | I2-L4 VanDerWaalsContact C-N 3.27Å; I2-L4 PolarHBondContact O-N 3.2Å; I2-L5 PolarHBondContact O-N 3.28Å; I2-T6 HydrophobicContact CG2-CG2 4.48Å; I2-T6 PolarHBondContact O-N 3.12Å; I2-T6 VanDerWaalsContact O-N 3.09Å; I2-T6 PolarHBondContact O-OG1 3.23Å |
| 3 | R | 74.7 | Confident | 79.5 | Confident | 221 Ų | 221 | 126.5 Ų | 126.5 | 83% | 0.834 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -62 | -31.7 | -180 | -68.3 | -169.3 | 176.9 | -180 | -0.6 | 114 | M1 T6 V7 | M1-R3 VanDerWaalsContact C-N 3.32Å; M1-R3 PolarHBondContact O-N 3.09Å; R3-T6 WeakPolarHBondContact CA-OG1 3.36Å; R3-T6 PolarHBondContact O-OG1 3.03Å; R3-V7 WeakPolarHBondContact O-CG2 3.48Å; R3-V7 PolarHBondContact O-N 2.87Å |
| 4 | L | 80.1 | Confident | 78.9 | Confident | 132 Ų | 132 | 125.4 Ų | 125.4 | 69% | 0.691 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -72.7 | -41.4 | 178.8 | -118.4 | 156.7 | 0 | 0 | 0 | 110.3 | M1 I2 T6 V7 V8 | M1-L4 PolarHBondContact O-N 3.43Å; M1-L4 VanDerWaalsContact O-N 3.12Å; I2-L4 VanDerWaalsContact C-N 3.27Å; I2-L4 PolarHBondContact O-N 3.2Å; L4-T6 PolarHBondContact O-N 3.36Å; L4-V7 PolarHBondContact O-N 3.32Å; L4-V8 WeakPolarHBondContact O-CG2 3.32Å; L4-V8 PolarHBondContact O-N 3.49Å |
| 5 | L | 82.8 | Confident | 78.3 | Confident | 112 Ų | 112 | 122.7 Ų | 122.7 | 59% | 0.586 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -64.7 | -40.4 | 178.8 | -170.7 | 145.4 | 0 | 0 | 0 | 111.9 | I2 V7 V8 I9 | I2-L5 PolarHBondContact O-N 3.28Å; L5-V7 VanDerWaalsContact C-N 3.34Å; L5-V7 PolarHBondContact O-N 3.44Å; L5-V8 PolarHBondContact O-N 3.12Å; L5-I9 HydrophobicContact CD2-CD1 3.5Å; L5-I9 HydrophobicContact CD2-CG1 4.38Å; L5-I9 HydrophobicContact CG-CD1 4.46Å; L5-I9 WeakPolarHBondContact O-CG1 3.4Å; L5-I9 PolarHBondContact O-N 3.41Å; L5-I9 VanDerWaalsContact O-N 3.12Å |
| 6 | T | 83 | Confident | 77.5 | Confident | 62 Ų | 62 | 120.6 Ų | 120.6 | 38% | 0.38 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -63.2 | -39.7 | 176.6 | 50.4 | 0 | 0 | 0 | 0 | 112.4 | I2 R3 L4 I9 Y10 | I2-T6 HydrophobicContact CG2-CG2 4.48Å; I2-T6 PolarHBondContact O-N 3.12Å; I2-T6 VanDerWaalsContact O-N 3.09Å; I2-T6 PolarHBondContact O-OG1 3.23Å; R3-T6 WeakPolarHBondContact CA-OG1 3.36Å; R3-T6 PolarHBondContact O-OG1 3.03Å; L4-T6 PolarHBondContact O-N 3.36Å; T6-I9 PolarHBondContact O-N 3.17Å; T6-Y10 WeakPolarHBondContact O-CD2 3.45Å; T6-Y10 PolarHBondContact O-N 3.47Å; T6-Y10 VanDerWaalsContact O-N 3.1Å |
| 7 | V | 82.4 | Confident | 76.6 | Confident | 82 Ų | 82 | 121.9 Ų | 121.9 | 50% | 0.497 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -66.1 | -41.7 | 179.1 | 173.5 | 0 | 0 | 0 | 0 | 111 | R3 L4 L5 I9 Y10 M11 | R3-V7 WeakPolarHBondContact O-CG2 3.48Å; R3-V7 PolarHBondContact O-N 2.87Å; L4-V7 PolarHBondContact O-N 3.32Å; L5-V7 VanDerWaalsContact C-N 3.34Å; L5-V7 PolarHBondContact O-N 3.44Å; V7-I9 PolarHBondContact O-N 3.31Å; V7-Y10 PolarHBondContact O-N 3.42Å; V7-M11 WeakPolarHBondContact O-CG 3.36Å; V7-M11 PolarHBondContact O-N 3.1Å |
| 8 | V | 84.2 | Confident | 75.6 | Confident | 76 Ų | 76 | 118.8 Ų | 118.8 | 46% | 0.461 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -61.7 | -43.9 | 177.4 | 174.6 | 0 | 0 | 0 | 0 | 111.2 | L4 L5 Y10 M11 F12 | L4-V8 WeakPolarHBondContact O-CG2 3.32Å; L4-V8 PolarHBondContact O-N 3.49Å; L5-V8 PolarHBondContact O-N 3.12Å; V8-Y10 PolarHBondContact O-N 3.44Å; V8-M11 PolarHBondContact O-N 3.3Å; V8-F12 HydrophobicContact CG1-CD2 3.98Å; V8-F12 HydrophobicContact CG1-CE2 4.08Å; V8-F12 WeakPolarHBondContact O-CD2 3.41Å; V8-F12 PolarHBondContact O-N 3.01Å; V8-F12 VanDerWaalsContact O-N 3.12Å |
