| 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 | 47.7 | Very low | 58.5 | Low | 236 Ų | 236 | 120.5 Ų | 120.5 | 100% | 1.163 | 66% | 0.663 | S | S | * | * | 0 | 96.5 | 0 | -79.2 | -171.8 | 173.4 | 0 | 0 | 106.8 | V3 | M1-V3 PolarHBondContact O-N 3.21Š| |||
| 2 | D | 52.9 | Low | 59 | Low | 166 Ų | 166 | 115.6 Ų | 115.6 | 89% | 0.888 | 65% | 0.65 | S | S | * | * | P | Polyproline II helix | trans | -76.1 | 118.2 | -176 | -74.6 | -43.8 | 0 | 0 | 0 | 110.7 | P4 | D2-P4 WeakPolarHBondContact O-CD 3.34Š|
| 3 | V | 57.2 | Low | 59.6 | Low | 110 Ų | 110 | 110.9 Ų | 110.9 | 67% | 0.667 | 64% | 0.635 | S | S | * | * | P | Polyproline II helix | trans | -76.4 | 122.4 | 175.8 | 179.9 | 0 | 0 | 0 | 0 | 107.8 | M1 G5 | M1-V3 PolarHBondContact O-N 3.21Å; V3-G5 PolarHBondContact O-N 3.2Å |
| 4 | P | 55.3 | Low | 60.3 | Low | 75 Ų | 75 | 106.9 Ų | 106.9 | 49% | 0.487 | 62% | 0.621 | S | S | . | * | P | Polyproline II helix | trans | -59.8 | 128.4 | -178.6 | -22.1 | 31.5 | 0 | 0 | 0 | 111.1 | D2 R9 | D2-P4 WeakPolarHBondContact O-CD 3.34Å; P4-R9 PolarHBondContact O-NE 3.39Å |
| 5 | G | 61 | Low | 60.5 | Low | 40 Ų | 40 | 103.2 Ų | 103.2 | 41% | 0.412 | 61% | 0.609 | S | S | . | * | P | Polyproline II helix | trans | -61 | 159.8 | -178.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | V3 V7 S8 R9 | V3-G5 PolarHBondContact O-N 3.2Å; G5-V7 PolarHBondContact O-N 3.02Å; G5-S8 WeakPolarHBondContact O-CB 2.98Å; G5-S8 PolarHBondContact O-N 3.33Å; G5-R9 PolarHBondContact O-N 3.4Å |
| 6 | P | 59.2 | Low | 60.6 | Low | 99 Ų | 99 | 99.7 Ų | 99.7 | 64% | 0.643 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -59.5 | -24.2 | -171.5 | 20.2 | -31.1 | 0 | 0 | 0 | 114.3 | R10 | P6-R10 WeakPolarHBondContact O-CG 3.28Å; P6-R10 PolarHBondContact O-N 3.09Å |
| 7 | V | 59 | Low | 60.6 | Low | 120 Ų | 120 | 98.6 Ų | 98.6 | 73% | 0.727 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -72.2 | -38.4 | 177 | -175.6 | 0 | 0 | 0 | 0 | 111.8 | G5 R9 R10 A11 | G5-V7 PolarHBondContact O-N 3.02Å; V7-R9 PolarHBondContact O-N 2.97Å; V7-R10 PolarHBondContact O-N 3.22Å; V7-A11 PolarHBondContact O-N 3.29Å |
| 8 | S | 60.8 | Low | 60.6 | Low | 68 Ų | 68 | 98.2 Ų | 98.2 | 48% | 0.476 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -64.7 | -39.6 | 177 | 165.6 | 0 | 0 | 0 | 0 | 111.5 | G5 A11 A12 | G5-S8 WeakPolarHBondContact O-CB 2.98Å; G5-S8 PolarHBondContact O-N 3.33Å; S8-A11 PolarHBondContact O-N 3.2Å; S8-A12 WeakPolarHBondContact O-CB 3.5Å; S8-A12 PolarHBondContact O-N 2.91Å |
| 9 | R | 61 | Low | 60.4 | Low | 149 Ų | 149 | 99.1 Ų | 99.1 | 56% | 0.562 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -67.1 | -37.7 | 177.4 | -62 | -174.1 | -169.5 | -163.2 | -0.6 | 112.6 | P4 G5 V7 A13 | P4-R9 PolarHBondContact O-NE 3.39Å; G5-R9 PolarHBondContact O-N 3.4Å; V7-R9 PolarHBondContact O-N 2.97Å; R9-A13 VanDerWaalsContact O-CB 3.3Å; R9-A13 WeakPolarHBondContact O-CB 3.39Å; R9-A13 PolarHBondContact O-N 3.05Å |
| 10 | R | 63.8 | Low | 60.2 | Low | 201 Ų | 201 | 100.5 Ų | 100.5 | 76% | 0.758 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -69.2 | -40.1 | 176 | -74.1 | -179.6 | 176.8 | -176.7 | -0.3 | 112.1 | P6 V7 A13 A14 | P6-R10 WeakPolarHBondContact O-CG 3.28Å; P6-R10 PolarHBondContact O-N 3.09Å; V7-R10 PolarHBondContact O-N 3.22Å; R10-A13 PolarHBondContact O-N 3.22Å; R10-A14 WeakPolarHBondContact O-CB 3.44Å; R10-A14 PolarHBondContact O-N 3.41Å |
| 11 | A | 65.6 | Low | 60 | Low | 62 Ų | 62 | 105.7 Ų | 105.7 | 51% | 0.512 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -64.9 | -42.4 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | V7 S8 A14 A15 | V7-A11 PolarHBondContact O-N 3.29Å; S8-A11 PolarHBondContact O-N 3.2Å; A11-A14 PolarHBondContact O-N 3.44Å; A11-A15 WeakPolarHBondContact O-CB 3.26Å; A11-A15 PolarHBondContact O-N 3.35Å |
| 12 | A | 64.6 | Low | 60.1 | Low | 61 Ų | 61 | 99 Ų | 99 | 50% | 0.504 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -65.4 | -40.5 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | S8 A15 A16 | S8-A12 WeakPolarHBondContact O-CB 3.5Å; S8-A12 PolarHBondContact O-N 2.91Å; A12-A15 PolarHBondContact O-N 3.49Å; A12-A16 VanDerWaalsContact O-CB 3.29Å; A12-A16 WeakPolarHBondContact O-CB 3.39Å; A12-A16 PolarHBondContact O-N 2.89Å |
| 13 | A | 67.4 | Low | 59.8 | Low | 55 Ų | 55 | 94.8 Ų | 94.8 | 46% | 0.455 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -67.3 | -38.3 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | R9 R10 A16 T17 | R9-A13 VanDerWaalsContact O-CB 3.3Å; R9-A13 WeakPolarHBondContact O-CB 3.39Å; R9-A13 PolarHBondContact O-N 3.05Å; R10-A13 PolarHBondContact O-N 3.22Å; A13-A16 PolarHBondContact O-N 3.32Å; A13-T17 WeakPolarHBondContact O-CB 3.35Å; A13-T17 PolarHBondContact O-N 2.92Å; A13-T17 PolarHBondContact O-OG1 3.18Å |
| 14 | A | 69.3 | Low | 59.3 | Low | 54 Ų | 54 | 100 Ų | 100 | 45% | 0.446 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -66.2 | -43.5 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | R10 A11 T17 V18 | R10-A14 WeakPolarHBondContact O-CB 3.44Å; R10-A14 PolarHBondContact O-N 3.41Å; A11-A14 PolarHBondContact O-N 3.44Å; A14-T17 PolarHBondContact O-N 2.98Å; A14-V18 WeakPolarHBondContact O-CB 3.49Å; A14-V18 VanDerWaalsContact O-CG2 3.31Å; A14-V18 WeakPolarHBondContact O-CG2 3.46Å; A14-V18 PolarHBondContact O-N 3.36Å |
| 15 | A | 63.5 | Low | 59 | Low | 52 Ų | 52 | 102 Ų | 102 | 43% | 0.43 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -63.7 | -41.6 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | A11 A12 T17 V18 L19 | A11-A15 WeakPolarHBondContact O-CB 3.26Å; A11-A15 PolarHBondContact O-N 3.35Å; A12-A15 PolarHBondContact O-N 3.49Å; A15-T17 VanDerWaalsContact C-N 3.34Å; A15-T17 PolarHBondContact O-N 3.03Å; A15-V18 PolarHBondContact O-N 3.36Å; A15-L19 WeakPolarHBondContact O-CB 3.48Å; A15-L19 WeakPolarHBondContact O-CG 3.4Å; A15-L19 PolarHBondContact O-N 2.98Å |
| 16 | A | 61.3 | Low | 58.3 | Low | 47 Ų | 47 | 110.5 Ų | 110.5 | 39% | 0.388 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -64.8 | -36.8 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | A12 A13 L19 L20 | A12-A16 VanDerWaalsContact O-CB 3.29Å; A12-A16 WeakPolarHBondContact O-CB 3.39Å; A12-A16 PolarHBondContact O-N 2.89Å; A13-A16 PolarHBondContact O-N 3.32Å; A16-L19 PolarHBondContact O-N 3.03Å; A16-L20 VanDerWaalsContact O-CB 3.27Å; A16-L20 WeakPolarHBondContact O-CB 3.49Å; A16-L20 WeakPolarHBondContact O-CD1 3.33Å; A16-L20 WeakPolarHBondContact O-CG 3.49Å; A16-L20 PolarHBondContact O-N 3.21Å |
| 17 | T | 61.1 | Low | 58 | Low | 81 Ų | 81 | 115.1 Ų | 115.1 | 50% | 0.497 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -72.5 | -35.5 | 177.1 | -53.9 | 0 | 0 | 0 | 0 | 111.9 | A13 A14 A15 R21 | A13-T17 WeakPolarHBondContact O-CB 3.35Å; A13-T17 PolarHBondContact O-N 2.92Å; A13-T17 PolarHBondContact O-OG1 3.18Å; A14-T17 PolarHBondContact O-N 2.98Å; A15-T17 VanDerWaalsContact C-N 3.34Å; A15-T17 PolarHBondContact O-N 3.03Å; T17-R21 WeakPolarHBondContact O-CB 3.31Å; T17-R21 PolarHBondContact O-N 3.23Å |
| 18 | V | 59.8 | Low | 58.3 | Low | 91 Ų | 91 | 116.6 Ų | 116.6 | 55% | 0.552 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -68.4 | -43.3 | 172.2 | 170.3 | 0 | 0 | 0 | 0 | 110.6 | A14 A15 R21 T22 | A14-V18 WeakPolarHBondContact O-CB 3.49Å; A14-V18 VanDerWaalsContact O-CG2 3.31Å; A14-V18 WeakPolarHBondContact O-CG2 3.46Å; A14-V18 PolarHBondContact O-N 3.36Å; A15-V18 PolarHBondContact O-N 3.36Å; V18-R21 CarbonylContact O-C 3.59Å; V18-R21 PolarHBondContact O-N 3.45Å; V18-T22 PolarHBondContact O-N 3.41Å; V18-T22 PolarHBondContact O-OG1 2.85Å; V18-T22 VanDerWaalsContact O-OG1 3.08Å |
| 19 | L | 57.6 | Low | 58.1 | Low | 116 Ų | 116 | 117.7 Ų | 117.7 | 61% | 0.607 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -64.7 | -37.4 | 174.8 | -77.5 | 168.2 | 0 | 0 | 0 | 112.5 | A15 A16 R21 T22 A23 | A15-L19 WeakPolarHBondContact O-CB 3.48Å; A15-L19 WeakPolarHBondContact O-CG 3.4Å; A15-L19 PolarHBondContact O-N 2.98Å; A16-L19 PolarHBondContact O-N 3.03Å; L19-R21 VanDerWaalsContact C-N 3.34Å; L19-T22 WeakPolarHBondContact CA-OG1 3.44Å; L19-T22 PolarHBondContact O-N 3.32Å; L19-T22 PolarHBondContact O-OG1 3.47Å; L19-A23 WeakPolarHBondContact O-CB 3.33Å; L19-A23 PolarHBondContact O-N 2.98Å |
| 20 | L | 56.9 | Low | 57.9 | Low | 127 Ų | 127 | 120.2 Ų | 120.2 | 67% | 0.665 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -70.9 | -29.8 | 173.4 | -76.1 | 166.3 | 0 | 0 | 0 | 112.3 | A16 R24 | A16-L20 VanDerWaalsContact O-CB 3.27Å; A16-L20 WeakPolarHBondContact O-CB 3.49Å; A16-L20 WeakPolarHBondContact O-CD1 3.33Å; A16-L20 WeakPolarHBondContact O-CG 3.49Å; A16-L20 PolarHBondContact O-N 3.21Å; L20-R24 PolarHBondContact O-N 3.39Å |
| 21 | R | 54.6 | Low | 57.8 | Low | 209 Ų | 209 | 118.6 Ų | 118.6 | 79% | 0.789 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -73.6 | -33.9 | 171.9 | -90.1 | -175.2 | 172.5 | -173.9 | -1.6 | 112.9 | T17 V18 L19 | T17-R21 WeakPolarHBondContact O-CB 3.31Å; T17-R21 PolarHBondContact O-N 3.23Å; V18-R21 CarbonylContact O-C 3.59Å; V18-R21 PolarHBondContact O-N 3.45Å; L19-R21 VanDerWaalsContact C-N 3.34Å |
| 22 | T | 49.4 | Very low | 57.7 | Low | 97 Ų | 97 | 121 Ų | 121 | 60% | 0.595 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -83.4 | -27.2 | 176.2 | 51.8 | 0 | 0 | 0 | 0 | 113 | V18 L19 R24 | V18-T22 PolarHBondContact O-N 3.41Å; V18-T22 PolarHBondContact O-OG1 2.85Å; V18-T22 VanDerWaalsContact O-OG1 3.08Å; L19-T22 WeakPolarHBondContact CA-OG1 3.44Å; L19-T22 PolarHBondContact O-N 3.32Å; L19-T22 PolarHBondContact O-OG1 3.47Å; T22-R24 VanDerWaalsContact C-N 3.34Å |
| 23 | A | 46.9 | Very low | 57.8 | Low | 76 Ų | 76 | 120.6 Ų | 120.6 | 63% | 0.628 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -78.4 | -15.1 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | L19 V25 | L19-A23 WeakPolarHBondContact O-CB 3.33Å; L19-A23 PolarHBondContact O-N 2.98Å; A23-V25 PolarHBondContact O-N 3.15Å |
| 24 | R | 47.1 | Very low | 57.8 | Low | 220 Ų | 220 | 120.6 Ų | 120.6 | 83% | 0.83 | 61% | 0.609 | S | S | * | * | trans | -81.2 | 71 | 171.6 | -151.9 | -177.9 | -118.4 | -172.4 | 0.2 | 109.1 | L20 T22 R26 | L20-R24 PolarHBondContact O-N 3.39Å; T22-R24 VanDerWaalsContact C-N 3.34Å; R24-R26 PolarHBondContact O-N 3.05Å; R24-R26 VanDerWaalsContact O-N 3.08Å | ||
| 25 | V | 48.1 | Very low | 57.8 | Low | 118 Ų | 118 | 120.1 Ų | 120.1 | 72% | 0.715 | 61% | 0.605 | S | S | * | * | trans | -47.1 | 118.8 | 164.5 | 175.8 | 0 | 0 | 0 | 0 | 107 | A23 R27 | A23-V25 PolarHBondContact O-N 3.15Å; V25-R27 PolarHBondContact O-N 3.41Å | ||
| 26 | R | 47.7 | Very low | 57.9 | Low | 218 Ų | 218 | 122.9 Ų | 122.9 | 82% | 0.823 | 61% | 0.612 | S | S | * | * | trans | -57.2 | 109.2 | -176.9 | -165.3 | 178.9 | -167 | -174.7 | 1.9 | 108.3 | R24 E28 | R24-R26 PolarHBondContact O-N 3.05Å; R24-R26 VanDerWaalsContact O-N 3.08Å; R26-E28 PolarHBondContact O-N 3.2Å | ||
| 27 | R | 52.5 | Low | 58.1 | Low | 195 Ų | 195 | 126.4 Ų | 126.4 | 74% | 0.736 | 62% | 0.623 | S | S | * | * | trans | -75.3 | 19.6 | -172 | -150.8 | 179.4 | -175.6 | -171.8 | 1.1 | 114.1 | V25 S245 | V25-R27 PolarHBondContact O-N 3.41Å; R27-S245 PolarHBondContact NH2-OG 3.05Å | ||
| 28 | E | 65.4 | Low | 58.3 | Low | 152 Ų | 152 | 125 Ų | 125 | 71% | 0.71 | 62% | 0.617 | S | S | * | * | trans | -149.2 | 122.6 | -178.7 | -60.4 | -174.2 | 176.8 | 0 | 0 | 105.6 | R26 | R26-E28 PolarHBondContact O-N 3.2Š| ||
| 29 | C | 56.5 | Low | 58.7 | Low | 90 Ų | 90 | 122.5 Ų | 122.5 | 61% | 0.608 | 61% | 0.605 | S | S | * | * | cis | -153.1 | 85 | 37.1 | -77.3 | 0 | 0 | 0 | 0 | 109.4 | P33 | C29-P33 WeakPolarHBondContact O-CD 3.21Š| ||
| 30 | W | 56 | Low | 59.1 | Low | 202 Ų | 202 | 125 Ų | 125 | 77% | 0.765 | 61% | 0.608 | S | S | * | * | S | Bend | trans | -77.4 | -16.7 | 163.2 | -70.3 | 93.4 | 0 | 0 | 0 | 111.5 | L32 P33 T34 | W30-L32 VanDerWaalsContact C-N 3.33Å; W30-L32 PolarHBondContact O-N 3.49Å; W30-P33 WeakPolarHBondContact O-CD 3.28Å; W30-T34 WeakPolarHBondContact O-CB 3.24Å; W30-T34 PolarHBondContact O-N 2.59Å; W30-T34 PolarHBondContact O-OG1 2.89Å |
| 31 | F | 63.1 | Low | 59.4 | Low | 168 Ų | 168 | 120 Ų | 120 | 74% | 0.737 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -54.6 | -46.6 | 179.1 | -176.7 | -96.3 | 0 | 0 | 0 | 112.7 | A35 | F31-A35 WeakPolarHBondContact O-CB 3.48Å; F31-A35 PolarHBondContact O-N 2.9Å |
| 32 | L | 63.4 | Low | 60 | Low | 111 Ų | 111 | 112.5 Ų | 112.5 | 58% | 0.581 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -70.7 | -49.1 | -178.6 | -171.4 | 78.8 | 0 | 0 | 0 | 112.3 | W30 T34 A35 L36 | W30-L32 VanDerWaalsContact C-N 3.33Å; W30-L32 PolarHBondContact O-N 3.49Å; L32-T34 PolarHBondContact O-N 3.05Å; L32-A35 PolarHBondContact O-N 3.21Å; L32-L36 HydrophobicContact CG-CD1 4.11Å; L32-L36 VanDerWaalsContact O-CB 3.31Å; L32-L36 WeakPolarHBondContact O-CB 3.31Å; L32-L36 VanDerWaalsContact O-CG 3.23Å; L32-L36 WeakPolarHBondContact O-CG 3.47Å; L32-L36 PolarHBondContact O-N 3.41Å |
| 33 | P | 65.4 | Low | 60.7 | Low | 53 Ų | 53 | 114.7 Ų | 114.7 | 34% | 0.344 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -56.7 | -44.3 | 171 | -25.7 | 33.6 | 0 | 0 | 0 | 113.7 | C29 W30 L36 L37 | C29-P33 WeakPolarHBondContact O-CD 3.21Å; W30-P33 WeakPolarHBondContact O-CD 3.28Å; P33-L36 PolarHBondContact O-N 3.38Å; P33-L37 VanDerWaalsContact O-CB 3.3Å; P33-L37 WeakPolarHBondContact O-CB 3.42Å; P33-L37 WeakPolarHBondContact O-CD1 3.5Å; P33-L37 PolarHBondContact O-N 2.86Å |
| 34 | T | 67.7 | Low | 60.9 | Low | 56 Ų | 56 | 113.2 Ų | 113.2 | 34% | 0.344 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -66.5 | -45 | 178.7 | -60.2 | 0 | 0 | 0 | 0 | 111 | W30 L32 L36 L37 C38 | W30-T34 WeakPolarHBondContact O-CB 3.24Å; W30-T34 PolarHBondContact O-N 2.59Å; W30-T34 PolarHBondContact O-OG1 2.89Å; L32-T34 PolarHBondContact O-N 3.05Å; T34-L36 VanDerWaalsContact C-N 3.32Å; T34-L36 PolarHBondContact O-N 2.8Å; T34-L37 PolarHBondContact O-N 3.44Å; T34-C38 VanDerWaalsContact O-CB 3.29Å; T34-C38 WeakPolarHBondContact O-CB 3.39Å; T34-C38 PolarHBondContact O-N 2.94Å; T34-C38 PolarHBondContact O-SG 2.73Å |
| 35 | A | 69.9 | Low | 61.2 | Low | 43 Ų | 43 | 105.1 Ų | 105.1 | 36% | 0.355 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -62.1 | -40.4 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | F31 L32 A39 | F31-A35 WeakPolarHBondContact O-CB 3.48Å; F31-A35 PolarHBondContact O-N 2.9Å; L32-A35 PolarHBondContact O-N 3.21Å; A35-A39 WeakPolarHBondContact O-CB 3.32Å; A35-A39 PolarHBondContact O-N 3.04Å |
| 36 | L | 66.3 | Low | 61.4 | Low | 111 Ų | 111 | 100.5 Ų | 100.5 | 58% | 0.581 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -67.6 | -40.6 | 175.4 | -73.6 | 171.3 | 0 | 0 | 0 | 112.3 | L32 P33 T34 A39 Y40 | L32-L36 HydrophobicContact CG-CD1 4.11Å; L32-L36 VanDerWaalsContact O-CB 3.31Å; L32-L36 WeakPolarHBondContact O-CB 3.31Å; L32-L36 VanDerWaalsContact O-CG 3.23Å; L32-L36 WeakPolarHBondContact O-CG 3.47Å; L32-L36 PolarHBondContact O-N 3.41Å; P33-L36 PolarHBondContact O-N 3.38Å; T34-L36 VanDerWaalsContact C-N 3.32Å; T34-L36 PolarHBondContact O-N 2.8Å; L36-A39 PolarHBondContact O-N 3Å; L36-Y40 WeakPolarHBondContact O-CB 3.41Å; L36-Y40 PolarHBondContact O-N 3.04Å |
| 37 | L | 63.6 | Low | 61.9 | Low | 120 Ų | 120 | 96.3 Ų | 96.3 | 63% | 0.628 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -66.4 | -41.3 | 174.7 | -91.8 | 151.7 | 0 | 0 | 0 | 111.9 | P33 T34 G41 | P33-L37 VanDerWaalsContact O-CB 3.3Å; P33-L37 WeakPolarHBondContact O-CB 3.42Å; P33-L37 WeakPolarHBondContact O-CD1 3.5Å; P33-L37 PolarHBondContact O-N 2.86Å; T34-L37 PolarHBondContact O-N 3.44Å; L37-G41 PolarHBondContact O-N 3Å |
| 38 | C | 65.9 | Low | 61.8 | Low | 53 Ų | 53 | 89.8 Ų | 89.8 | 36% | 0.358 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -65.7 | -43.7 | 175 | -70.4 | 0 | 0 | 0 | 0 | 111.2 | T34 F42 | T34-C38 VanDerWaalsContact O-CB 3.29Å; T34-C38 WeakPolarHBondContact O-CB 3.39Å; T34-C38 PolarHBondContact O-N 2.94Å; T34-C38 PolarHBondContact O-SG 2.73Å; C38-F42 WeakPolarHBondContact O-CB 3.36Å; C38-F42 PolarHBondContact O-N 2.98Å |
| 39 | A | 68.6 | Low | 61 | Low | 38 Ų | 38 | 86.1 Ų | 86.1 | 31% | 0.314 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -64.9 | -45.6 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.2 | A35 L36 F42 F43 | A35-A39 WeakPolarHBondContact O-CB 3.32Å; A35-A39 PolarHBondContact O-N 3.04Å; L36-A39 PolarHBondContact O-N 3Å; A39-F42 WeakPolarHBondContact O-CB 3.3Å; A39-F42 PolarHBondContact O-N 3.1Å; A39-F43 HydrophobicContact CB-CE2 4.45Å; A39-F43 WeakPolarHBondContact O-CD2 3.49Å; A39-F43 PolarHBondContact O-N 3.43Å |
| 40 | Y | 66.3 | Low | 61.1 | Low | 168 Ų | 168 | 86.1 Ų | 86.1 | 66% | 0.659 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -60.7 | -48.3 | 175.5 | 173.5 | -99.3 | 0 | 0 | 0 | 111.6 | L36 F42 F43 A44 | L36-Y40 WeakPolarHBondContact O-CB 3.41Å; L36-Y40 PolarHBondContact O-N 3.04Å; Y40-F42 VanDerWaalsContact C-N 3.3Å; Y40-F42 PolarHBondContact O-N 2.97Å; Y40-F43 PolarHBondContact O-N 3.36Å; Y40-A44 HydrophobicContact CE1-CB 4.48Å; Y40-A44 VanDerWaalsContact O-CB 3.23Å; Y40-A44 WeakPolarHBondContact O-CB 3.42Å; Y40-A44 PolarHBondContact O-N 3.01Å |
| 41 | G | 63.4 | Low | 61 | Low | 23 Ų | 23 | 77.3 Ų | 77.3 | 24% | 0.237 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -60.7 | -38.7 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | L37 S45 | L37-G41 PolarHBondContact O-N 3Å; G41-S45 WeakPolarHBondContact O-CB 3.48Å; G41-S45 PolarHBondContact O-N 3.26Å; G41-S45 PolarHBondContact O-OG 2.88Å |
| 42 | F | 66.8 | Low | 60.6 | Low | 51 Ų | 51 | 74.7 Ų | 74.7 | 22% | 0.224 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -58.6 | -54.3 | 171.6 | 176.5 | -113.2 | 0 | 0 | 0 | 111.6 | C38 A39 Y40 A44 S45 L46 F228 | C38-F42 WeakPolarHBondContact O-CB 3.36Å; C38-F42 PolarHBondContact O-N 2.98Å; A39-F42 WeakPolarHBondContact O-CB 3.3Å; A39-F42 PolarHBondContact O-N 3.1Å; Y40-F42 VanDerWaalsContact C-N 3.3Å; Y40-F42 PolarHBondContact O-N 2.97Å; F42-A44 VanDerWaalsContact C-N 3.32Å; F42-A44 PolarHBondContact O-N 3.47Å; F42-S45 PolarHBondContact O-N 2.73Å; F42-L46 HydrophobicContact CD1-CD1 3.83Å; F42-L46 HydrophobicContact CD2-CD1 4.12Å; F42-L46 HydrophobicContact CD2-CG 4.37Å; F42-L46 HydrophobicContact CE1-CD1 3.38Å; F42-L46 HydrophobicContact CE2-CD1 3.75Å; F42-L46 HydrophobicContact CE2-CG 4.19Å; F42-L46 HydrophobicContact CG-CD1 4.21Å; F42-L46 HydrophobicContact CZ-CD1 3.38Å; F42-L46 HydrophobicContact CZ-CG 4.3Å; F42-L46 WeakPolarHBondContact O-CB 3.37Å; F42-L46 WeakPolarHBondContact O-CG 3.4Å; F42-L46 PolarHBondContact O-N 2.92Å; F42-F228 HydrophobicContact CB-CD2 3.71Å; F42-F228 HydrophobicContact CB-CE2 4.05Å; F42-F228 HydrophobicContact CD2-CB 3.49Å; F42-F228 VanDerWaalsContact CD2-CB 3.49Å; F42-F228 HydrophobicContact CD2-CD1 4.05Å; F42-F228 AromaticContact CD2-CD2 3.16Å; F42-F228 HydrophobicContact CD2-CD2 3.16Å; F42-F228 AromaticContact CD2-CE2 3.84Å; F42-F228 HydrophobicContact CD2-CE2 3.84Å; F42-F228 AromaticContact CD2-CG 3.26Å; F42-F228 HydrophobicContact CD2-CG 3.26Å; F42-F228 HydrophobicContact CE2-CB 3.77Å; F42-F228 AromaticContact CE2-CD1 3.89Å; F42-F228 HydrophobicContact CE2-CD1 3.89Å; F42-F228 AromaticContact CE2-CD2 3.86Å; F42-F228 HydrophobicContact CE2-CD2 3.86Å; F42-F228 HydrophobicContact CE2-CE1 4.46Å; F42-F228 HydrophobicContact CE2-CE2 4.43Å; F42-F228 AromaticContact CE2-CG 3.53Å; F42-F228 HydrophobicContact CE2-CG 3.53Å; F42-F228 AromaticContact CG-CD2 3.69Å; F42-F228 HydrophobicContact CG-CD2 3.69Å; F42-F228 HydrophobicContact CG-CE2 4.04Å; F42-F228 HydrophobicContact CG-CG 4.23Å |
| 43 | F | 64.1 | Low | 60.2 | Low | 142 Ų | 142 | 73.7 Ų | 73.7 | 62% | 0.623 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -71.2 | -23 | -178.5 | -71.9 | -64.1 | 0 | 0 | 0 | 114 | A39 Y40 | A39-F43 HydrophobicContact CB-CE2 4.45Å; A39-F43 WeakPolarHBondContact O-CD2 3.49Å; A39-F43 PolarHBondContact O-N 3.43Å; Y40-F43 PolarHBondContact O-N 3.36Å |
| 44 | A | 50.2 | Low | 59.7 | Low | 46 Ų | 46 | 75.3 Ų | 75.3 | 38% | 0.38 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -82 | -28.1 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | Y40 F42 | Y40-A44 HydrophobicContact CE1-CB 4.48Å; Y40-A44 VanDerWaalsContact O-CB 3.23Å; Y40-A44 WeakPolarHBondContact O-CB 3.42Å; Y40-A44 PolarHBondContact O-N 3.01Å; F42-A44 VanDerWaalsContact C-N 3.32Å; F42-A44 PolarHBondContact O-N 3.47Å |
| 45 | S | 55.1 | Low | 59.2 | Low | 49 Ų | 49 | 76.1 Ų | 76.1 | 34% | 0.343 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -87.5 | -31.8 | 178.4 | -55.7 | 0 | 0 | 0 | 0 | 112.4 | G41 F42 R47 | G41-S45 WeakPolarHBondContact O-CB 3.48Å; G41-S45 PolarHBondContact O-N 3.26Å; G41-S45 PolarHBondContact O-OG 2.88Å; F42-S45 PolarHBondContact O-N 2.73Å; S45-R47 PolarHBondContact O-N 3.46Å; S45-R47 VanDerWaalsContact O-N 3.12Å |
| 46 | L | 52 | Low | 58.4 | Low | 22 Ų | 22 | 80 Ų | 80 | 12% | 0.115 | 42% | 0.421 | C | S | . | . | trans | -65.1 | 107.3 | 156.5 | -68.4 | 174.4 | 0 | 0 | 0 | 105.8 | F42 P48 L221 | F42-L46 HydrophobicContact CD1-CD1 3.83Å; F42-L46 HydrophobicContact CD2-CD1 4.12Å; F42-L46 HydrophobicContact CD2-CG 4.37Å; F42-L46 HydrophobicContact CE1-CD1 3.38Å; F42-L46 HydrophobicContact CE2-CD1 3.75Å; F42-L46 HydrophobicContact CE2-CG 4.19Å; F42-L46 HydrophobicContact CG-CD1 4.21Å; F42-L46 HydrophobicContact CZ-CD1 3.38Å; F42-L46 HydrophobicContact CZ-CG 4.3Å; F42-L46 WeakPolarHBondContact O-CB 3.37Å; F42-L46 WeakPolarHBondContact O-CG 3.4Å; F42-L46 PolarHBondContact O-N 2.92Å; L46-P48 HydrophobicContact CB-CG 4.29Å; L46-P48 WeakPolarHBondContact O-CD 3.42Å; L46-L221 HydrophobicContact CD2-CD1 3.89Å | ||