| 9 | I | 86.6 | Confident | 74.6 | Confident | 105 Ų | 105 | 117.7 Ų | 117.7 | 54% | 0.538 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -61.9 | -44.6 | 177.6 | -67.3 | 172.7 | 0 | 0 | 0 | 111.3 | L5 T6 V7 M11 F12 A13 | L5-I9 HydrophobicContact CD2-CD1 3.5Å; L5-I9 HydrophobicContact CD2-CG1 4.38Å; L5-I9 HydrophobicContact CG-CD1 4.46Å; L5-I9 WeakPolarHBondContact O-CG1 3.4Å; L5-I9 PolarHBondContact O-N 3.41Å; L5-I9 VanDerWaalsContact O-N 3.12Å; T6-I9 PolarHBondContact O-N 3.17Å; V7-I9 PolarHBondContact O-N 3.31Å; I9-M11 VanDerWaalsContact C-N 3.34Å; I9-M11 PolarHBondContact O-N 3.48Å; I9-F12 PolarHBondContact O-N 2.9Å; I9-A13 PolarHBondContact O-N 3.24Å |
| 10 | Y | 83 | Confident | 73.5 | Confident | 168 Ų | 168 | 117.3 Ų | 117.3 | 66% | 0.659 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -62.4 | -39.9 | 178.1 | -94.1 | -75.3 | 0 | 0 | 0 | 112.5 | T6 V7 V8 A13 I14 | T6-Y10 WeakPolarHBondContact O-CD2 3.45Å; T6-Y10 PolarHBondContact O-N 3.47Å; T6-Y10 VanDerWaalsContact O-N 3.1Å; V7-Y10 PolarHBondContact O-N 3.42Å; V8-Y10 PolarHBondContact O-N 3.44Å; Y10-A13 PolarHBondContact O-N 3.32Å; Y10-I14 WeakPolarHBondContact O-CG1 3.33Å; Y10-I14 PolarHBondContact O-N 3.02Å |
| 11 | M | 81 | Confident | 72.2 | Confident | 125 Ų | 125 | 121.1 Ų | 121.1 | 62% | 0.616 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -64 | -41.9 | 177.2 | -71.1 | -65.1 | -178.4 | 0 | 0 | 112.1 | V7 V8 I9 I14 S15 | V7-M11 WeakPolarHBondContact O-CG 3.36Å; V7-M11 PolarHBondContact O-N 3.1Å; V8-M11 PolarHBondContact O-N 3.3Å; I9-M11 VanDerWaalsContact C-N 3.34Å; I9-M11 PolarHBondContact O-N 3.48Å; M11-I14 PolarHBondContact O-N 3.12Å; M11-S15 WeakPolarHBondContact O-CB 3.49Å; M11-S15 PolarHBondContact O-N 3.43Å |
| 12 | F | 80.7 | Confident | 71.3 | Confident | 151 Ų | 151 | 113.1 Ų | 113.1 | 66% | 0.662 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -64.8 | -37.9 | 174.7 | -92.2 | -78.6 | 0 | 0 | 0 | 112.6 | V8 I9 S15 S16 | V8-F12 HydrophobicContact CG1-CD2 3.98Å; V8-F12 HydrophobicContact CG1-CE2 4.08Å; V8-F12 WeakPolarHBondContact O-CD2 3.41Å; V8-F12 PolarHBondContact O-N 3.01Å; V8-F12 VanDerWaalsContact O-N 3.12Å; I9-F12 PolarHBondContact O-N 2.9Å; F12-S15 PolarHBondContact O-N 3.33Å; F12-S16 WeakPolarHBondContact O-CB 3.39Å; F12-S16 PolarHBondContact O-N 3.17Å; F12-S16 PolarHBondContact O-OG 3.13Å |
| 13 | A | 78.4 | Confident | 70.1 | Confident | 52 Ų | 52 | 115.5 Ų | 115.5 | 43% | 0.43 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -65.4 | -41.3 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | I9 Y10 S16 N17 | I9-A13 PolarHBondContact O-N 3.24Å; Y10-A13 PolarHBondContact O-N 3.32Å; A13-S16 WeakPolarHBondContact CA-OG 3.38Å; A13-S16 PolarHBondContact O-OG 2.77Å; A13-S16 VanDerWaalsContact O-OG 3.13Å; A13-N17 WeakPolarHBondContact O-CB 3.3Å; A13-N17 PolarHBondContact O-N 2.92Å; A13-N17 VanDerWaalsContact O-N 3.17Å |