| 47 | R | 58.3 | Low | 57.8 | Low | 130 Ų | 130 | 79.7 Ų | 79.7 | 49% | 0.491 | 42% | 0.419 | S | S | . | . | trans | -105.1 | 71.3 | 167 | -63.2 | -172.9 | -175.3 | -178.7 | -7.7 | 107.9 | S45 S49 E50 P51 A220 | S45-R47 PolarHBondContact O-N 3.46Å; S45-R47 VanDerWaalsContact O-N 3.12Å; R47-S49 PolarHBondContact O-N 3.41Å; R47-S49 VanDerWaalsContact O-N 3.12Å; R47-E50 HydrophobicContact CB-CB 4.29Å; R47-E50 HydrophobicContact CB-CG 4.02Å; R47-E50 VanDerWaalsContact CD-OE1 3.29Å; R47-E50 WeakPolarHBondContact CD-OE1 3.35Å; R47-E50 WeakPolarHBondContact CD-OE2 3.28Å; R47-E50 IonicContact CZ-OE1 3.46Å; R47-E50 IonicContact CZ-OE2 3.75Å; R47-E50 IonicContact NE-OE1 2.88Å; R47-E50 IonicContact NE-OE2 3.86Å; R47-E50 IonicContact NH1-OE1 2.68Å; R47-E50 PolarHBondContact NH1-OE1 3.27Å; R47-E50 IonicContact NH1-OE2 3.95Å; R47-E50 PolarHBondContact NH1-OE2 3.33Å; R47-E50 PolarHBondContact O-N 2.54Å; R47-P51 VanDerWaalsContact O-CD 3.29Å; R47-P51 WeakPolarHBondContact O-CD 3.35Å; R47-A220 HydrophobicContact CB-CB 4.18Å; R47-A220 WeakPolarHBondContact O-CB 3.31Å | ||
| 48 | P | 49.2 | Very low | 57.3 | Low | 58 Ų | 58 | 80.6 Ų | 80.6 | 38% | 0.377 | 42% | 0.424 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -66.1 | -20.9 | -172.6 | -8 | 26.8 | 0 | 0 | 0 | 110.8 | L46 F52 L81 | L46-P48 HydrophobicContact CB-CG 4.29Å; L46-P48 WeakPolarHBondContact O-CD 3.42Å; P48-F52 WeakPolarHBondContact O-CD2 3.48Å; P48-L81 HydrophobicContact CB-CD2 4.47Å |
| 49 | S | 49.3 | Very low | 56.7 | Low | 74 Ų | 74 | 79.3 Ų | 79.3 | 52% | 0.517 | 42% | 0.42 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -84 | -25.3 | -177.5 | 53.2 | 0 | 0 | 0 | 0 | 114.9 | R47 F52 L53 | R47-S49 PolarHBondContact O-N 3.41Å; R47-S49 VanDerWaalsContact O-N 3.12Å; S49-F52 CarbonylContact O-C 3.58Å; S49-F52 PolarHBondContact O-N 3.01Å; S49-L53 WeakPolarHBondContact O-CB 3.29Å; S49-L53 PolarHBondContact O-N 3.39Å |
| 50 | E | 58.4 | Low | 55.8 | Low | 91 Ų | 91 | 83.7 Ų | 83.7 | 43% | 0.425 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -60.9 | -41.8 | 180 | -75.2 | -166.6 | 169.3 | 0 | 0 | 113.5 | R47 F52 L53 | R47-E50 HydrophobicContact CB-CB 4.29Å; R47-E50 HydrophobicContact CB-CG 4.02Å; R47-E50 VanDerWaalsContact CD-OE1 3.29Å; R47-E50 WeakPolarHBondContact CD-OE1 3.35Å; R47-E50 WeakPolarHBondContact CD-OE2 3.28Å; R47-E50 IonicContact CZ-OE1 3.46Å; R47-E50 IonicContact CZ-OE2 3.75Å; R47-E50 IonicContact NE-OE1 2.88Å; R47-E50 IonicContact NE-OE2 3.86Å; R47-E50 IonicContact NH1-OE1 2.68Å; R47-E50 PolarHBondContact NH1-OE1 3.27Å; R47-E50 IonicContact NH1-OE2 3.95Å; R47-E50 PolarHBondContact NH1-OE2 3.33Å; R47-E50 PolarHBondContact O-N 2.54Å; E50-F52 PolarHBondContact O-N 3.36Å; E50-L53 PolarHBondContact O-N 3.3Å |
| 51 | P | 54.6 | Low | 54.8 | Low | 16 Ų | 16 | 81.9 Ų | 81.9 | 10% | 0.104 | 45% | 0.447 | C | S | . | . | H | α-helix | trans | -41.9 | -42.3 | 162.2 | -43 | 45.5 | 0 | 0 | 0 | 117 | R47 P55 E217 A220 | R47-P51 VanDerWaalsContact O-CD 3.29Å; R47-P51 WeakPolarHBondContact O-CD 3.35Å; P51-P55 WeakPolarHBondContact O-CD 3.46Å; P51-P55 WeakPolarHBondContact O-CG 3.39Å; P51-E217 HydrophobicContact CB-CB 4.17Å; P51-E217 HydrophobicContact CB-CG 4.48Å; P51-E217 WeakPolarHBondContact CB-O 3.41Å; P51-E217 WeakPolarHBondContact CG-O 3.17Å; P51-A220 HydrophobicContact CG-CB 4.23Å |
| 52 | F | 55.1 | Low | 54.1 | Low | 114 Ų | 114 | 86.2 Ų | 86.2 | 50% | 0.5 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -98.2 | -21.5 | -171.5 | -64.5 | -82.5 | 0 | 0 | 0 | 112.4 | P48 S49 E50 P55 Y56 | P48-F52 WeakPolarHBondContact O-CD2 3.48Å; S49-F52 CarbonylContact O-C 3.58Å; S49-F52 PolarHBondContact O-N 3.01Å; E50-F52 PolarHBondContact O-N 3.36Å; F52-P55 WeakPolarHBondContact O-CD 3.39Å; F52-Y56 WeakPolarHBondContact O-CB 3.36Å; F52-Y56 PolarHBondContact O-N 2.94Å |
| 53 | L | 53.1 | Low | 53.3 | Low | 90 Ų | 90 | 91.1 Ų | 91.1 | 47% | 0.471 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -69 | -39.4 | -176.5 | -160.7 | 72.7 | 0 | 0 | 0 | 111.5 | S49 E50 L57 | S49-L53 WeakPolarHBondContact O-CB 3.29Å; S49-L53 PolarHBondContact O-N 3.39Å; E50-L53 PolarHBondContact O-N 3.3Å; L53-L57 HydrophobicContact CD2-CD1 4.49Å; L53-L57 HydrophobicContact CG-CD1 3.94Å; L53-L57 VanDerWaalsContact O-CB 3.31Å; L53-L57 WeakPolarHBondContact O-CB 3.36Å; L53-L57 WeakPolarHBondContact O-CD1 3.36Å; L53-L57 WeakPolarHBondContact O-CG 3.4Å; L53-L57 PolarHBondContact O-N 3.23Å |
| 54 | T | 56.5 | Low | 52.2 | Low | 86 Ų | 86 | 91.3 Ų | 91.3 | 53% | 0.528 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -71.2 | -44.2 | -179.2 | -45.5 | 0 | 0 | 0 | 0 | 112.6 | L57 L58 | T54-L57 PolarHBondContact O-N 3.4Å; T54-L58 HydrophobicContact CG2-CD1 3.64Å; T54-L58 HydrophobicContact CG2-CG 4.49Å; T54-L58 VanDerWaalsContact O-CB 3.31Å; T54-L58 WeakPolarHBondContact O-CB 3.37Å; T54-L58 VanDerWaalsContact O-CG 3.29Å; T54-L58 WeakPolarHBondContact O-CG 3.43Å; T54-L58 PolarHBondContact O-N 3.07Å |
| 55 | P | 55.7 | Low | 51.8 | Low | 73 Ų | 73 | 95.1 Ų | 95.1 | 47% | 0.474 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -64.2 | -38.2 | 169.9 | -21.4 | 32.5 | 0 | 0 | 0 | 113.8 | P51 F52 L57 L58 G59 | P51-P55 WeakPolarHBondContact O-CD 3.46Å; P51-P55 WeakPolarHBondContact O-CG 3.39Å; F52-P55 WeakPolarHBondContact O-CD 3.39Å; P55-L57 VanDerWaalsContact C-N 3.28Å; P55-L57 PolarHBondContact O-N 2.87Å; P55-L58 PolarHBondContact O-N 3.33Å; P55-G59 PolarHBondContact O-N 3.35Å |
| 56 | Y | 53.1 | Low | 51.2 | Low | 124 Ų | 124 | 102.3 Ų | 102.3 | 49% | 0.486 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -65.4 | -29.4 | 177 | -179.3 | -99.1 | 0 | 0 | 0 | 113.3 | F52 K62 | F52-Y56 WeakPolarHBondContact O-CB 3.36Å; F52-Y56 PolarHBondContact O-N 2.94Å; Y56-K62 VanDerWaalsContact CE1-CE 3.45Å; Y56-K62 VanDerWaalsContact CE1-NZ 3.3Å; Y56-K62 VanDerWaalsContact CZ-NZ 3.28Å; Y56-K62 PolarHBondContact OH-NZ 2.87Å |
| 57 | L | 53.6 | Low | 50.7 | Low | 106 Ų | 106 | 112.4 Ų | 112.4 | 56% | 0.555 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -90.2 | -21.7 | 177.4 | -68.1 | 173.2 | 0 | 0 | 0 | 113.5 | L53 T54 P55 | L53-L57 HydrophobicContact CD2-CD1 4.49Å; L53-L57 HydrophobicContact CG-CD1 3.94Å; L53-L57 VanDerWaalsContact O-CB 3.31Å; L53-L57 WeakPolarHBondContact O-CB 3.36Å; L53-L57 WeakPolarHBondContact O-CD1 3.36Å; L53-L57 WeakPolarHBondContact O-CG 3.4Å; L53-L57 PolarHBondContact O-N 3.23Å; T54-L57 PolarHBondContact O-N 3.4Å; P55-L57 VanDerWaalsContact C-N 3.28Å; P55-L57 PolarHBondContact O-N 2.87Å |
| 58 | L | 54 | Low | 50 | Low | 139 Ų | 139 | 115.3 Ų | 115.3 | 73% | 0.728 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -102.6 | -1.8 | -178.9 | -67.9 | 171 | 0 | 0 | 0 | 113.9 | T54 P55 | T54-L58 HydrophobicContact CG2-CD1 3.64Å; T54-L58 HydrophobicContact CG2-CG 4.49Å; T54-L58 VanDerWaalsContact O-CB 3.31Å; T54-L58 WeakPolarHBondContact O-CB 3.37Å; T54-L58 VanDerWaalsContact O-CG 3.29Å; T54-L58 WeakPolarHBondContact O-CG 3.43Å; T54-L58 PolarHBondContact O-N 3.07Å; P55-L58 PolarHBondContact O-N 3.33Å |
| 59 | G | 53.4 | Low | 49.8 | Very low | 26 Ų | 26 | 119.8 Ų | 119.8 | 27% | 0.268 | 61% | 0.613 | S | S | . | * | S | Bend | trans | -68.3 | 153 | 175 | 0 | 0 | 0 | 0 | 0 | 112.5 | P55 D61 | P55-G59 PolarHBondContact O-N 3.35Å; G59-D61 PolarHBondContact O-N 2.96Å |
| 60 | P | 49 | Very low | 49.9 | Very low | 129 Ų | 129 | 121.8 Ų | 121.8 | 84% | 0.838 | 62% | 0.624 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.3 | -8.1 | -174.2 | -17.7 | 31.7 | 0 | 0 | 0 | 114.9 | ||
| 61 | D | 46.6 | Very low | 49.7 | Very low | 130 Ų | 130 | 127 Ų | 127 | 70% | 0.695 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93 | -12.6 | -163.8 | -51.8 | -44.8 | 0 | 0 | 0 | 114 | G59 N63 L64 | G59-D61 PolarHBondContact O-N 2.96Å; D61-N63 PolarHBondContact O-N 3.45Å; D61-L64 PolarHBondContact O-N 3.38Å |
| 62 | K | 47.6 | Very low | 49.9 | Very low | 115 Ų | 115 | 130.8 Ų | 130.8 | 50% | 0.5 | 67% | 0.67 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -83.6 | 39.6 | -177 | -73.4 | -79.2 | -178.3 | 174.7 | 0 | 113.7 | Y56 | Y56-K62 VanDerWaalsContact CE1-CE 3.45Å; Y56-K62 VanDerWaalsContact CE1-NZ 3.3Å; Y56-K62 VanDerWaalsContact CZ-NZ 3.28Å; Y56-K62 PolarHBondContact OH-NZ 2.87Å |
| 63 | N | 49.5 | Very low | 50.9 | Low | 153 Ų | 153 | 130.2 Ų | 130.2 | 82% | 0.818 | 67% | 0.672 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -117.1 | 15.7 | 152.1 | -126.2 | 7.2 | 0 | 0 | 0 | 113.5 | D61 | D61-N63 PolarHBondContact O-N 3.45Š|
| 64 | L | 42.8 | Very low | 52.1 | Low | 147 Ų | 147 | 136.2 Ų | 136.2 | 77% | 0.77 | 69% | 0.688 | S | S | * | * | S | Bend | trans | -148 | 136.4 | 179.4 | -70.8 | 173.4 | 0 | 0 | 0 | 114.6 | D61 | D61-L64 PolarHBondContact O-N 3.38Š|
| 65 | T | 40.4 | Very low | 53.2 | Low | 126 Ų | 126 | 138.4 Ų | 138.4 | 77% | 0.773 | 70% | 0.696 | S | S | * | * | trans | 24.4 | 130.9 | 153.7 | 38.4 | 0 | 0 | 0 | 0 | 120.6 | R67 | T65-R67 PolarHBondContact O-N 3.41Š| ||
| 66 | E | 42.2 | Very low | 54.3 | Low | 200 Ų | 200 | 139.9 Ų | 139.9 | 94% | 0.935 | 70% | 0.7 | S | S | * | * | trans | -42 | 97.8 | 156.7 | -72.5 | 177.4 | 137.6 | 0 | 0 | 111.4 | ||||
| 67 | R | 41.6 | Very low | 55.5 | Low | 233 Ų | 233 | 137 Ų | 137 | 88% | 0.879 | 70% | 0.695 | S | S | * | * | trans | -94.4 | 116 | 143.2 | -90.5 | -168.7 | -167.7 | -125.7 | 3.4 | 106.4 | T65 E69 | T65-R67 PolarHBondContact O-N 3.41Å; R67-E69 PolarHBondContact O-N 3.39Å | ||
| 68 | E | 43.8 | Very low | 56.6 | Low | 191 Ų | 191 | 137.3 Ų | 137.3 | 89% | 0.893 | 70% | 0.697 | S | S | * | * | trans | -50.9 | 100.4 | 167.9 | -162.6 | 170.4 | -169.1 | 0 | 0 | 108.4 | ||||
| 69 | E | 45.8 | Very low | 57.8 | Low | 152 Ų | 152 | 137.3 Ų | 137.3 | 71% | 0.71 | 69% | 0.691 | S | S | * | * | trans | -65.1 | 135.3 | 169 | -77.7 | -157.5 | 166.5 | 0 | 0 | 108.1 | R67 K71 | R67-E69 PolarHBondContact O-N 3.39Å; E69-K71 PolarHBondContact O-N 3.18Å | ||
| 70 | P | 51.8 | Low | 59 | Low | 116 Ų | 116 | 139.2 Ų | 139.2 | 75% | 0.753 | 70% | 0.697 | S | S | * | * | trans | -57.1 | 130.3 | 177.6 | 24.7 | -31.5 | 0 | 0 | 0 | 108.2 | ||||
| 71 | K | 52.6 | Low | 60.3 | Low | 200 Ų | 200 | 135 Ų | 135 | 87% | 0.87 | 67% | 0.667 | S | S | * | * | trans | -42 | 119.1 | 177.2 | -90.7 | 175.7 | 177.9 | 161 | 0 | 108.5 | E69 D73 | E69-K71 PolarHBondContact O-N 3.18Å; K71-D73 PolarHBondContact O-N 3.44Å; K71-D73 VanDerWaalsContact O-N 3.1Å | ||