| 14 | I | 71.9 | Confident | 68.8 | Low | 110 Ų | 110 | 113.1 Ų | 113.1 | 56% | 0.564 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -68.9 | -41.6 | 177.1 | -64.4 | 164.8 | 0 | 0 | 0 | 110.4 | Y10 M11 N17 A18 | Y10-I14 WeakPolarHBondContact O-CG1 3.33Å; Y10-I14 PolarHBondContact O-N 3.02Å; M11-I14 PolarHBondContact O-N 3.12Å; I14-N17 PolarHBondContact O-N 3.42Å; I14-A18 VanDerWaalsContact O-CB 3.3Å; I14-A18 WeakPolarHBondContact O-CB 3.38Å; I14-A18 PolarHBondContact O-N 3.25Å |
| 15 | S | 69.6 | Low | 67.2 | Low | 86 Ų | 86 | 114.9 Ų | 114.9 | 60% | 0.601 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -65.2 | -39.1 | 177.8 | 169.8 | 0 | 0 | 0 | 0 | 113.2 | M11 F12 A18 | M11-S15 WeakPolarHBondContact O-CB 3.49Å; M11-S15 PolarHBondContact O-N 3.43Å; F12-S15 PolarHBondContact O-N 3.33Å; S15-A18 PolarHBondContact O-N 3.45Å |
| 16 | S | 65.4 | Low | 65.7 | Low | 88 Ų | 88 | 113.4 Ų | 113.4 | 62% | 0.615 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -74.4 | -27.7 | 179.5 | 50.4 | 0 | 0 | 0 | 0 | 112.8 | F12 A13 | F12-S16 WeakPolarHBondContact O-CB 3.39Å; F12-S16 PolarHBondContact O-N 3.17Å; F12-S16 PolarHBondContact O-OG 3.13Å; A13-S16 WeakPolarHBondContact CA-OG 3.38Å; A13-S16 PolarHBondContact O-OG 2.77Å; A13-S16 VanDerWaalsContact O-OG 3.13Å |
| 17 | N | 62.9 | Low | 64.1 | Low | 143 Ų | 143 | 118.4 Ų | 118.4 | 77% | 0.765 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -86.4 | -15.7 | 175 | -157.2 | 19.6 | 0 | 0 | 0 | 113 | A13 I14 N19 | A13-N17 WeakPolarHBondContact O-CB 3.3Å; A13-N17 PolarHBondContact O-N 2.92Å; A13-N17 VanDerWaalsContact O-N 3.17Å; I14-N17 PolarHBondContact O-N 3.42Å; N17-N19 PolarHBondContact O-N 2.96Å |
| 18 | A | 57.4 | Low | 62.9 | Low | 66 Ų | 66 | 120.9 Ų | 120.9 | 55% | 0.545 | 64% | 0.643 | S | S | . | * | trans | -77.9 | 63.4 | 170.9 | 0 | 0 | 0 | 0 | 0 | 110.4 | I14 S15 P20 | I14-A18 VanDerWaalsContact O-CB 3.3Å; I14-A18 WeakPolarHBondContact O-CB 3.38Å; I14-A18 PolarHBondContact O-N 3.25Å; S15-A18 PolarHBondContact O-N 3.45Å; A18-P20 WeakPolarHBondContact O-CD 3.43Å | ||
| 19 | N | 57.4 | Low | 61.3 | Low | 99 Ų | 99 | 121.9 Ų | 121.9 | 53% | 0.529 | 65% | 0.651 | S | S | . | * | trans | -65.1 | 113.6 | 164.5 | -98.1 | -23.6 | 0 | 0 | 0 | 108.4 | N17 H21 | N17-N19 PolarHBondContact O-N 2.96Å; N19-H21 PolarHBondContact O-N 2.97Å; N19-H21 VanDerWaalsContact O-N 3.13Å | ||
| 20 | P | 52.8 | Low | 59.8 | Low | 109 Ų | 109 | 126 Ų | 126 | 71% | 0.708 | 67% | 0.668 | S | S | * | * | S | Bend | trans | -77.9 | 101.6 | 171.5 | 31.7 | -24.5 | 0 | 0 | 0 | 106.2 | A18 | A18-P20 WeakPolarHBondContact O-CD 3.43Š|
| 21 | H | 46.4 | Very low | 58.3 | Low | 198 Ų | 198 | 122.6 Ų | 122.6 | 92% | 0.917 | 68% | 0.675 | S | S | * | * | S | Bend | trans | 58.6 | 79.1 | 174.7 | -57.5 | -84.2 | 0 | 0 | 0 | 115.3 | N19 | N19-H21 PolarHBondContact O-N 2.97Å; N19-H21 VanDerWaalsContact O-N 3.13Å |
| 22 | G | 43 | Very low | 57.1 | Low | 46 Ų | 46 | 123.9 Ų | 123.9 | 47% | 0.474 | 68% | 0.684 | S | S | . | * | trans | -140.5 | 134.8 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 23 | Y | 48.9 | Very low | 55.8 | Low | 194 Ų | 194 | 124.4 Ų | 124.4 | 76% | 0.761 | 69% | 0.692 | S | S | * | * | trans | 93.3 | 51.8 | 177 | -47.7 | -70.4 | 0 | 0 | 0 | 117.7 | K25 | Y23-K25 VanDerWaalsContact C-N 3.27Å; Y23-K25 PolarHBondContact O-N 3.1Å | ||
| 24 | L | 47.9 | Very low | 54 | Low | 171 Ų | 171 | 128.9 Ų | 128.9 | 90% | 0.895 | 71% | 0.709 | S | S | * | * | trans | -90.6 | 70.4 | 143.9 | -84.6 | 164.9 | 0 | 0 | 0 | 108.7 | S26 | L24-S26 VanDerWaalsContact C-N 3.25Å; L24-S26 PolarHBondContact O-N 2.84Å | ||