| 72 | P | 59.1 | Low | 61.9 | Low | 97 Ų | 97 | 136 Ų | 136 | 63% | 0.63 | 66% | 0.661 | S | S | * | * | trans | -58.8 | 125.9 | -176.9 | 22.2 | -32 | 0 | 0 | 0 | 107.6 | R74 V77 | P72-R74 PolarHBondContact O-N 3.4Å; P72-V77 HydrophobicContact CB-CG2 3.88Å | ||
| 73 | D | 77.3 | Confident | 63.5 | Low | 101 Ų | 101 | 134.7 Ų | 134.7 | 54% | 0.54 | 66% | 0.66 | S | S | . | * | trans | -57.8 | 112.3 | 177.7 | -179.8 | -0.7 | 0 | 0 | 0 | 107.5 | K71 L75 L76 V77 | K71-D73 PolarHBondContact O-N 3.44Å; K71-D73 VanDerWaalsContact O-N 3.1Å; D73-L75 PolarHBondContact O-N 2.63Å; D73-L75 VanDerWaalsContact O-N 3.12Å; D73-L75 WeakPolarHBondContact OD1-CB 3.38Å; D73-L75 PolarHBondContact OD1-N 3.49Å; D73-L75 VanDerWaalsContact OD1-N 3.12Å; D73-L76 HydrophobicContact CB-CB 3.89Å; D73-L76 WeakPolarHBondContact O-CA 3.34Å; D73-L76 WeakPolarHBondContact O-CB 3.34Å; D73-L76 PolarHBondContact O-N 3.01Å; D73-V77 PolarHBondContact O-N 3.31Å | ||
| 74 | R | 77.4 | Confident | 64.9 | Low | 216 Ų | 216 | 128.7 Ų | 128.7 | 82% | 0.815 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -56.4 | -33.2 | -175.2 | -67.1 | -179.3 | 176.2 | -178.8 | -2.1 | 110.9 | P72 V77 L78 | P72-R74 PolarHBondContact O-N 3.4Å; R74-V77 PolarHBondContact O-N 2.73Å; R74-L78 WeakPolarHBondContact O-CB 3.36Å; R74-L78 VanDerWaalsContact O-CG 3.29Å; R74-L78 WeakPolarHBondContact O-CG 3.44Å; R74-L78 PolarHBondContact O-N 2.84Å |
| 75 | L | 78.9 | Confident | 66.7 | Low | 133 Ų | 133 | 124.2 Ų | 124.2 | 70% | 0.696 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -69 | -39.4 | 178.5 | -142.3 | 93 | 0 | 0 | 0 | 111.2 | D73 L78 K79 | D73-L75 PolarHBondContact O-N 2.63Å; D73-L75 VanDerWaalsContact O-N 3.12Å; D73-L75 WeakPolarHBondContact OD1-CB 3.38Å; D73-L75 PolarHBondContact OD1-N 3.49Å; D73-L75 VanDerWaalsContact OD1-N 3.12Å; L75-L78 PolarHBondContact O-N 3.33Å; L75-K79 WeakPolarHBondContact O-CB 3.23Å; L75-K79 PolarHBondContact O-N 3.5Å |
| 76 | L | 78.9 | Confident | 68.6 | Low | 104 Ų | 104 | 122 Ų | 122 | 55% | 0.545 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -65 | -45.2 | 175.1 | -176.1 | 65.2 | 0 | 0 | 0 | 110.9 | D73 L78 K79 V80 | D73-L76 HydrophobicContact CB-CB 3.89Å; D73-L76 WeakPolarHBondContact O-CA 3.34Å; D73-L76 WeakPolarHBondContact O-CB 3.34Å; D73-L76 PolarHBondContact O-N 3.01Å; L76-L78 PolarHBondContact O-N 3.1Å; L76-K79 PolarHBondContact O-N 3.29Å; L76-V80 WeakPolarHBondContact O-CG2 3.33Å; L76-V80 PolarHBondContact O-N 3.31Å |
| 77 | V | 78.3 | Confident | 70.3 | Confident | 64 Ų | 64 | 118 Ų | 118 | 39% | 0.388 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -59.7 | -46.6 | 176.2 | 177.1 | 0 | 0 | 0 | 0 | 110.9 | P72 D73 R74 K79 V80 L81 | P72-V77 HydrophobicContact CB-CG2 3.88Å; D73-V77 PolarHBondContact O-N 3.31Å; R74-V77 PolarHBondContact O-N 2.73Å; V77-K79 VanDerWaalsContact C-N 3.32Å; V77-K79 PolarHBondContact O-N 3.47Å; V77-V80 PolarHBondContact O-N 3.41Å; V77-L81 HydrophobicContact CG1-CD1 4.01Å; V77-L81 HydrophobicContact CG1-CG 4.47Å; V77-L81 WeakPolarHBondContact O-CB 3.44Å; V77-L81 VanDerWaalsContact O-CG 3.29Å; V77-L81 WeakPolarHBondContact O-CG 3.17Å; V77-L81 PolarHBondContact O-N 3.49Å |
| 78 | L | 78.1 | Confident | 72 | Confident | 112 Ų | 112 | 107.2 Ų | 107.2 | 59% | 0.586 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -62 | -39 | 176.4 | -73.6 | 169.4 | 0 | 0 | 0 | 112.3 | R74 L75 L76 W82 | R74-L78 WeakPolarHBondContact O-CB 3.36Å; R74-L78 VanDerWaalsContact O-CG 3.29Å; R74-L78 WeakPolarHBondContact O-CG 3.44Å; R74-L78 PolarHBondContact O-N 2.84Å; L75-L78 PolarHBondContact O-N 3.33Å; L76-L78 PolarHBondContact O-N 3.1Å; L78-W82 WeakPolarHBondContact O-CB 3.36Å; L78-W82 PolarHBondContact O-N 2.85Å |
| 79 | K | 77.9 | Confident | 73.8 | Confident | 138 Ų | 138 | 99.4 Ų | 99.4 | 60% | 0.6 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -67.3 | -41.1 | 177.8 | -169.7 | 176.8 | -177.6 | 179.3 | 0 | 112.2 | L75 L76 V77 W82 N83 | L75-K79 WeakPolarHBondContact O-CB 3.23Å; L75-K79 PolarHBondContact O-N 3.5Å; L76-K79 PolarHBondContact O-N 3.29Å; V77-K79 VanDerWaalsContact C-N 3.32Å; V77-K79 PolarHBondContact O-N 3.47Å; K79-W82 PolarHBondContact O-N 3.35Å; K79-N83 VanDerWaalsContact O-CG 3.29Å; K79-N83 PolarHBondContact O-N 3.37Å; K79-N83 PolarHBondContact O-ND2 3.28Å |
| 80 | V | 78.6 | Confident | 75.7 | Confident | 66 Ų | 66 | 96.9 Ų | 96.9 | 40% | 0.4 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -63.1 | -48.7 | 174.9 | 171.6 | 0 | 0 | 0 | 0 | 110.2 | L76 V77 W82 N83 D84 | L76-V80 WeakPolarHBondContact O-CG2 3.33Å; L76-V80 PolarHBondContact O-N 3.31Å; V77-V80 PolarHBondContact O-N 3.41Å; V80-W82 VanDerWaalsContact C-N 3.27Å; V80-W82 PolarHBondContact O-N 3.23Å; V80-N83 PolarHBondContact O-N 3.4Å; V80-N83 VanDerWaalsContact O-N 3.15Å; V80-D84 PolarHBondContact O-N 3.16Å |
| 81 | L | 77.4 | Confident | 77.2 | Confident | 42 Ų | 42 | 93.5 Ų | 93.5 | 22% | 0.22 | 47% | 0.469 | C | S | . | . | H | α-helix | trans | -58 | -39.7 | 176.1 | -72.3 | 171 | 0 | 0 | 0 | 112.4 | P48 V77 F85 L221 | P48-L81 HydrophobicContact CB-CD2 4.47Å; V77-L81 HydrophobicContact CG1-CD1 4.01Å; V77-L81 HydrophobicContact CG1-CG 4.47Å; V77-L81 WeakPolarHBondContact O-CB 3.44Å; V77-L81 VanDerWaalsContact O-CG 3.29Å; V77-L81 WeakPolarHBondContact O-CG 3.17Å; V77-L81 PolarHBondContact O-N 3.49Å; L81-F85 VanDerWaalsContact O-CB 3.24Å; L81-F85 WeakPolarHBondContact O-CB 3.35Å; L81-F85 PolarHBondContact O-N 3.23Å; L81-L221 HydrophobicContact CD2-CD1 4.42Å; L81-L221 HydrophobicContact CD2-CD2 4.35Å |
| 82 | W | 79.9 | Confident | 78.6 | Confident | 149 Ų | 149 | 88.7 Ų | 88.7 | 56% | 0.564 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -67.3 | -40.9 | 177.1 | -177.3 | -109 | 0 | 0 | 0 | 112.7 | L78 K79 V80 F85 L86 | L78-W82 WeakPolarHBondContact O-CB 3.36Å; L78-W82 PolarHBondContact O-N 2.85Å; K79-W82 PolarHBondContact O-N 3.35Å; V80-W82 VanDerWaalsContact C-N 3.27Å; V80-W82 PolarHBondContact O-N 3.23Å; W82-F85 HydrophobicContact CE3-CD1 4.1Å; W82-F85 HydrophobicContact CH2-CD1 4.33Å; W82-F85 HydrophobicContact CH2-CE1 4.27Å; W82-F85 AromaticContact CZ3-CD1 3.86Å; W82-F85 HydrophobicContact CZ3-CD1 3.86Å; W82-F85 HydrophobicContact CZ3-CE1 4.02Å; W82-F85 WeakPolarHBondContact O-CB 3.39Å; W82-F85 PolarHBondContact O-N 2.89Å; W82-L86 HydrophobicContact CZ2-CD1 4.42Å; W82-L86 HydrophobicContact CZ2-CD2 4.23Å; W82-L86 HydrophobicContact CZ2-CG 4.36Å; W82-L86 WeakPolarHBondContact O-CG 3.49Å; W82-L86 PolarHBondContact O-N 3.15Å |
| 83 | N | 81.8 | Confident | 79.8 | Confident | 88 Ų | 88 | 87.4 Ų | 87.4 | 47% | 0.471 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -66.4 | -42.6 | 175.5 | -71.8 | -21.1 | 0 | 0 | 0 | 111.6 | K79 V80 F85 L86 M87 | K79-N83 VanDerWaalsContact O-CG 3.29Å; K79-N83 PolarHBondContact O-N 3.37Å; K79-N83 PolarHBondContact O-ND2 3.28Å; V80-N83 PolarHBondContact O-N 3.4Å; V80-N83 VanDerWaalsContact O-N 3.15Å; N83-F85 VanDerWaalsContact C-N 3.31Å; N83-F85 PolarHBondContact O-N 2.88Å; N83-L86 PolarHBondContact O-N 2.95Å; N83-M87 WeakPolarHBondContact O-CB 3.28Å; N83-M87 PolarHBondContact O-N 3.44Å |
| 84 | D | 79 | Confident | 80.2 | Confident | 27 Ų | 27 | 82.7 Ų | 82.7 | 14% | 0.144 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -62.2 | -40.9 | 174.6 | -75.7 | -30.7 | 0 | 0 | 0 | 111.4 | V80 M87 C88 R218 L221 | V80-D84 PolarHBondContact O-N 3.16Å; D84-M87 PolarHBondContact O-N 3.48Å; D84-C88 WeakPolarHBondContact O-CB 3.24Å; D84-C88 PolarHBondContact O-N 2.98Å; D84-C88 PolarHBondContact O-SG 3.24Å; D84-R218 HydrophobicContact CB-CG 4.25Å; D84-R218 IonicContact OD1-CZ 3.16Å; D84-R218 IonicContact OD1-NE 2.97Å; D84-R218 PolarHBondContact OD1-NE 3.28Å; D84-R218 IonicContact OD1-NH2 2.73Å; D84-R218 PolarHBondContact OD1-NH2 3.25Å; D84-L221 HydrophobicContact CB-CD2 4.18Å |
| 85 | F | 79 | Confident | 80.8 | Confident | 54 Ų | 54 | 75.8 Ų | 75.8 | 24% | 0.237 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -57.3 | -55.1 | 173.2 | 175.4 | -89.1 | 0 | 0 | 0 | 111.3 | L81 W82 N83 M87 C88 Y89 L221 V225 | L81-F85 VanDerWaalsContact O-CB 3.24Å; L81-F85 WeakPolarHBondContact O-CB 3.35Å; L81-F85 PolarHBondContact O-N 3.23Å; W82-F85 HydrophobicContact CE3-CD1 4.1Å; W82-F85 HydrophobicContact CH2-CD1 4.33Å; W82-F85 HydrophobicContact CH2-CE1 4.27Å; W82-F85 AromaticContact CZ3-CD1 3.86Å; W82-F85 HydrophobicContact CZ3-CD1 3.86Å; W82-F85 HydrophobicContact CZ3-CE1 4.02Å; W82-F85 WeakPolarHBondContact O-CB 3.39Å; W82-F85 PolarHBondContact O-N 2.89Å; N83-F85 VanDerWaalsContact C-N 3.31Å; N83-F85 PolarHBondContact O-N 2.88Å; F85-M87 VanDerWaalsContact C-N 3.29Å; F85-M87 PolarHBondContact O-N 3.27Å; F85-C88 PolarHBondContact O-N 3.19Å; F85-Y89 HydrophobicContact CD1-CD2 4.21Å; F85-Y89 AromaticContact CD2-CD2 3.63Å; F85-Y89 HydrophobicContact CD2-CD2 3.63Å; F85-Y89 AromaticContact CD2-CE2 3.48Å; F85-Y89 HydrophobicContact CD2-CE2 3.48Å; F85-Y89 VanDerWaalsContact CD2-CE2 3.48Å; F85-Y89 HydrophobicContact CE1-CD2 4.07Å; F85-Y89 AromaticContact CE2-CD2 3.5Å; F85-Y89 HydrophobicContact CE2-CD2 3.5Å; F85-Y89 AromaticContact CE2-CE2 3.3Å; F85-Y89 HydrophobicContact CE2-CE2 3.3Å; F85-Y89 AromaticContact CG-CD2 3.99Å; F85-Y89 HydrophobicContact CG-CD2 3.99Å; F85-Y89 HydrophobicContact CG-CE2 4.27Å; F85-Y89 AromaticContact CZ-CD2 3.72Å; F85-Y89 HydrophobicContact CZ-CD2 3.72Å; F85-Y89 AromaticContact CZ-CE2 3.95Å; F85-Y89 HydrophobicContact CZ-CE2 3.95Å; F85-Y89 VanDerWaalsContact O-CD2 3.24Å; F85-Y89 WeakPolarHBondContact O-CD2 3.45Å; F85-Y89 PolarHBondContact O-N 3.2Å; F85-L221 HydrophobicContact CB-CD2 4.27Å; F85-V225 HydrophobicContact CD2-CG2 4.13Å; F85-V225 HydrophobicContact CE2-CG1 3.94Å; F85-V225 HydrophobicContact CE2-CG2 4Å |
| 86 | L | 81.2 | Confident | 81.4 | Confident | 78 Ų | 78 | 70.3 Ų | 70.3 | 41% | 0.408 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -59.2 | -41.6 | 179.6 | -74.7 | 174.1 | 0 | 0 | 0 | 111.5 | W82 N83 S90 | W82-L86 HydrophobicContact CZ2-CD1 4.42Å; W82-L86 HydrophobicContact CZ2-CD2 4.23Å; W82-L86 HydrophobicContact CZ2-CG 4.36Å; W82-L86 WeakPolarHBondContact O-CG 3.49Å; W82-L86 PolarHBondContact O-N 3.15Å; N83-L86 PolarHBondContact O-N 2.95Å; L86-S90 WeakPolarHBondContact O-CB 3.36Å; L86-S90 PolarHBondContact O-N 2.99Å; L86-S90 PolarHBondContact O-OG 2.9Å |
| 87 | M | 78.8 | Confident | 82.2 | Confident | 118 Ų | 118 | 65.8 Ų | 65.8 | 58% | 0.581 | 34% | 0.339 | S | S | * | . | H | α-helix | trans | -64.4 | -43.7 | 178.8 | -172.3 | 173.7 | 177.3 | 0 | 0 | 112.1 | N83 D84 F85 S90 R218 | N83-M87 WeakPolarHBondContact O-CB 3.28Å; N83-M87 PolarHBondContact O-N 3.44Å; D84-M87 PolarHBondContact O-N 3.48Å; F85-M87 VanDerWaalsContact C-N 3.29Å; F85-M87 PolarHBondContact O-N 3.27Å; M87-S90 PolarHBondContact O-N 3.23Å; M87-R218 VanDerWaalsContact SD-CZ 3.59Å; M87-R218 PolarHBondContact SD-NH1 3.29Å; M87-R218 PolarHBondContact SD-NH2 3.46Å |