| 25 | K | 44.8 | Very low | 52.9 | Low | 169 Ų | 169 | 128 Ų | 128 | 74% | 0.735 | 71% | 0.713 | S | S | * | * | trans | -80.6 | 81.4 | 155.9 | -83.5 | -172.3 | 172.4 | -170 | 0 | 106.8 | Y23 | Y23-K25 VanDerWaalsContact C-N 3.27Å; Y23-K25 PolarHBondContact O-N 3.1Å | ||
| 26 | S | 52.4 | Low | 52 | Low | 81 Ų | 81 | 131.5 Ų | 131.5 | 57% | 0.566 | 73% | 0.725 | S | S | * | * | trans | -105.4 | 79.2 | 161.4 | 59.5 | 0 | 0 | 0 | 0 | 107.4 | L24 I28 | L24-S26 VanDerWaalsContact C-N 3.25Å; L24-S26 PolarHBondContact O-N 2.84Å; S26-I28 VanDerWaalsContact C-N 3.25Å; S26-I28 PolarHBondContact O-N 3.07Å | ||
| 27 | E | 48.5 | Very low | 51.1 | Low | 167 Ų | 167 | 131.4 Ų | 131.4 | 78% | 0.78 | 72% | 0.724 | S | S | * | * | trans | -63.7 | 91 | 158.2 | -68.5 | 168.6 | -167.3 | 0 | 0 | 106.7 | ||||
| 28 | I | 56.8 | Low | 50.4 | Low | 134 Ų | 134 | 134.3 Ų | 134.3 | 69% | 0.687 | 73% | 0.73 | S | S | * | * | trans | -107 | 113.8 | 166.4 | -59.7 | 169.1 | 0 | 0 | 0 | 105.6 | S26 E30 | S26-I28 VanDerWaalsContact C-N 3.25Å; S26-I28 PolarHBondContact O-N 3.07Å; I28-E30 PolarHBondContact O-N 3.31Å | ||
| 29 | P | 52.2 | Low | 50.1 | Low | 97 Ų | 97 | 138.3 Ų | 138.3 | 63% | 0.63 | 74% | 0.74 | S | S | * | * | trans | -68.6 | 121.2 | 179.8 | 26.3 | -30.7 | 0 | 0 | 0 | 109.4 | A31 | P29-A31 PolarHBondContact O-N 3.3Š| ||
| 30 | E | 54.8 | Low | 49.4 | Very low | 192 Ų | 192 | 139.3 Ų | 139.3 | 90% | 0.897 | 75% | 0.745 | S | S | * | * | G | 310 helix | trans | -61.7 | 4.9 | 179.4 | -65.1 | 178.2 | 153.2 | 0 | 0 | 114.3 | I28 L32 | I28-E30 PolarHBondContact O-N 3.31Å; E30-L32 PolarHBondContact O-N 2.92Å |
| 31 | A | 52.2 | Low | 49.2 | Very low | 97 Ų | 97 | 141.9 Ų | 141.9 | 80% | 0.802 | 75% | 0.753 | S | S | * | * | G | 310 helix | trans | -86.6 | 7.7 | -175.8 | 0 | 0 | 0 | 0 | 0 | 115 | P29 | P29-A31 PolarHBondContact O-N 3.3Š|
| 32 | L | 54.3 | Low | 49.4 | Very low | 152 Ų | 152 | 136.7 Ų | 136.7 | 80% | 0.796 | 74% | 0.739 | S | S | * | * | G | 310 helix | trans | -112.2 | 6.8 | -174.4 | -133.8 | 150.5 | 0 | 0 | 0 | 114.3 | E30 | E30-L32 PolarHBondContact O-N 2.92Š|
| 33 | L | 53.2 | Low | 49.7 | Very low | 161 Ų | 161 | 140 Ų | 140 | 84% | 0.843 | 75% | 0.752 | S | S | * | * | trans | -115.2 | 39.1 | -176.8 | -66 | 175.2 | 0 | 0 | 0 | 113 | ||||
| 34 | D | 41.7 | Very low | 49.8 | Very low | 147 Ų | 147 | 140.9 Ų | 140.9 | 79% | 0.786 | 76% | 0.755 | S | S | * | * | trans | -96.8 | 89 | 166.8 | -134.8 | -0.7 | 0 | 0 | 0 | 108.5 | ||||
| 35 | S | 49.1 | Very low | 50.2 | Low | 92 Ų | 92 | 141.8 Ų | 141.8 | 64% | 0.643 | 75% | 0.748 | S | S | * | * | trans | -140.9 | 84 | 168.1 | 67.2 | 0 | 0 | 0 | 0 | 109.9 | S37 | S35-S37 PolarHBondContact O-N 2.98Š| ||
| 36 | N | 49.3 | Very low | 50.5 | Low | 159 Ų | 159 | 143.8 Ų | 143.8 | 85% | 0.85 | 75% | 0.753 | S | S | * | * | trans | -53.3 | 76.9 | 161.2 | -72.5 | -45.9 | 0 | 0 | 0 | 110.9 | ||||
| 37 | S | 48.3 | Very low | 50.5 | Low | 86 Ų | 86 | 148.5 Ų | 148.5 | 60% | 0.601 | 77% | 0.766 | S | S | * | * | trans | -174.1 | 90.9 | 172.3 | 55.5 | 0 | 0 | 0 | 0 | 110.9 | S35 | S35-S37 PolarHBondContact O-N 2.98Š| ||
| 38 | F | 47.4 | Very low | 50.7 | Low | 203 Ų | 203 | 151.3 Ų | 151.3 | 89% | 0.89 | 77% | 0.769 | S | S | * | * | trans | -179.3 | 79.5 | 143.9 | -123.2 | -99.6 | 0 | 0 | 0 | 106.8 | ||||
| 39 | M | 49.8 | Very low | 50.8 | Low | 150 Ų | 150 | 148.3 Ų | 148.3 | 74% | 0.739 | 76% | 0.76 | S | S | * | * | 47.5 | 92.5 | 98 | -78.3 | -91.3 | 111.6 | 0 | 0 | 111.9 | |||||
| 40 | D | 44.2 | Very low | 51.1 | Low | 121 Ų | 121 | 152.7 Ų | 152.7 | 65% | 0.647 | 77% | 0.772 | S | S | * | * | S | Bend | 52 | 115.6 | 129.4 | -60.4 | -15.5 | 0 | 0 | 0 | 119 | |||
| 41 | N | 48.9 | Very low | 51.3 | Low | 162 Ų | 162 | 150.1 Ų | 150.1 | 87% | 0.866 | 76% | 0.758 | S | S | * | * | trans | 69.4 | 75.1 | 144.9 | -60.3 | -24.6 | 0 | 0 | 0 | 116.9 | ||||
| 42 | S | 48.9 | Very low | 51.7 | Low | 90 Ų | 90 | 148.5 Ų | 148.5 | 63% | 0.629 | 74% | 0.74 | S | S | * | * | trans | -142.3 | 137.9 | 145.7 | 73.1 | 0 | 0 | 0 | 0 | 111.3 | Y44 | S42-Y44 PolarHBondContact O-N 2.76Š| ||
| 43 | P | 50.9 | Low | 51.9 | Low | 114 Ų | 114 | 150.4 Ų | 150.4 | 74% | 0.74 | 74% | 0.741 | S | S | * | * | trans | -75.1 | 121 | -173.7 | 30.5 | -32.6 | 0 | 0 | 0 | 110.3 | Y45 | P43-Y45 HydrophobicContact CB-CD2 4.15Å; P43-Y45 PolarHBondContact O-N 2.89Å | ||
| 44 | Y | 50.1 | Low | 52.3 | Low | 214 Ų | 214 | 151.5 Ų | 151.5 | 84% | 0.839 | 73% | 0.734 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.2 | 44.8 | -174.1 | -80.6 | -88.7 | 0 | 0 | 0 | 115.6 | S42 | S42-Y44 PolarHBondContact O-N 2.76Š|
| 45 | Y | 56 | Low | 52.9 | Low | 189 Ų | 189 | 150.8 Ų | 150.8 | 74% | 0.741 | 72% | 0.721 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.2 | -26.3 | -174.9 | -76.8 | -73.9 | 0 | 0 | 0 | 115.6 | P43 | P43-Y45 HydrophobicContact CB-CD2 4.15Å; P43-Y45 PolarHBondContact O-N 2.89Å |
| 46 | Y | 51.1 | Low | 53.2 | Low | 211 Ų | 211 | 152.8 Ų | 152.8 | 83% | 0.827 | 72% | 0.718 | S | S | * | * | trans | -153.8 | 75.2 | 178.4 | -65.6 | -80.4 | 0 | 0 | 0 | 110.9 | R48 | Y46-R48 PolarHBondContact O-N 2.86Š| ||
| 47 | Q | 52.3 | Low | 53.5 | Low | 181 Ų | 181 | 149.9 Ų | 149.9 | 85% | 0.846 | 71% | 0.706 | S | S | * | * | trans | -72.3 | 79.7 | 158.1 | -164.3 | 171.4 | 9.9 | 0 | 0 | 107.1 | S49 | Q47-S49 PolarHBondContact O-N 2.88Š| ||
| 48 | R | 53.4 | Low | 54 | Low | 226 Ų | 226 | 150.6 Ų | 150.6 | 85% | 0.853 | 70% | 0.702 | S | S | * | * | trans | -60.3 | 95.3 | 167.4 | -126.9 | 179.1 | -171.5 | 171.3 | 3.7 | 104.9 | Y46 Q50 | Y46-R48 PolarHBondContact O-N 2.86Å; R48-Q50 PolarHBondContact O-N 3.26Å | ||
| 49 | S | 57.8 | Low | 54.4 | Low | 70 Ų | 70 | 145.6 Ų | 145.6 | 49% | 0.49 | 69% | 0.685 | S | S | . | * | trans | -48.8 | 116.6 | 167.6 | 46.9 | 0 | 0 | 0 | 0 | 106.1 | Q47 F51 | Q47-S49 PolarHBondContact O-N 2.88Å; S49-F51 VanDerWaalsContact O-CD2 3.3Å; S49-F51 WeakPolarHBondContact O-CD2 3.12Å; S49-F51 PolarHBondContact O-N 2.8Å; S49-F51 WeakPolarHBondContact OG-CE2 3.16Å | ||
| 50 | Q | 59.8 | Low | 54.7 | Low | 190 Ų | 190 | 144.1 Ų | 144.1 | 89% | 0.888 | 68% | 0.676 | S | S | * | * | trans | -66.3 | 85.4 | 173.5 | -74 | 178.7 | -19.2 | 0 | 0 | 105.7 | R48 P52 | R48-Q50 PolarHBondContact O-N 3.26Å; Q50-P52 WeakPolarHBondContact O-CD 3.44Å; Q50-P52 VanDerWaalsContact O-N 3.15Å | ||
| 51 | F | 58.4 | Low | 55.3 | Low | 137 Ų | 137 | 146.5 Ų | 146.5 | 60% | 0.601 | 68% | 0.681 | S | S | * | * | trans | -55.6 | 122.8 | 170.3 | -74.6 | -81.1 | 0 | 0 | 0 | 106.3 | S49 K53 W55 | S49-F51 VanDerWaalsContact O-CD2 3.3Å; S49-F51 WeakPolarHBondContact O-CD2 3.12Å; S49-F51 PolarHBondContact O-N 2.8Å; S49-F51 WeakPolarHBondContact OG-CE2 3.16Å; F51-K53 PolarHBondContact O-N 2.84Å; F51-W55 HydrophobicContact CD1-CE3 4.09Å | ||