| 88 | C | 75.9 | Confident | 82.9 | Confident | 6 Ų | 6 | 62.9 Ų | 62.9 | 4% | 0.041 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -61.7 | -48.6 | 177.9 | -68.1 | 0 | 0 | 0 | 0 | 111.6 | D84 F85 S90 S91 L214 R218 V222 | D84-C88 WeakPolarHBondContact O-CB 3.24Å; D84-C88 PolarHBondContact O-N 2.98Å; D84-C88 PolarHBondContact O-SG 3.24Å; F85-C88 PolarHBondContact O-N 3.19Å; C88-S90 VanDerWaalsContact C-N 3.29Å; C88-S90 PolarHBondContact O-N 3.34Å; C88-S91 PolarHBondContact O-N 3.23Å; C88-L214 HydrophobicContact CB-CD2 4.12Å; C88-L214 WeakPolarHBondContact SG-CD2 3.29Å; C88-R218 VanDerWaalsContact SG-CD 3.57Å; C88-V222 HydrophobicContact CB-CG2 3.89Å |
| 89 | Y | 82.3 | Confident | 83.8 | Confident | 27 Ų | 27 | 60.4 Ų | 60.4 | 11% | 0.106 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -81.9 | -4.3 | -175.2 | -70 | -66.4 | 0 | 0 | 0 | 114.6 | F85 S91 L94 L95 S98 V225 N226 | F85-Y89 HydrophobicContact CD1-CD2 4.21Å; F85-Y89 AromaticContact CD2-CD2 3.63Å; F85-Y89 HydrophobicContact CD2-CD2 3.63Å; F85-Y89 AromaticContact CD2-CE2 3.48Å; F85-Y89 HydrophobicContact CD2-CE2 3.48Å; F85-Y89 VanDerWaalsContact CD2-CE2 3.48Å; F85-Y89 HydrophobicContact CE1-CD2 4.07Å; F85-Y89 AromaticContact CE2-CD2 3.5Å; F85-Y89 HydrophobicContact CE2-CD2 3.5Å; F85-Y89 AromaticContact CE2-CE2 3.3Å; F85-Y89 HydrophobicContact CE2-CE2 3.3Å; F85-Y89 AromaticContact CG-CD2 3.99Å; F85-Y89 HydrophobicContact CG-CD2 3.99Å; F85-Y89 HydrophobicContact CG-CE2 4.27Å; F85-Y89 AromaticContact CZ-CD2 3.72Å; F85-Y89 HydrophobicContact CZ-CD2 3.72Å; F85-Y89 AromaticContact CZ-CE2 3.95Å; F85-Y89 HydrophobicContact CZ-CE2 3.95Å; F85-Y89 VanDerWaalsContact O-CD2 3.24Å; F85-Y89 WeakPolarHBondContact O-CD2 3.45Å; F85-Y89 PolarHBondContact O-N 3.2Å; Y89-S91 VanDerWaalsContact C-N 3.3Å; Y89-L94 HydrophobicContact CD1-CD2 4.26Å; Y89-L94 HydrophobicContact CE1-CD2 4.26Å; Y89-L95 HydrophobicContact CD1-CD1 3.72Å; Y89-L95 HydrophobicContact CG-CD1 4.43Å; Y89-S98 VanDerWaalsContact CE1-OG 3.28Å; Y89-S98 WeakPolarHBondContact CE1-OG 3.48Å; Y89-V225 HydrophobicContact CE2-CG1 4.29Å; Y89-V225 WeakPolarHBondContact OH-CG1 3.23Å; Y89-N226 PolarHBondContact OH-OD1 2.83Å |
| 90 | S | 84.5 | Confident | 84.7 | Confident | 99 Ų | 99 | 53.8 Ų | 53.8 | 69% | 0.692 | 28% | 0.282 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.6 | -22.1 | 170.4 | -67.2 | 0 | 0 | 0 | 0 | 112.7 | L86 M87 C88 R92 | L86-S90 WeakPolarHBondContact O-CB 3.36Å; L86-S90 PolarHBondContact O-N 2.99Å; L86-S90 PolarHBondContact O-OG 2.9Å; M87-S90 PolarHBondContact O-N 3.23Å; C88-S90 VanDerWaalsContact C-N 3.29Å; C88-S90 PolarHBondContact O-N 3.34Å; S90-R92 PolarHBondContact O-N 3.41Å |
| 91 | S | 83.6 | Confident | 85.6 | Confident | 45 Ų | 45 | 51.9 Ų | 51.9 | 32% | 0.315 | 27% | 0.268 | S | S | . | . | S | Bend | trans | -74.4 | 112.7 | 174.9 | 165.3 | 0 | 0 | 0 | 0 | 110.3 | C88 Y89 L94 L95 | C88-S91 PolarHBondContact O-N 3.23Å; Y89-S91 VanDerWaalsContact C-N 3.3Å; S91-L94 PolarHBondContact O-N 3.18Å; S91-L94 WeakPolarHBondContact OG-CB 3.31Å; S91-L94 PolarHBondContact OG-N 3.33Å; S91-L95 WeakPolarHBondContact O-CB 3.4Å; S91-L95 PolarHBondContact O-N 3.02Å |
| 92 | R | 83.2 | Confident | 86.6 | Confident | 98 Ų | 98 | 50 Ų | 50 | 37% | 0.37 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -55 | -48.5 | 179.5 | -171.9 | -170.6 | -179.8 | -156.8 | -4.2 | 112.8 | S90 L94 L95 C96 E162 S272 S276 | S90-R92 PolarHBondContact O-N 3.41Å; R92-L94 VanDerWaalsContact C-N 3.33Å; R92-L94 PolarHBondContact O-N 3.44Å; R92-L95 PolarHBondContact O-N 2.93Å; R92-C96 WeakPolarHBondContact O-CB 3.48Å; R92-C96 PolarHBondContact O-N 3.41Å; R92-C96 PolarHBondContact O-SG 3.33Å; R92-E162 IonicContact CZ-OE1 3.93Å; R92-E162 IonicContact NH2-OE1 3.54Å; R92-S272 PolarHBondContact NH2-O 3Å; R92-S272 PolarHBondContact NH2-OG 2.96Å; R92-S276 PolarHBondContact NH1-OG 3.49Å; R92-S276 PolarHBondContact NH2-OG 3.49Å |
| 93 | P | 83.9 | Confident | 87.4 | Confident | 70 Ų | 70 | 45 Ų | 45 | 46% | 0.455 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -58.8 | -44 | 177.5 | -24.4 | 34.9 | 0 | 0 | 0 | 112.6 | C96 W97 | P93-C96 PolarHBondContact O-N 2.88Å; P93-W97 PolarHBondContact O-N 2.91Å; P93-W97 VanDerWaalsContact O-N 3.07Å |
| 94 | L | 85.4 | Confident | 88.2 | Confident | 3 Ų | 3 | 40.8 Ų | 40.8 | 2% | 0.016 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -65.1 | -45.1 | -179.3 | -168.1 | 157.9 | 0 | 0 | 0 | 111.2 | Y89 S91 R92 C96 W97 S98 N213 L214 V222 | Y89-L94 HydrophobicContact CD1-CD2 4.26Å; Y89-L94 HydrophobicContact CE1-CD2 4.26Å; S91-L94 PolarHBondContact O-N 3.18Å; S91-L94 WeakPolarHBondContact OG-CB 3.31Å; S91-L94 PolarHBondContact OG-N 3.33Å; R92-L94 VanDerWaalsContact C-N 3.33Å; R92-L94 PolarHBondContact O-N 3.44Å; L94-C96 VanDerWaalsContact C-N 3.34Å; L94-C96 PolarHBondContact O-N 2.99Å; L94-W97 PolarHBondContact O-N 2.97Å; L94-S98 WeakPolarHBondContact O-CB 3.22Å; L94-S98 PolarHBondContact O-N 3.04Å; L94-N213 HydrophobicContact CD1-CB 4.39Å; L94-L214 HydrophobicContact CD1-CD2 3.58Å; L94-L214 HydrophobicContact CD1-CG 3.85Å; L94-V222 HydrophobicContact CD2-CG1 4.47Å |
| 95 | L | 90 | Very high | 89.1 | Confident | 70 Ų | 70 | 39.9 Ų | 39.9 | 37% | 0.366 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -58.8 | -45 | 175.7 | -177.4 | 65.9 | 0 | 0 | 0 | 111.4 | Y89 S91 R92 S98 V99 | Y89-L95 HydrophobicContact CD1-CD1 3.72Å; Y89-L95 HydrophobicContact CG-CD1 4.43Å; S91-L95 WeakPolarHBondContact O-CB 3.4Å; S91-L95 PolarHBondContact O-N 3.02Å; R92-L95 PolarHBondContact O-N 2.93Å; L95-S98 PolarHBondContact O-N 2.93Å; L95-V99 HydrophobicContact CD1-CG2 3.95Å; L95-V99 HydrophobicContact CG-CG2 4.23Å; L95-V99 WeakPolarHBondContact O-CB 3.48Å; L95-V99 VanDerWaalsContact O-CG2 3.23Å; L95-V99 WeakPolarHBondContact O-CG2 3.42Å; L95-V99 PolarHBondContact O-N 2.9Å |
| 96 | C | 92.4 | Very high | 90 | Very high | 18 Ų | 18 | 37.3 Ų | 37.3 | 12% | 0.122 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -59.4 | -48.3 | 177.2 | -73.5 | 0 | 0 | 0 | 0 | 112.2 | R92 P93 L94 W100 E162 F269 | R92-C96 WeakPolarHBondContact O-CB 3.48Å; R92-C96 PolarHBondContact O-N 3.41Å; R92-C96 PolarHBondContact O-SG 3.33Å; P93-C96 PolarHBondContact O-N 2.88Å; L94-C96 VanDerWaalsContact C-N 3.34Å; L94-C96 PolarHBondContact O-N 2.99Å; C96-W100 WeakPolarHBondContact O-CB 3.47Å; C96-W100 PolarHBondContact O-N 3.19Å; C96-E162 PolarHBondContact SG-OE1 2.97Å; C96-F269 HydrophobicContact CB-CE1 4.08Å; C96-F269 WeakPolarHBondContact O-CE1 3.31Å; C96-F269 WeakPolarHBondContact O-CZ 3.5Å |
| 97 | W | 94.6 | Very high | 90.8 | Very high | 9 Ų | 9 | 33.6 Ų | 33.6 | 3% | 0.034 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -64.7 | -41.7 | 178.1 | -72.5 | 114.4 | 0 | 0 | 0 | 112.3 | P93 L94 W101 W157 L165 I205 A206 Q209 I210 | P93-W97 PolarHBondContact O-N 2.91Å; P93-W97 VanDerWaalsContact O-N 3.07Å; L94-W97 PolarHBondContact O-N 2.97Å; W97-W101 VanDerWaalsContact O-CB 3.22Å; W97-W101 WeakPolarHBondContact O-CB 3.33Å; W97-W101 PolarHBondContact O-N 2.84Å; W97-W157 AromaticContact CH2-CE3 3.87Å; W97-W157 HydrophobicContact CH2-CE3 3.87Å; W97-W157 HydrophobicContact CH2-CZ3 4.29Å; W97-W157 HydrophobicContact CZ2-CB 4.29Å; W97-W157 HydrophobicContact CZ2-CE3 4.02Å; W97-L165 HydrophobicContact CD2-CD1 4.29Å; W97-L165 HydrophobicContact CE3-CD1 3.82Å; W97-L165 HydrophobicContact CE3-CD2 3.87Å; W97-L165 HydrophobicContact CE3-CG 4.16Å; W97-L165 HydrophobicContact CH2-CD1 4.39Å; W97-L165 HydrophobicContact CH2-CD2 4.12Å; W97-L165 HydrophobicContact CH2-CG 4.1Å; W97-L165 HydrophobicContact CZ3-CD1 3.9Å; W97-L165 HydrophobicContact CZ3-CD2 3.35Å; W97-L165 HydrophobicContact CZ3-CG 3.71Å; W97-I205 HydrophobicContact CH2-CG2 3.61Å; W97-I205 HydrophobicContact CZ2-CG2 4.46Å; W97-I205 HydrophobicContact CZ3-CG2 3.79Å; W97-A206 HydrophobicContact CE3-CB 3.73Å; W97-A206 HydrophobicContact CZ3-CB 4.24Å; W97-Q209 HydrophobicContact CD2-CB 3.88Å; W97-Q209 HydrophobicContact CD2-CG 4.19Å; W97-Q209 HydrophobicContact CG-CB 3.91Å; W97-Q209 HydrophobicContact CH2-CG 4.35Å; W97-Q209 HydrophobicContact CZ2-CB 4.43Å; W97-Q209 HydrophobicContact CZ2-CG 3.83Å; W97-I210 HydrophobicContact CB-CD1 4.26Å; W97-I210 HydrophobicContact CB-CG1 3.81Å |
| 98 | S | 94.5 | Very high | 91.8 | Very high | 4 Ų | 4 | 29.1 Ų | 29.1 | 3% | 0.028 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -65.2 | -46.8 | 177.5 | 154.8 | 0 | 0 | 0 | 0 | 112.5 | Y89 L94 L95 W100 W101 A102 N226 | Y89-S98 VanDerWaalsContact CE1-OG 3.28Å; Y89-S98 WeakPolarHBondContact CE1-OG 3.48Å; L94-S98 WeakPolarHBondContact O-CB 3.22Å; L94-S98 PolarHBondContact O-N 3.04Å; L95-S98 PolarHBondContact O-N 2.93Å; S98-W100 VanDerWaalsContact C-N 3.34Å; S98-W100 PolarHBondContact O-N 3.02Å; S98-W101 WeakPolarHBondContact O-CB 3.18Å; S98-W101 PolarHBondContact O-N 2.58Å; S98-A102 PolarHBondContact O-N 3.37Å; S98-N226 WeakPolarHBondContact CB-OD1 3.4Å; S98-N226 PolarHBondContact OG-ND2 3.29Å; S98-N226 PolarHBondContact OG-OD1 3.46Å |
| 99 | V | 95.6 | Very high | 92.8 | Very high | 59 Ų | 59 | 31.9 Ų | 31.9 | 36% | 0.358 | 17% | 0.173 | S | C | . | . | H | α-helix | trans | -61.6 | -45.8 | 178.7 | 167.8 | 0 | 0 | 0 | 0 | 110 | L95 W101 A102 L103 F269 | L95-V99 HydrophobicContact CD1-CG2 3.95Å; L95-V99 HydrophobicContact CG-CG2 4.23Å; L95-V99 WeakPolarHBondContact O-CB 3.48Å; L95-V99 VanDerWaalsContact O-CG2 3.23Å; L95-V99 WeakPolarHBondContact O-CG2 3.42Å; L95-V99 PolarHBondContact O-N 2.9Å; V99-W101 VanDerWaalsContact C-N 3.34Å; V99-W101 PolarHBondContact O-N 3.49Å; V99-A102 PolarHBondContact O-N 2.89Å; V99-L103 HydrophobicContact CG1-CD1 3.62Å; V99-L103 HydrophobicContact CG1-CG 4.32Å; V99-L103 WeakPolarHBondContact O-CB 3.25Å; V99-L103 VanDerWaalsContact O-CG 3.23Å; V99-L103 WeakPolarHBondContact O-CG 3.39Å; V99-L103 PolarHBondContact O-N 3.34Å; V99-F269 HydrophobicContact CG1-CZ 4.46Å |