| 52 | P | 59.9 | Low | 55.6 | Low | 64 Ų | 64 | 148.4 Ų | 148.4 | 42% | 0.416 | 68% | 0.675 | S | S | . | * | trans | -45.6 | 135 | 175.8 | 9.5 | -26.6 | 0 | 0 | 0 | 109.5 | Q50 W54 W55 K56 | Q50-P52 WeakPolarHBondContact O-CD 3.44Å; Q50-P52 VanDerWaalsContact O-N 3.15Å; P52-W54 CarbonylContact O-C 3.56Å; P52-W54 PolarHBondContact O-N 2.89Å; P52-W55 HydrophobicContact CG-CB 4.37Å; P52-W55 HydrophobicContact CG-CD2 4.27Å; P52-W55 HydrophobicContact CG-CE3 3.5Å; P52-W55 HydrophobicContact CG-CZ3 4.11Å; P52-W55 WeakPolarHBondContact O-CA 3.29Å; P52-W55 WeakPolarHBondContact O-CB 3.22Å; P52-W55 PolarHBondContact O-N 2.94Å; P52-K56 PolarHBondContact O-N 3.13Å | ||
| 53 | K | 59.7 | Low | 56.1 | Low | 192 Ų | 192 | 155 Ų | 155 | 84% | 0.835 | 69% | 0.687 | S | S | * | * | H | α-helix | trans | -51.6 | -27.6 | -174.5 | -78.2 | 179.9 | 177.4 | 176 | 0 | 112.9 | F51 K56 T57 | F51-K53 PolarHBondContact O-N 2.84Å; K53-K56 PolarHBondContact O-N 2.93Å; K53-T57 PolarHBondContact O-N 2.92Å; K53-T57 PolarHBondContact O-OG1 3.5Å |
| 54 | W | 60.5 | Low | 56.6 | Low | 183 Ų | 183 | 156.1 Ų | 156.1 | 69% | 0.693 | 68% | 0.68 | S | S | * | * | H | α-helix | trans | -62.2 | -44.9 | 172 | 120.4 | 31.4 | 0 | 0 | 0 | 111.6 | P52 K56 T57 I58 | P52-W54 CarbonylContact O-C 3.56Å; P52-W54 PolarHBondContact O-N 2.89Å; W54-K56 PolarHBondContact O-N 3.12Å; W54-T57 WeakPolarHBondContact CA-OG1 3.45Å; W54-T57 PolarHBondContact O-N 3.5Å; W54-T57 VanDerWaalsContact O-N 3.07Å; W54-T57 PolarHBondContact O-OG1 2.73Å; W54-T57 VanDerWaalsContact O-OG1 3.1Å; W54-I58 HydrophobicContact CG-CD1 4.29Å; W54-I58 WeakPolarHBondContact O-CG1 3.32Å; W54-I58 PolarHBondContact O-N 2.8Å |
| 55 | W | 55.2 | Low | 57.1 | Low | 132 Ų | 132 | 151.5 Ų | 151.5 | 50% | 0.5 | 68% | 0.677 | S | S | . | * | H | α-helix | trans | -64.3 | -33.1 | -176.8 | -115.1 | -27.9 | 0 | 0 | 0 | 111.6 | F51 P52 N59 | F51-W55 HydrophobicContact CD1-CE3 4.09Å; P52-W55 HydrophobicContact CG-CB 4.37Å; P52-W55 HydrophobicContact CG-CD2 4.27Å; P52-W55 HydrophobicContact CG-CE3 3.5Å; P52-W55 HydrophobicContact CG-CZ3 4.11Å; P52-W55 WeakPolarHBondContact O-CA 3.29Å; P52-W55 WeakPolarHBondContact O-CB 3.22Å; P52-W55 PolarHBondContact O-N 2.94Å; W55-N59 VanDerWaalsContact O-CB 3.26Å; W55-N59 WeakPolarHBondContact O-CB 3.3Å; W55-N59 PolarHBondContact O-N 3.29Å |
| 56 | K | 55.6 | Low | 57.2 | Low | 135 Ų | 135 | 149.6 Ų | 149.6 | 59% | 0.587 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -65.5 | -40.5 | 173.3 | -161.8 | -178.7 | 179.2 | -168.6 | 0 | 111.8 | P52 K53 W54 E60 | P52-K56 PolarHBondContact O-N 3.13Å; K53-K56 PolarHBondContact O-N 2.93Å; W54-K56 PolarHBondContact O-N 3.12Å; K56-E60 VanDerWaalsContact CE-OE1 3.29Å; K56-E60 WeakPolarHBondContact CE-OE1 3.19Å; K56-E60 HydrophobicContact CG-CG 4.44Å; K56-E60 WeakPolarHBondContact O-CB 3.49Å; K56-E60 WeakPolarHBondContact O-CG 3.26Å; K56-E60 PolarHBondContact O-N 3.48Å |
| 57 | T | 56.2 | Low | 57.7 | Low | 97 Ų | 97 | 146.7 Ų | 146.7 | 60% | 0.595 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -75.3 | -30.5 | 179.1 | 14.7 | 0 | 0 | 0 | 0 | 113.2 | K53 W54 | K53-T57 PolarHBondContact O-N 2.92Å; K53-T57 PolarHBondContact O-OG1 3.5Å; W54-T57 WeakPolarHBondContact CA-OG1 3.45Å; W54-T57 PolarHBondContact O-N 3.5Å; W54-T57 VanDerWaalsContact O-N 3.07Å; W54-T57 PolarHBondContact O-OG1 2.73Å; W54-T57 VanDerWaalsContact O-OG1 3.1Å |