| 100 | W | 97.6 | Very high | 93.6 | Very high | 0 Ų | 0 | 30.6 Ų | 30.6 | 0% | 0 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -59.7 | -45.2 | 174.9 | -175.1 | 87.2 | 0 | 0 | 0 | 111.9 | C96 S98 A102 S104 L165 S169 L202 I203 A206 F269 | C96-W100 WeakPolarHBondContact O-CB 3.47Å; C96-W100 PolarHBondContact O-N 3.19Å; S98-W100 VanDerWaalsContact C-N 3.34Å; S98-W100 PolarHBondContact O-N 3.02Å; W100-A102 PolarHBondContact O-N 3.07Å; W100-S104 WeakPolarHBondContact CZ2-OG 3.5Å; W100-S104 PolarHBondContact NE1-OG 3.47Å; W100-S104 WeakPolarHBondContact O-CB 3.29Å; W100-S104 PolarHBondContact O-N 3.36Å; W100-S104 PolarHBondContact O-OG 2.95Å; W100-L165 HydrophobicContact CB-CD1 3.82Å; W100-L165 HydrophobicContact CB-CD2 4.32Å; W100-L165 HydrophobicContact CD2-CD2 3.4Å; W100-L165 HydrophobicContact CD2-CG 4.44Å; W100-L165 HydrophobicContact CE3-CD2 3.88Å; W100-L165 HydrophobicContact CG-CB 4.37Å; W100-L165 HydrophobicContact CG-CD1 3.85Å; W100-L165 HydrophobicContact CG-CD2 3.55Å; W100-L165 HydrophobicContact CG-CG 4.11Å; W100-L165 HydrophobicContact CZ2-CD2 4.41Å; W100-S169 PolarHBondContact NE1-OG 3.37Å; W100-L202 HydrophobicContact CH2-CB 3.21Å; W100-L202 HydrophobicContact CH2-CD1 3.68Å; W100-L202 HydrophobicContact CH2-CG 4.15Å; W100-L202 HydrophobicContact CZ2-CB 3.68Å; W100-L202 HydrophobicContact CZ2-CD1 3.18Å; W100-L202 HydrophobicContact CZ2-CG 4.12Å; W100-L202 HydrophobicContact CZ3-CB 3.88Å; W100-I203 HydrophobicContact CZ3-CD1 4.22Å; W100-A206 HydrophobicContact CE3-CB 3.84Å; W100-A206 HydrophobicContact CZ3-CB 3.92Å; W100-F269 HydrophobicContact CB-CE1 4.06Å; W100-F269 HydrophobicContact CB-CE2 3.8Å; W100-F269 HydrophobicContact CB-CZ 3.46Å; W100-F269 VanDerWaalsContact CB-CZ 3.46Å; W100-F269 AromaticContact CD1-CD2 3.91Å; W100-F269 AromaticContact CD1-CE2 3.74Å; W100-F269 HydrophobicContact CG-CE2 4.19Å; W100-F269 HydrophobicContact CG-CZ 4.23Å |
| 101 | W | 97 | Very high | 94.2 | Very high | 25 Ų | 25 | 25.9 Ų | 25.9 | 10% | 0.095 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -58.1 | -48.9 | 179.7 | -173.2 | 110.2 | 0 | 0 | 0 | 110.6 | W97 S98 V99 T105 I203 A206 T207 I210 F223 N226 T227 A230 | W97-W101 VanDerWaalsContact O-CB 3.22Å; W97-W101 WeakPolarHBondContact O-CB 3.33Å; W97-W101 PolarHBondContact O-N 2.84Å; S98-W101 WeakPolarHBondContact O-CB 3.18Å; S98-W101 PolarHBondContact O-N 2.58Å; V99-W101 VanDerWaalsContact C-N 3.34Å; V99-W101 PolarHBondContact O-N 3.49Å; W101-T105 HydrophobicContact CZ3-CG2 4.39Å; W101-T105 WeakPolarHBondContact O-CB 3.41Å; W101-T105 PolarHBondContact O-N 3.25Å; W101-T105 PolarHBondContact O-OG1 3.48Å; W101-I203 HydrophobicContact CB-CD1 4.48Å; W101-I203 HydrophobicContact CD2-CD1 3.99Å; W101-I203 HydrophobicContact CG-CD1 3.69Å; W101-I203 VanDerWaalsContact NE1-CD1 3.35Å; W101-A206 HydrophobicContact CB-CB 4.45Å; W101-T207 PolarHBondContact NE1-OG1 2.72Å; W101-I210 HydrophobicContact CB-CD1 4.23Å; W101-I210 HydrophobicContact CG-CD1 4.33Å; W101-F223 HydrophobicContact CZ2-CD1 4.34Å; W101-N226 HydrophobicContact CD2-CB 4.14Å; W101-N226 HydrophobicContact CE3-CB 3.43Å; W101-N226 VanDerWaalsContact CE3-CB 3.43Å; W101-N226 HydrophobicContact CH2-CB 4.37Å; W101-N226 VanDerWaalsContact CZ3-C 3.41Å; W101-N226 HydrophobicContact CZ3-CB 3.58Å; W101-T227 WeakPolarHBondContact CH2-OG1 3.2Å; W101-A230 HydrophobicContact CZ3-CB 4.25Å |
| 102 | A | 97.6 | Very high | 94.9 | Very high | 2 Ų | 2 | 25.5 Ų | 25.5 | 2% | 0.017 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -68.1 | -45.9 | -176.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | S98 V99 W100 C106 I229 A230 | S98-A102 PolarHBondContact O-N 3.37Å; V99-A102 PolarHBondContact O-N 2.89Å; W100-A102 PolarHBondContact O-N 3.07Å; A102-C106 PolarHBondContact O-N 3.15Å; A102-C106 VanDerWaalsContact O-N 3.15Å; A102-I229 HydrophobicContact CB-CB 4.13Å; A102-I229 HydrophobicContact CB-CG2 3.88Å; A102-A230 WeakPolarHBondContact O-CB 3.42Å |
| 103 | L | 98.1 | Very high | 95.5 | Very high | 45 Ų | 45 | 24.9 Ų | 24.9 | 24% | 0.236 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -63.1 | -48 | 177.4 | -67.5 | 172.4 | 0 | 0 | 0 | 111.4 | V99 T105 C106 G107 L233 Y261 I265 | V99-L103 HydrophobicContact CG1-CD1 3.62Å; V99-L103 HydrophobicContact CG1-CG 4.32Å; V99-L103 WeakPolarHBondContact O-CB 3.25Å; V99-L103 VanDerWaalsContact O-CG 3.23Å; V99-L103 WeakPolarHBondContact O-CG 3.39Å; V99-L103 PolarHBondContact O-N 3.34Å; L103-T105 PolarHBondContact O-N 3.4Å; L103-C106 WeakPolarHBondContact O-CB 3.01Å; L103-C106 PolarHBondContact O-N 2.91Å; L103-G107 PolarHBondContact O-N 3.01Å; L103-L233 HydrophobicContact CD2-CD1 3.79Å; L103-Y261 VanDerWaalsContact CA-OH 3.26Å; L103-Y261 WeakPolarHBondContact CA-OH 3.23Å; L103-Y261 WeakPolarHBondContact CB-OH 3.45Å; L103-Y261 WeakPolarHBondContact CD2-OH 3.49Å; L103-Y261 WeakPolarHBondContact O-CE1 3.36Å; L103-Y261 PolarHBondContact O-OH 3.06Å; L103-I265 HydrophobicContact CB-CD1 3.78Å; L103-I265 HydrophobicContact CB-CG1 4.31Å; L103-I265 HydrophobicContact CD1-CG1 4.38Å |
| 104 | S | 97.9 | Very high | 96.1 | Very high | 0 Ų | 0 | 24 Ų | 24 | 0% | 0 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -69.7 | -34.2 | -177 | -59.6 | 0 | 0 | 0 | 0 | 112.5 | W100 G107 Y108 | W100-S104 WeakPolarHBondContact CZ2-OG 3.5Å; W100-S104 PolarHBondContact NE1-OG 3.47Å; W100-S104 WeakPolarHBondContact O-CB 3.29Å; W100-S104 PolarHBondContact O-N 3.36Å; W100-S104 PolarHBondContact O-OG 2.95Å; S104-G107 PolarHBondContact O-N 3.41Å; S104-Y108 VanDerWaalsContact O-CB 3.28Å; S104-Y108 WeakPolarHBondContact O-CB 3.32Å; S104-Y108 PolarHBondContact O-N 2.81Å |
| 105 | T | 98.1 | Very high | 96.6 | Very high | 7 Ų | 7 | 23.8 Ų | 23.8 | 4% | 0.043 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -64.2 | -41.6 | 174.1 | -59.5 | 0 | 0 | 0 | 0 | 111.2 | W101 L103 Y108 F109 Y199 A230 | W101-T105 HydrophobicContact CZ3-CG2 4.39Å; W101-T105 WeakPolarHBondContact O-CB 3.41Å; W101-T105 PolarHBondContact O-N 3.25Å; W101-T105 PolarHBondContact O-OG1 3.48Å; L103-T105 PolarHBondContact O-N 3.4Å; T105-Y108 PolarHBondContact O-N 3.1Å; T105-F109 HydrophobicContact CG2-CD2 4.03Å; T105-F109 HydrophobicContact CG2-CE2 3.47Å; T105-F109 VanDerWaalsContact CG2-CE2 3.47Å; T105-F109 HydrophobicContact CG2-CZ 3.81Å; T105-F109 WeakPolarHBondContact O-CD2 3.16Å; T105-F109 WeakPolarHBondContact O-CG 3.46Å; T105-F109 PolarHBondContact O-N 2.88Å; T105-Y199 PolarHBondContact OG1-OH 3.48Å; T105-A230 HydrophobicContact CG2-CB 3.84Å |
| 106 | C | 98.3 | Very high | 96.8 | Very high | 1 Ų | 1 | 24.6 Ų | 24.6 | 1% | 0.007 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -57.4 | -54.2 | 171.8 | 168.1 | 0 | 0 | 0 | 0 | 111.5 | A102 L103 Y108 F109 Q110 L233 Q234 | A102-C106 PolarHBondContact O-N 3.15Å; A102-C106 VanDerWaalsContact O-N 3.15Å; L103-C106 WeakPolarHBondContact O-CB 3.01Å; L103-C106 PolarHBondContact O-N 2.91Å; C106-Y108 VanDerWaalsContact C-N 3.27Å; C106-Y108 PolarHBondContact O-N 2.93Å; C106-F109 PolarHBondContact O-N 2.98Å; C106-Q110 PolarHBondContact O-N 3.39Å; C106-Q110 VanDerWaalsContact O-N 3.12Å; C106-L233 HydrophobicContact CB-CB 3.95Å; C106-Q234 VanDerWaalsContact SG-CA 3.58Å; C106-Q234 PolarHBondContact SG-N 3.41Å |
| 107 | G | 98.2 | Very high | 96.9 | Very high | 0 Ų | 0 | 25.5 Ų | 25.5 | 0% | 0 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -60.3 | -37.3 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | L103 S104 Q110 V111 | L103-G107 PolarHBondContact O-N 3.01Å; S104-G107 PolarHBondContact O-N 3.41Å; G107-Q110 PolarHBondContact O-N 3.24Å; G107-V111 WeakPolarHBondContact O-CG2 3.31Å; G107-V111 PolarHBondContact O-N 3.42Å; G107-V111 VanDerWaalsContact O-N 3.09Å |
| 108 | Y | 98.4 | Very high | 96.9 | Very high | 23 Ų | 23 | 25.1 Ų | 25.1 | 9% | 0.09 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -62.3 | -46.6 | 176.1 | 171.2 | -95.5 | 0 | 0 | 0 | 112 | S104 T105 C106 Q110 V111 V112 F195 R196 Y199 | S104-Y108 VanDerWaalsContact O-CB 3.28Å; S104-Y108 WeakPolarHBondContact O-CB 3.32Å; S104-Y108 PolarHBondContact O-N 2.81Å; T105-Y108 PolarHBondContact O-N 3.1Å; C106-Y108 VanDerWaalsContact C-N 3.27Å; C106-Y108 PolarHBondContact O-N 2.93Å; Y108-Q110 VanDerWaalsContact C-N 3.31Å; Y108-Q110 PolarHBondContact O-N 3.3Å; Y108-V111 PolarHBondContact O-N 3.23Å; Y108-V112 HydrophobicContact CD1-CG2 4.36Å; Y108-V112 HydrophobicContact CD2-CG2 4.05Å; Y108-V112 HydrophobicContact CE1-CG2 3.96Å; Y108-V112 HydrophobicContact CE2-CG2 3.63Å; Y108-V112 HydrophobicContact CG-CG2 4.4Å; Y108-V112 WeakPolarHBondContact O-CG2 3.46Å; Y108-V112 PolarHBondContact O-N 2.87Å; Y108-F195 AromaticContact CD2-CE1 3.95Å; Y108-F195 HydrophobicContact CD2-CE1 3.95Å; Y108-F195 HydrophobicContact CD2-CE2 4.32Å; Y108-F195 AromaticContact CD2-CZ 3.47Å; Y108-F195 HydrophobicContact CD2-CZ 3.47Å; Y108-F195 VanDerWaalsContact CD2-CZ 3.47Å; Y108-F195 HydrophobicContact CE2-CE1 4.19Å; Y108-F195 HydrophobicContact CE2-CZ 4.18Å; Y108-F195 HydrophobicContact CG-CZ 4.3Å; Y108-R196 HydrophobicContact CE2-CG 4.49Å; Y108-R196 PolarHBondContact OH-NE 3.49Å; Y108-R196 PolarHBondContact OH-NH2 3.03Å; Y108-R196 VanDerWaalsContact OH-NH2 3.14Å; Y108-Y199 VanDerWaalsContact CB-CE2 3.41Å; Y108-Y199 HydrophobicContact CD1-CD1 4.34Å; Y108-Y199 AromaticContact CD1-CE1 3.68Å; Y108-Y199 HydrophobicContact CD1-CE1 3.68Å; Y108-Y199 AromaticContact CD1-CZ 3.76Å; Y108-Y199 AromaticContact CD2-CD1 3.16Å; Y108-Y199 HydrophobicContact CD2-CD1 3.16Å; Y108-Y199 AromaticContact CD2-CD2 3.9Å; Y108-Y199 HydrophobicContact CD2-CD2 3.9Å; Y108-Y199 AromaticContact CD2-CE1 3.38Å; Y108-Y199 HydrophobicContact CD2-CE1 3.38Å; Y108-Y199 HydrophobicContact CD2-CE2 4.09Å; Y108-Y199 AromaticContact CD2-CG 3.43Å; Y108-Y199 HydrophobicContact CD2-CG 3.43Å; Y108-Y199 VanDerWaalsContact CD2-CG 3.43Å; Y108-Y199 AromaticContact CD2-CZ 3.83Å; Y108-Y199 HydrophobicContact CE1-CD1 4.49Å; Y108-Y199 AromaticContact CE1-CE1 3.91Å; Y108-Y199 HydrophobicContact CE1-CE1 3.91Å; Y108-Y199 AromaticContact CE2-CD1 3.35Å; Y108-Y199 HydrophobicContact CE2-CD1 3.35Å; Y108-Y199 AromaticContact CE2-CE1 3.62Å; Y108-Y199 HydrophobicContact CE2-CE1 3.62Å; Y108-Y199 HydrophobicContact CE2-CG 4.02Å; Y108-Y199 AromaticContact CG-CD1 3.72Å; Y108-Y199 HydrophobicContact CG-CD1 3.72Å; Y108-Y199 HydrophobicContact CG-CD2 4.04Å; Y108-Y199 AromaticContact CG-CE1 3.41Å; Y108-Y199 HydrophobicContact CG-CE1 3.41Å; Y108-Y199 VanDerWaalsContact CG-CE1 3.41Å; Y108-Y199 AromaticContact CG-CE2 3.77Å; Y108-Y199 HydrophobicContact CG-CE2 3.77Å; Y108-Y199 HydrophobicContact CG-CG 4Å; Y108-Y199 AromaticContact CG-CZ 3.42Å; Y108-Y199 VanDerWaalsContact CG-CZ 3.42Å; Y108-Y199 AromaticContact CZ-CE1 3.88Å |
| 109 | F | 97.8 | Very high | 97 | Very high | 65 Ų | 65 | 25 Ų | 25 | 29% | 0.285 | 13% | 0.134 | S | C | . | . | H | α-helix | trans | -62.3 | -38.5 | 177.3 | -69.6 | -36.2 | 0 | 0 | 0 | 112.4 | T105 C106 N113 L231 Q234 | T105-F109 HydrophobicContact CG2-CD2 4.03Å; T105-F109 HydrophobicContact CG2-CE2 3.47Å; T105-F109 VanDerWaalsContact CG2-CE2 3.47Å; T105-F109 HydrophobicContact CG2-CZ 3.81Å; T105-F109 WeakPolarHBondContact O-CD2 3.16Å; T105-F109 WeakPolarHBondContact O-CG 3.46Å; T105-F109 PolarHBondContact O-N 2.88Å; C106-F109 PolarHBondContact O-N 2.98Å; F109-N113 WeakPolarHBondContact O-CB 3.43Å; F109-N113 PolarHBondContact O-N 2.87Å; F109-N113 PolarHBondContact O-ND2 2.88Å; F109-L231 HydrophobicContact CD2-CD2 4.22Å; F109-L231 HydrophobicContact CE2-CD2 3.76Å; F109-Q234 HydrophobicContact CB-CG 3.99Å |