| 58 | I | 57.8 | Low | 58.1 | Low | 101 Ų | 101 | 144.4 Ų | 144.4 | 52% | 0.518 | 66% | 0.659 | S | S | . | * | H | α-helix | trans | -78.4 | -32.2 | 176.4 | -64.2 | -175.7 | 0 | 0 | 0 | 111.6 | W54 | W54-I58 HydrophobicContact CG-CD1 4.29Å; W54-I58 WeakPolarHBondContact O-CG1 3.32Å; W54-I58 PolarHBondContact O-N 2.8Å |
| 59 | N | 55.8 | Low | 58.2 | Low | 99 Ų | 99 | 142.2 Ų | 142.2 | 53% | 0.529 | 65% | 0.652 | S | S | . | * | H | α-helix | trans | -97.1 | -0.3 | 177.9 | -69.8 | -16.6 | 0 | 0 | 0 | 114.4 | W55 K61 | W55-N59 VanDerWaalsContact O-CB 3.26Å; W55-N59 WeakPolarHBondContact O-CB 3.3Å; W55-N59 PolarHBondContact O-N 3.29Å; N59-K61 PolarHBondContact O-N 2.73Å |
| 60 | E | 56 | Low | 58.2 | Low | 119 Ų | 119 | 149 Ų | 149 | 56% | 0.556 | 67% | 0.666 | S | S | * | * | trans | -74.4 | 2.9 | 170.3 | -99.6 | 172.5 | -172.6 | 0 | 0 | 113.1 | K56 R62 | K56-E60 VanDerWaalsContact CE-OE1 3.29Å; K56-E60 WeakPolarHBondContact CE-OE1 3.19Å; K56-E60 HydrophobicContact CG-CG 4.44Å; K56-E60 WeakPolarHBondContact O-CB 3.49Å; K56-E60 WeakPolarHBondContact O-CG 3.26Å; K56-E60 PolarHBondContact O-N 3.48Å; E60-R62 PolarHBondContact O-N 2.9Å | ||
| 61 | K | 57.7 | Low | 58 | Low | 171 Ų | 171 | 143.3 Ų | 143.3 | 74% | 0.743 | 66% | 0.659 | S | S | * | * | S | Bend | trans | -58 | 96.6 | 159.3 | -74.1 | -174.4 | 179 | 179.9 | 0 | 107.6 | N59 W63 | N59-K61 PolarHBondContact O-N 2.73Å; K61-W63 PolarHBondContact O-N 2.97Å |
| 62 | R | 55.3 | Low | 57.7 | Low | 201 Ų | 201 | 140 Ų | 140 | 76% | 0.758 | 66% | 0.664 | S | S | * | * | trans | -32.9 | 101.9 | 173.2 | -91.5 | 173.2 | 160.4 | 176.8 | -5.2 | 109.5 | E60 F64 | E60-R62 PolarHBondContact O-N 2.9Å; R62-F64 HydrophobicContact CB-CD2 3.95Å; R62-F64 HydrophobicContact CB-CE2 3.71Å; R62-F64 HydrophobicContact CB-CZ 4.29Å; R62-F64 HydrophobicContact CG-CE2 4.37Å; R62-F64 HydrophobicContact CG-CZ 4.49Å; R62-F64 PolarHBondContact O-N 3.48Å | ||
| 63 | W | 59.6 | Low | 57.4 | Low | 228 Ų | 228 | 145.2 Ų | 145.2 | 86% | 0.864 | 69% | 0.687 | S | S | * | * | trans | -68.5 | 88.5 | 160.4 | -69.3 | 89.2 | 0 | 0 | 0 | 105.6 | K61 | K61-W63 PolarHBondContact O-N 2.97Š| ||
| 64 | F | 60 | Low | 57.1 | Low | 138 Ų | 138 | 144.5 Ų | 144.5 | 61% | 0.605 | 69% | 0.689 | S | S | * | * | trans | -63.8 | 128.1 | 161.6 | -72.7 | -80.6 | 0 | 0 | 0 | 106.2 | R62 I66 | R62-F64 HydrophobicContact CB-CD2 3.95Å; R62-F64 HydrophobicContact CB-CE2 3.71Å; R62-F64 HydrophobicContact CB-CZ 4.29Å; R62-F64 HydrophobicContact CG-CE2 4.37Å; R62-F64 HydrophobicContact CG-CZ 4.49Å; R62-F64 PolarHBondContact O-N 3.48Å; F64-I66 VanDerWaalsContact C-N 3.28Å; F64-I66 PolarHBondContact O-N 2.83Å | ||
| 65 | P | 60.6 | Low | 56.4 | Low | 118 Ų | 118 | 144.2 Ų | 144.2 | 77% | 0.766 | 70% | 0.695 | S | S | * | * | trans | -62 | 101.4 | 169.2 | 25.3 | -30.3 | 0 | 0 | 0 | 106.2 | K67 | P65-K67 PolarHBondContact O-N 3.02Š| ||
| 66 | I | 58.3 | Low | 56 | Low | 149 Ų | 149 | 147.3 Ų | 147.3 | 76% | 0.764 | 73% | 0.729 | S | S | * | * | trans | -65.1 | 95.9 | 167 | -60.6 | 172.2 | 0 | 0 | 0 | 103.5 | F64 E68 | F64-I66 VanDerWaalsContact C-N 3.28Å; F64-I66 PolarHBondContact O-N 2.83Å; I66-E68 HydrophobicContact CG2-CG 4.4Å; I66-E68 PolarHBondContact O-N 2.82Å | ||
| 67 | K | 62.9 | Low | 56 | Low | 150 Ų | 150 | 147.9 Ų | 147.9 | 65% | 0.652 | 74% | 0.736 | S | S | * | * | trans | -61.1 | 100.3 | 160.2 | -78.9 | -172.1 | 176.8 | -177.2 | 0 | 104.8 | P65 Y69 | P65-K67 PolarHBondContact O-N 3.02Å; K67-Y69 HydrophobicContact CB-CD2 3.71Å; K67-Y69 HydrophobicContact CB-CE2 3.5Å; K67-Y69 HydrophobicContact CD-CE2 3.6Å; K67-Y69 HydrophobicContact CG-CE2 4.21Å; K67-Y69 PolarHBondContact O-N 3.27Å | ||
| 68 | E | 59.2 | Low | 56 | Low | 132 Ų | 132 | 150.6 Ų | 150.6 | 62% | 0.617 | 74% | 0.743 | S | S | * | * | trans | -62.5 | 85.9 | 164.3 | -71 | -173.1 | -172.7 | 0 | 0 | 107.1 | I66 R70 | I66-E68 HydrophobicContact CG2-CG 4.4Å; I66-E68 PolarHBondContact O-N 2.82Å; E68-R70 HydrophobicContact CB-CG 4.39Å; E68-R70 PolarHBondContact O-N 3.27Å; E68-R70 IonicContact OE2-CZ 3.12Å; E68-R70 IonicContact OE2-NE 2.9Å; E68-R70 PolarHBondContact OE2-NE 2.87Å; E68-R70 VanDerWaalsContact OE2-NE 3.12Å; E68-R70 IonicContact OE2-NH2 3.46Å; E68-R70 PolarHBondContact OE2-NH2 2.82Å | ||
| 69 | Y | 55.8 | Low | 55.9 | Low | 180 Ų | 180 | 153.3 Ų | 153.3 | 71% | 0.706 | 76% | 0.755 | S | S | * | * | trans | -70.3 | 89.8 | 164.8 | -79 | -83.6 | 0 | 0 | 0 | 107 | K67 G71 | K67-Y69 HydrophobicContact CB-CD2 3.71Å; K67-Y69 HydrophobicContact CB-CE2 3.5Å; K67-Y69 HydrophobicContact CD-CE2 3.6Å; K67-Y69 HydrophobicContact CG-CE2 4.21Å; K67-Y69 PolarHBondContact O-N 3.27Å; Y69-G71 PolarHBondContact O-N 3.34Å | ||
| 70 | R | 57.7 | Low | 55.9 | Low | 212 Ų | 212 | 156.5 Ų | 156.5 | 80% | 0.8 | 77% | 0.769 | S | S | * | * | trans | -78.4 | 96 | 170.5 | -66.1 | -172.5 | -178.4 | -162.9 | -0.1 | 108.3 | E68 | E68-R70 HydrophobicContact CB-CG 4.39Å; E68-R70 PolarHBondContact O-N 3.27Å; E68-R70 IonicContact OE2-CZ 3.12Å; E68-R70 IonicContact OE2-NE 2.9Å; E68-R70 PolarHBondContact OE2-NE 2.87Å; E68-R70 VanDerWaalsContact OE2-NE 3.12Å; E68-R70 IonicContact OE2-NH2 3.46Å; E68-R70 PolarHBondContact OE2-NH2 2.82Å | ||
| 71 | G | 54.9 | Low | 55.9 | Low | 72 Ų | 72 | 158.9 Ų | 158.9 | 74% | 0.742 | 78% | 0.782 | S | S | * | * | S | Bend | trans | 80.6 | 136.2 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | Y69 | Y69-G71 PolarHBondContact O-N 3.34Š|
| 72 | G | 52.5 | Low | 55.8 | Low | 68 Ų | 68 | 158.1 Ų | 158.1 | 70% | 0.701 | 79% | 0.785 | S | S | * | * | cis | -175.2 | 169.1 | 2.2 | 0 | 0 | 0 | 0 | 0 | 103.9 | M74 | G72-M74 PolarHBondContact O-N 2.79Š| ||
| 73 | L | 54.1 | Low | 55.8 | Low | 172 Ų | 172 | 155 Ų | 155 | 90% | 0.901 | 79% | 0.787 | S | S | * | * | trans | -44.2 | 112.3 | 176.4 | -97.2 | 123.8 | 0 | 0 | 0 | 110.7 | E75 | L73-E75 PolarHBondContact O-N 3.43Š| ||
| 74 | M | 54 | Low | 55.5 | Low | 178 Ų | 178 | 149.4 Ų | 149.4 | 88% | 0.877 | 78% | 0.781 | S | S | * | * | trans | -85.4 | 92.4 | 172.5 | -172.1 | 165.3 | 134.6 | 0 | 0 | 106.5 | G72 | G72-M74 PolarHBondContact O-N 2.79Š| ||
| 75 | E | 45.7 | Very low | 55.2 | Low | 176 Ų | 176 | 150.3 Ų | 150.3 | 82% | 0.822 | 80% | 0.795 | S | S | * | * | trans | -79.7 | 107.3 | 159.9 | -74.5 | -176.6 | 163.6 | 0 | 0 | 108 | L73 | L73-E75 PolarHBondContact O-N 3.43Š| ||
| 76 | V | 46.4 | Very low | 54.7 | Low | 197 Ų | 197 | 153.3 Ų | 153.3 | 100% | 1.194 | 80% | 0.798 | S | S | * | * | trans | -142.7 | 0 | 149.3 | -176.9 | 0 | 0 | 0 | 0 | 107.2 |
Retrieved 76 of 76 residues in 19.5 ms
(Link to these results)