| 110 | Q | 98.1 | Very high | 96.9 | Very high | 0 Ų | 0 | 25.7 Ų | 25.7 | 0% | 0 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -59.5 | -52.7 | 174.3 | -67.2 | -61.2 | -37.8 | 0 | 0 | 111.4 | C106 G107 Y108 V112 N113 Y114 Q234 L237 T238 Y258 | C106-Q110 PolarHBondContact O-N 3.39Å; C106-Q110 VanDerWaalsContact O-N 3.12Å; G107-Q110 PolarHBondContact O-N 3.24Å; Y108-Q110 VanDerWaalsContact C-N 3.31Å; Y108-Q110 PolarHBondContact O-N 3.3Å; Q110-V112 PolarHBondContact O-N 3.27Å; Q110-N113 PolarHBondContact O-N 2.96Å; Q110-Y114 WeakPolarHBondContact O-CD2 3.29Å; Q110-Y114 PolarHBondContact O-N 3.43Å; Q110-Q234 PolarHBondContact NE2-O 3.37Å; Q110-L237 HydrophobicContact CG-CD2 3.65Å; Q110-L237 HydrophobicContact CG-CG 4.17Å; Q110-T238 PolarHBondContact NE2-OG1 3.07Å; Q110-T238 PolarHBondContact OE1-OG1 3.41Å; Q110-Y258 HydrophobicContact CB-CD1 3.85Å; Q110-Y258 HydrophobicContact CB-CD2 4.18Å; Q110-Y258 HydrophobicContact CB-CE1 3.59Å; Q110-Y258 HydrophobicContact CB-CE2 3.95Å; Q110-Y258 HydrophobicContact CB-CG 4.15Å; Q110-Y258 HydrophobicContact CG-CD1 4.26Å; Q110-Y258 HydrophobicContact CG-CE1 3.82Å; Q110-Y258 PolarHBondContact OE1-OH 2.84Å |
| 111 | V | 98.4 | Very high | 96.6 | Very high | 0 Ų | 0 | 30.6 Ų | 30.6 | 0% | 0 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -58.9 | -49.4 | -179.1 | 174.6 | 0 | 0 | 0 | 0 | 111 | G107 Y108 Y114 T115 V176 M179 F195 F255 Y258 F262 | G107-V111 WeakPolarHBondContact O-CG2 3.31Å; G107-V111 PolarHBondContact O-N 3.42Å; G107-V111 VanDerWaalsContact O-N 3.09Å; Y108-V111 PolarHBondContact O-N 3.23Å; V111-Y114 PolarHBondContact O-N 2.84Å; V111-T115 VanDerWaalsContact O-CB 3.29Å; V111-T115 WeakPolarHBondContact O-CB 3.33Å; V111-T115 PolarHBondContact O-N 3.37Å; V111-V176 HydrophobicContact CG1-CG2 4.42Å; V111-V176 HydrophobicContact CG2-CG1 4.06Å; V111-V176 HydrophobicContact CG2-CG2 3.89Å; V111-M179 HydrophobicContact CG1-CE 4.28Å; V111-F195 HydrophobicContact CB-CE1 3.94Å; V111-F195 HydrophobicContact CB-CE2 4.42Å; V111-F195 HydrophobicContact CB-CZ 3.7Å; V111-F195 HydrophobicContact CG1-CD1 3.92Å; V111-F195 HydrophobicContact CG1-CE1 3.43Å; V111-F195 VanDerWaalsContact CG1-CE1 3.43Å; V111-F195 HydrophobicContact CG1-CE2 4.39Å; V111-F195 HydrophobicContact CG1-CZ 3.69Å; V111-F195 HydrophobicContact CG2-CE2 4.43Å; V111-F195 HydrophobicContact CG2-CZ 4.18Å; V111-F255 HydrophobicContact CG1-CE1 4.03Å; V111-F255 HydrophobicContact CG1-CZ 4.45Å; V111-Y258 HydrophobicContact CG2-CD2 4.29Å; V111-Y258 HydrophobicContact CG2-CG 4.49Å; V111-F262 HydrophobicContact CG2-CE2 4.35Å |
| 112 | V | 97.1 | Very high | 96.4 | Very high | 36 Ų | 36 | 31.1 Ų | 31.1 | 22% | 0.218 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -66.3 | -42.9 | -176.8 | 173.5 | 0 | 0 | 0 | 0 | 112.4 | Y108 Q110 Y114 Y192 F195 | Y108-V112 HydrophobicContact CD1-CG2 4.36Å; Y108-V112 HydrophobicContact CD2-CG2 4.05Å; Y108-V112 HydrophobicContact CE1-CG2 3.96Å; Y108-V112 HydrophobicContact CE2-CG2 3.63Å; Y108-V112 HydrophobicContact CG-CG2 4.4Å; Y108-V112 WeakPolarHBondContact O-CG2 3.46Å; Y108-V112 PolarHBondContact O-N 2.87Å; Q110-V112 PolarHBondContact O-N 3.27Å; V112-Y114 PolarHBondContact O-N 3.11Å; V112-Y192 HydrophobicContact CG2-CE2 4.42Å; V112-F195 HydrophobicContact CG2-CE1 4.24Å |
| 113 | N | 96.1 | Very high | 96.2 | Very high | 85 Ų | 85 | 32.9 Ų | 32.9 | 46% | 0.455 | 17% | 0.168 | S | C | . | . | H | α-helix | trans | -64.2 | -31.1 | -178.3 | -72.9 | -25.8 | 0 | 0 | 0 | 112.6 | F109 Q110 Q234 | F109-N113 WeakPolarHBondContact O-CB 3.43Å; F109-N113 PolarHBondContact O-N 2.87Å; F109-N113 PolarHBondContact O-ND2 2.88Å; Q110-N113 PolarHBondContact O-N 2.96Å; N113-Q234 PolarHBondContact ND2-NE2 3.03Å |
| 114 | Y | 97.3 | Very high | 95.9 | Very high | 51 Ų | 51 | 33.5 Ų | 33.5 | 20% | 0.2 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -106.5 | -5 | -174.8 | -62.2 | -65.2 | 0 | 0 | 0 | 113.8 | Q110 V111 V112 Q116 G117 L118 T238 V242 Y258 | Q110-Y114 WeakPolarHBondContact O-CD2 3.29Å; Q110-Y114 PolarHBondContact O-N 3.43Å; V111-Y114 PolarHBondContact O-N 2.84Å; V112-Y114 PolarHBondContact O-N 3.11Å; Y114-Q116 VanDerWaalsContact C-N 3.29Å; Y114-Q116 PolarHBondContact O-N 2.69Å; Y114-G117 PolarHBondContact O-N 3.31Å; Y114-G117 VanDerWaalsContact O-N 3.08Å; Y114-L118 PolarHBondContact O-N 3.49Å; Y114-L118 VanDerWaalsContact O-N 3.09Å; Y114-T238 VanDerWaalsContact OH-CG2 3.29Å; Y114-T238 WeakPolarHBondContact OH-CG2 3.29Å; Y114-V242 HydrophobicContact CD1-CG1 4.36Å; Y114-V242 HydrophobicContact CD2-CG2 4.33Å; Y114-V242 HydrophobicContact CE1-CB 4.39Å; Y114-V242 HydrophobicContact CE1-CG1 3.5Å; Y114-V242 VanDerWaalsContact CE1-CG1 3.5Å; Y114-V242 HydrophobicContact CE1-CG2 4.18Å; Y114-V242 HydrophobicContact CE2-CG1 4.5Å; Y114-V242 HydrophobicContact CE2-CG2 3.69Å; Y114-V242 WeakPolarHBondContact OH-CG1 3.5Å; Y114-Y258 HydrophobicContact CD2-CE2 4.17Å; Y114-Y258 VanDerWaalsContact CD2-OH 3.23Å; Y114-Y258 WeakPolarHBondContact CD2-OH 3.18Å |
| 115 | T | 96.8 | Very high | 95.4 | Very high | 0 Ų | 0 | 36.1 Ų | 36.1 | 0% | 0 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -61 | -35.1 | -179.1 | -138.1 | 0 | 0 | 0 | 0 | 113.3 | V111 G117 L118 W119 M179 Y192 | V111-T115 VanDerWaalsContact O-CB 3.29Å; V111-T115 WeakPolarHBondContact O-CB 3.33Å; V111-T115 PolarHBondContact O-N 3.37Å; T115-G117 VanDerWaalsContact C-N 3.31Å; T115-G117 PolarHBondContact O-N 2.88Å; T115-L118 WeakPolarHBondContact O-CB 3.48Å; T115-L118 PolarHBondContact O-N 3.34Å; T115-W119 HydrophobicContact CG2-CD2 4.12Å; T115-W119 HydrophobicContact CG2-CE3 3.96Å; T115-W119 HydrophobicContact CG2-CH2 3.7Å; T115-W119 HydrophobicContact CG2-CZ2 3.81Å; T115-W119 HydrophobicContact CG2-CZ3 3.78Å; T115-W119 VanDerWaalsContact O-CG 3.28Å; T115-W119 PolarHBondContact O-N 3.17Å; T115-M179 WeakPolarHBondContact OG1-CE 3.47Å; T115-Y192 HydrophobicContact CG2-CD2 4.36Å; T115-Y192 HydrophobicContact CG2-CE2 3.82Å |
| 116 | Q | 93.5 | Very high | 94.7 | Very high | 86 Ų | 86 | 45.7 Ų | 45.7 | 40% | 0.402 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -63.7 | -39.6 | 177.1 | -64.1 | -68.9 | -30.5 | 0 | 0 | 111.1 | Y114 L118 W119 E120 N132 | Y114-Q116 VanDerWaalsContact C-N 3.29Å; Y114-Q116 PolarHBondContact O-N 2.69Å; Q116-L118 VanDerWaalsContact C-N 3.35Å; Q116-W119 VanDerWaalsContact NE2-CZ3 3.32Å; Q116-W119 PolarHBondContact O-N 3.49Å; Q116-E120 PolarHBondContact O-N 2.97Å; Q116-N132 PolarHBondContact OE1-ND2 3.42Å |
| 117 | G | 94.3 | Very high | 93.7 | Very high | 38 Ų | 38 | 55.2 Ų | 55.2 | 39% | 0.392 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -67 | -36.4 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | Y114 T115 K121 | Y114-G117 PolarHBondContact O-N 3.31Å; Y114-G117 VanDerWaalsContact O-N 3.08Å; T115-G117 VanDerWaalsContact C-N 3.31Å; T115-G117 PolarHBondContact O-N 2.88Å; G117-K121 PolarHBondContact O-N 2.94Å; G117-K121 VanDerWaalsContact O-N 3.13Å |
| 118 | L | 95.4 | Very high | 92.8 | Very high | 0 Ų | 0 | 57.1 Ų | 57.1 | 0% | 0 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -64.8 | -46.4 | 173.3 | -178 | 66.6 | 0 | 0 | 0 | 111.2 | Y114 T115 Q116 E120 K121 V122 M179 D180 I251 F255 | Y114-L118 PolarHBondContact O-N 3.49Å; Y114-L118 VanDerWaalsContact O-N 3.09Å; T115-L118 WeakPolarHBondContact O-CB 3.48Å; T115-L118 PolarHBondContact O-N 3.34Å; Q116-L118 VanDerWaalsContact C-N 3.35Å; L118-E120 VanDerWaalsContact C-N 3.34Å; L118-E120 PolarHBondContact O-N 3.33Å; L118-K121 WeakPolarHBondContact O-CB 3.45Å; L118-K121 PolarHBondContact O-N 3.16Å; L118-K121 VanDerWaalsContact O-N 3.11Å; L118-V122 HydrophobicContact CD1-CG2 4.46Å; L118-V122 HydrophobicContact CG-CG2 4.47Å; L118-V122 WeakPolarHBondContact O-CG2 3.34Å; L118-V122 PolarHBondContact O-N 3.28Å; L118-M179 HydrophobicContact CD2-CB 3.94Å; L118-M179 HydrophobicContact CD2-CE 4.18Å; L118-D180 HydrophobicContact CD1-CB 4.32Å; L118-I251 HydrophobicContact CB-CG1 4.06Å; L118-I251 HydrophobicContact CD1-CG1 4.39Å; L118-F255 HydrophobicContact CB-CD2 4.28Å; L118-F255 HydrophobicContact CB-CE2 3.79Å; L118-F255 HydrophobicContact CB-CZ 4.02Å; L118-F255 HydrophobicContact CD1-CD2 4.4Å; L118-F255 HydrophobicContact CD2-CD1 3.65Å; L118-F255 HydrophobicContact CD2-CD2 4.1Å; L118-F255 HydrophobicContact CD2-CE1 3.55Å; L118-F255 HydrophobicContact CD2-CE2 4.01Å; L118-F255 HydrophobicContact CD2-CG 3.93Å; L118-F255 HydrophobicContact CD2-CZ 3.74Å; L118-F255 HydrophobicContact CG-CD2 4.5Å; L118-F255 HydrophobicContact CG-CE2 4.39Å; L118-F255 HydrophobicContact CG-CZ 4.49Å |
| 119 | W | 95.3 | Very high | 91.8 | Very high | 3 Ų | 3 | 59.1 Ų | 59.1 | 1% | 0.011 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -61.7 | -40.3 | 178.4 | -66.2 | -22 | 0 | 0 | 0 | 112.5 | T115 Q116 K121 V122 M123 N132 V135 I185 C188 Y189 Y192 | T115-W119 HydrophobicContact CG2-CD2 4.12Å; T115-W119 HydrophobicContact CG2-CE3 3.96Å; T115-W119 HydrophobicContact CG2-CH2 3.7Å; T115-W119 HydrophobicContact CG2-CZ2 3.81Å; T115-W119 HydrophobicContact CG2-CZ3 3.78Å; T115-W119 VanDerWaalsContact O-CG 3.28Å; T115-W119 PolarHBondContact O-N 3.17Å; Q116-W119 VanDerWaalsContact NE2-CZ3 3.32Å; Q116-W119 PolarHBondContact O-N 3.49Å; W119-K121 VanDerWaalsContact C-N 3.29Å; W119-K121 PolarHBondContact O-N 3.37Å; W119-V122 PolarHBondContact O-N 2.98Å; W119-M123 PolarHBondContact O-N 3.49Å; W119-N132 HydrophobicContact CE3-CB 3.75Å; W119-N132 VanDerWaalsContact CE3-OD1 3.28Å; W119-N132 HydrophobicContact CZ3-CB 3.64Å; W119-V135 HydrophobicContact CH2-CB 4.34Å; W119-V135 HydrophobicContact CH2-CG1 4.03Å; W119-V135 HydrophobicContact CZ2-CG1 4.11Å; W119-I185 HydrophobicContact CB-CD1 4.06Å; W119-I185 HydrophobicContact CG-CD1 4.11Å; W119-C188 PolarHBondContact NE1-SG 3.38Å; W119-Y189 AromaticContact CD1-CE1 3.99Å; W119-Y189 HydrophobicContact CD2-CD1 4.06Å; W119-Y189 AromaticContact CD2-CE1 3.59Å; W119-Y189 HydrophobicContact CD2-CE1 3.59Å; W119-Y189 AromaticContact CE2-CD1 3.53Å; W119-Y189 AromaticContact CE2-CE1 3.59Å; W119-Y189 HydrophobicContact CE3-CE1 4.06Å; W119-Y189 HydrophobicContact CG-CD1 4.38Å; W119-Y189 AromaticContact CG-CE1 3.84Å; W119-Y189 HydrophobicContact CG-CE1 3.84Å; W119-Y189 HydrophobicContact CH2-CD1 4.42Å; W119-Y189 HydrophobicContact CH2-CE1 4.41Å; W119-Y189 AromaticContact CZ2-CD1 3.75Å; W119-Y189 HydrophobicContact CZ2-CD1 3.75Å; W119-Y189 HydrophobicContact CZ2-CE1 4.03Å; W119-Y189 HydrophobicContact CZ3-CE1 4.42Å; W119-Y189 AromaticContact NE1-CD1 3.63Å; W119-Y189 AromaticContact NE1-CE1 3.87Å; W119-Y192 AromaticContact CH2-CD1 3.8Å; W119-Y192 HydrophobicContact CH2-CD1 3.8Å; W119-Y192 AromaticContact CH2-CE1 3.74Å; W119-Y192 HydrophobicContact CH2-CE1 3.74Å; W119-Y192 HydrophobicContact CH2-CG 4.32Å; W119-Y192 AromaticContact CZ2-CD1 3.57Å; W119-Y192 HydrophobicContact CZ2-CD1 3.57Å; W119-Y192 HydrophobicContact CZ2-CD2 4.25Å; W119-Y192 AromaticContact CZ2-CE1 3.96Å; W119-Y192 HydrophobicContact CZ2-CE1 3.96Å; W119-Y192 AromaticContact CZ2-CG 3.68Å; W119-Y192 HydrophobicContact CZ2-CG 3.68Å |
| 120 | E | 93.3 | Very high | 91.2 | Very high | 72 Ų | 72 | 59.3 Ų | 59.3 | 34% | 0.336 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -63.5 | -35.3 | 174.5 | -172.9 | 63.2 | -160.4 | 0 | 0 | 112 | Q116 L118 M123 P124 S125 | Q116-E120 PolarHBondContact O-N 2.97Å; L118-E120 VanDerWaalsContact C-N 3.34Å; L118-E120 PolarHBondContact O-N 3.33Å; E120-M123 CarbonylContact O-C 3.49Å; E120-P124 WeakPolarHBondContact O-CA 3.23Å; E120-S125 PolarHBondContact OE1-N 3.04Å; E120-S125 PolarHBondContact OE1-OG 3.46Å; E120-S125 WeakPolarHBondContact OE2-CB 3.35Å; E120-S125 PolarHBondContact OE2-N 3.04Å; E120-S125 VanDerWaalsContact OE2-N 3.17Å; E120-S125 PolarHBondContact OE2-OG 3.03Å |
| 121 | K | 92.7 | Very high | 90.9 | Very high | 103 Ų | 103 | 65.3 Ų | 65.3 | 45% | 0.448 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -67.9 | -41.6 | 174.2 | -178.1 | 173.8 | -179.8 | 176 | 0 | 112 | G117 L118 W119 I251 T252 | G117-K121 PolarHBondContact O-N 2.94Å; G117-K121 VanDerWaalsContact O-N 3.13Å; L118-K121 WeakPolarHBondContact O-CB 3.45Å; L118-K121 PolarHBondContact O-N 3.16Å; L118-K121 VanDerWaalsContact O-N 3.11Å; W119-K121 VanDerWaalsContact C-N 3.29Å; W119-K121 PolarHBondContact O-N 3.37Å; K121-I251 HydrophobicContact CB-CG2 4.16Å; K121-I251 HydrophobicContact CD-CG2 3.26Å; K121-I251 HydrophobicContact CG-CG2 4.31Å; K121-T252 PolarHBondContact NZ-OG1 3.43Å |
| 122 | V | 92.8 | Very high | 90.6 | Very high | 36 Ų | 36 | 66.3 Ų | 66.3 | 22% | 0.218 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -73 | -42.3 | -178.7 | 174.5 | 0 | 0 | 0 | 0 | 111.5 | L118 W119 I185 | L118-V122 HydrophobicContact CD1-CG2 4.46Å; L118-V122 HydrophobicContact CG-CG2 4.47Å; L118-V122 WeakPolarHBondContact O-CG2 3.34Å; L118-V122 PolarHBondContact O-N 3.28Å; W119-V122 PolarHBondContact O-N 2.98Å; V122-I185 HydrophobicContact CB-CD1 4.38Å; V122-I185 HydrophobicContact CG1-CB 4.12Å; V122-I185 HydrophobicContact CG1-CD1 4.22Å |
| 123 | M | 92.5 | Very high | 90.3 | Very high | 39 Ų | 39 | 67.2 Ų | 67.2 | 19% | 0.192 | 35% | 0.352 | C | S | . | . | S | Bend | trans | -140.8 | 98.3 | 178.4 | -174 | 175 | 76.7 | 0 | 0 | 110.1 | W119 E120 S125 A128 A129 I130 I185 | W119-M123 PolarHBondContact O-N 3.49Å; E120-M123 CarbonylContact O-C 3.49Å; M123-S125 PolarHBondContact O-N 2.89Å; M123-A128 HydrophobicContact CE-CB 4.08Å; M123-A128 HydrophobicContact CG-CB 3.66Å; M123-A128 HydrophobicContact SD-CB 3.56Å; M123-A128 VanDerWaalsContact SD-CB 3.56Å; M123-A129 WeakPolarHBondContact CE-O 3.13Å; M123-I130 HydrophobicContact CE-CG1 4.49Å; M123-I185 HydrophobicContact CB-CB 4.09Å; M123-I185 HydrophobicContact CB-CD1 4.23Å; M123-I185 HydrophobicContact CB-CG1 4.13Å; M123-I185 HydrophobicContact CE-CG1 4.06Å; M123-I185 HydrophobicContact CE-CG2 4.32Å; M123-I185 HydrophobicContact SD-CB 4.3Å; M123-I185 HydrophobicContact SD-CG1 4.4Å; M123-I185 HydrophobicContact SD-CG2 3.82Å |
| 124 | P | 91 | Very high | 89.8 | Confident | 59 Ų | 59 | 65.2 Ų | 65.2 | 38% | 0.383 | 35% | 0.352 | S | S | . | . | trans | -60.9 | 129.7 | -179.7 | -26.2 | 34.9 | 0 | 0 | 0 | 112.9 | E120 R126 Y127 | E120-P124 WeakPolarHBondContact O-CA 3.23Å; P124-R126 PolarHBondContact O-N 3.37Å; P124-Y127 HydrophobicContact CB-CD2 4.45Å; P124-Y127 PolarHBondContact O-N 3.41Å | ||
| 125 | S | 87.8 | Confident | 89.7 | Confident | 55 Ų | 55 | 63.5 Ų | 63.5 | 39% | 0.385 | 35% | 0.346 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -52.9 | -28.4 | 179.2 | 55.4 | 0 | 0 | 0 | 0 | 115.2 | E120 M123 Y127 | E120-S125 PolarHBondContact OE1-N 3.04Å; E120-S125 PolarHBondContact OE1-OG 3.46Å; E120-S125 WeakPolarHBondContact OE2-CB 3.35Å; E120-S125 PolarHBondContact OE2-N 3.04Å; E120-S125 VanDerWaalsContact OE2-N 3.17Å; E120-S125 PolarHBondContact OE2-OG 3.03Å; M123-S125 PolarHBondContact O-N 2.89Å; S125-Y127 PolarHBondContact O-N 3.37Å |
| 126 | R | 84.3 | Confident | 89.4 | Confident | 208 Ų | 208 | 65.8 Ų | 65.8 | 79% | 0.785 | 36% | 0.357 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.4 | -21.1 | -174.3 | -66.6 | -174.6 | -179.8 | -174.4 | 0.7 | 114 | P124 | P124-R126 PolarHBondContact O-N 3.37Š|
| 127 | Y | 77.3 | Confident | 89 | Confident | 201 Ų | 201 | 64.6 Ų | 64.6 | 79% | 0.788 | 36% | 0.362 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -128.8 | -0.4 | -169.1 | -53.3 | -66.9 | 0 | 0 | 0 | 114.2 | P124 S125 | P124-Y127 HydrophobicContact CB-CD2 4.45Å; P124-Y127 PolarHBondContact O-N 3.41Å; S125-Y127 PolarHBondContact O-N 3.37Å |
| 128 | A | 79.3 | Confident | 88.8 | Confident | 40 Ų | 40 | 66.3 Ų | 66.3 | 33% | 0.331 | 37% | 0.365 | S | S | . | . | S | Bend | trans | -146.9 | 153.9 | -176 | 0 | 0 | 0 | 0 | 0 | 112.6 | M123 | M123-A128 HydrophobicContact CE-CB 4.08Å; M123-A128 HydrophobicContact CG-CB 3.66Å; M123-A128 HydrophobicContact SD-CB 3.56Å; M123-A128 VanDerWaalsContact SD-CB 3.56Å |
| 129 | A | 76.5 | Confident | 88.5 | Confident | 65 Ų | 65 | 66.3 Ų | 66.3 | 54% | 0.537 | 37% | 0.365 | S | S | . | . | trans | -71.5 | 128.3 | 172.2 | 0 | 0 | 0 | 0 | 0 | 110.4 | M123 Y131 | M123-A129 WeakPolarHBondContact CE-O 3.13Å; A129-Y131 HydrophobicContact CB-CE2 4.31Å | ||
| 130 | I | 85.4 | Confident | 88 | Confident | 69 Ų | 69 | 69.8 Ų | 69.8 | 35% | 0.354 | 39% | 0.386 | S | S | . | . | trans | -100.7 | 134.6 | -176.4 | -58.1 | 175.6 | 0 | 0 | 0 | 110.1 | M123 N132 | M123-I130 HydrophobicContact CE-CG1 4.49Å; I130-N132 HydrophobicContact CG2-CB 3.8Å; I130-N132 WeakPolarHBondContact CG2-ND2 3.42Å; I130-N132 WeakPolarHBondContact CG2-OD1 3.23Å | ||
| 131 | Y | 91.6 | Very high | 87.5 | Confident | 126 Ų | 126 | 71.9 Ų | 71.9 | 49% | 0.494 | 40% | 0.399 | S | S | . | . | trans | -112 | 13.1 | 179.7 | -60.7 | -82.6 | 0 | 0 | 0 | 113.8 | A129 G133 G134 V135 W186 Y189 | A129-Y131 HydrophobicContact CB-CE2 4.31Å; Y131-G133 VanDerWaalsContact C-N 3.31Å; Y131-G133 PolarHBondContact O-N 3.01Å; Y131-G133 VanDerWaalsContact O-N 3.15Å; Y131-G134 WeakPolarHBondContact O-CA 3.31Å; Y131-G134 PolarHBondContact O-N 3.4Å; Y131-V135 WeakPolarHBondContact O-CG2 3.14Å; Y131-V135 PolarHBondContact O-N 3.28Å; Y131-W186 HydrophobicContact CD2-CH2 4.02Å; Y131-W186 HydrophobicContact CE2-CH2 4.09Å; Y131-W186 HydrophobicContact CE2-CZ2 4.37Å; Y131-Y189 PolarHBondContact N-OH 3.12Å | ||
| 132 | N | 92.6 | Very high | 87.3 | Confident | 20 Ų | 20 | 70.4 Ų | 70.4 | 11% | 0.107 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -44.7 | -49.5 | -176.7 | -65.7 | 2.3 | 0 | 0 | 0 | 113.2 | Q116 W119 I130 G134 V135 E136 Y189 | Q116-N132 PolarHBondContact OE1-ND2 3.42Å; W119-N132 HydrophobicContact CE3-CB 3.75Å; W119-N132 VanDerWaalsContact CE3-OD1 3.28Å; W119-N132 HydrophobicContact CZ3-CB 3.64Å; I130-N132 HydrophobicContact CG2-CB 3.8Å; I130-N132 WeakPolarHBondContact CG2-ND2 3.42Å; I130-N132 WeakPolarHBondContact CG2-OD1 3.23Å; N132-G134 VanDerWaalsContact C-N 3.34Å; N132-G134 PolarHBondContact O-N 2.93Å; N132-V135 PolarHBondContact O-N 3.32Å; N132-E136 WeakPolarHBondContact O-CG 3.46Å; N132-E136 PolarHBondContact O-N 2.92Å; N132-Y189 PolarHBondContact N-OH 3.21Å; N132-Y189 WeakPolarHBondContact OD1-CE1 3.45Å; N132-Y189 PolarHBondContact OD1-OH 3.45Å |
| 133 | G | 90.6 | Very high | 86.9 | Confident | 56 Ų | 56 | 68.8 Ų | 68.8 | 58% | 0.577 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -64.4 | -35.8 | 179.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | Y131 E136 A137 | Y131-G133 VanDerWaalsContact C-N 3.31Å; Y131-G133 PolarHBondContact O-N 3.01Å; Y131-G133 VanDerWaalsContact O-N 3.15Å; G133-E136 PolarHBondContact O-N 3.44Å; G133-A137 WeakPolarHBondContact O-CB 3.4Å; G133-A137 PolarHBondContact O-N 2.95Å |
| 134 | G | 86.5 | Confident | 86.3 | Confident | 43 Ų | 43 | 69.7 Ų | 69.7 | 44% | 0.443 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -67.1 | -39.8 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | Y131 N132 A137 V138 | Y131-G134 WeakPolarHBondContact O-CA 3.31Å; Y131-G134 PolarHBondContact O-N 3.4Å; N132-G134 VanDerWaalsContact C-N 3.34Å; N132-G134 PolarHBondContact O-N 2.93Å; G134-A137 PolarHBondContact O-N 2.9Å; G134-V138 WeakPolarHBondContact O-CB 3.16Å; G134-V138 VanDerWaalsContact O-CG2 3.3Å; G134-V138 WeakPolarHBondContact O-CG2 3.39Å; G134-V138 PolarHBondContact O-N 3.33Å |
| 135 | V | 94.4 | Very high | 85.9 | Confident | 15 Ų | 15 | 71.1 Ų | 71.1 | 9% | 0.091 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -65.4 | -40.2 | 176.7 | 178.9 | 0 | 0 | 0 | 0 | 110.9 | W119 Y131 N132 S139 Y189 Y192 V193 | W119-V135 HydrophobicContact CH2-CB 4.34Å; W119-V135 HydrophobicContact CH2-CG1 4.03Å; W119-V135 HydrophobicContact CZ2-CG1 4.11Å; Y131-V135 WeakPolarHBondContact O-CG2 3.14Å; Y131-V135 PolarHBondContact O-N 3.28Å; N132-V135 PolarHBondContact O-N 3.32Å; V135-S139 VanDerWaalsContact O-CB 3.3Å; V135-S139 WeakPolarHBondContact O-CB 3.43Å; V135-S139 PolarHBondContact O-N 3.38Å; V135-S139 PolarHBondContact O-OG 3.45Å; V135-Y189 HydrophobicContact CB-CD1 4.36Å; V135-Y189 HydrophobicContact CB-CG 4.43Å; V135-Y189 HydrophobicContact CG1-CD1 4.14Å; V135-Y189 HydrophobicContact CG1-CG 4.23Å; V135-Y189 HydrophobicContact CG2-CD1 3.75Å; V135-Y189 HydrophobicContact CG2-CD2 3.57Å; V135-Y189 HydrophobicContact CG2-CE1 4.09Å; V135-Y189 HydrophobicContact CG2-CE2 3.94Å; V135-Y189 HydrophobicContact CG2-CG 3.46Å; V135-Y189 VanDerWaalsContact CG2-CG 3.46Å; V135-Y192 HydrophobicContact CG1-CD1 3.85Å; V135-Y192 HydrophobicContact CG1-CE1 4.48Å; V135-V193 HydrophobicContact CG1-CG2 3.81Å |
| 136 | E | 89.9 | Confident | 85.6 | Confident | 47 Ų | 47 | 69.1 Ų | 69.1 | 22% | 0.22 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -62.5 | -43.2 | 172.6 | -73 | -65.2 | 171.5 | 0 | 0 | 112.3 | N132 G133 S139 T140 Y192 R196 | N132-E136 WeakPolarHBondContact O-CG 3.46Å; N132-E136 PolarHBondContact O-N 2.92Å; G133-E136 PolarHBondContact O-N 3.44Å; E136-S139 WeakPolarHBondContact CA-OG 3.45Å; E136-S139 PolarHBondContact O-OG 3.15Å; E136-T140 WeakPolarHBondContact O-CB 3.24Å; E136-T140 PolarHBondContact O-N 3.39Å; E136-T140 PolarHBondContact O-OG1 3.49Å; E136-Y192 VanDerWaalsContact CD-OH 3.29Å; E136-Y192 PolarHBondContact OE1-OH 3.38Å; E136-Y192 PolarHBondContact OE2-OH 2.94Å; E136-R196 IonicContact OE2-NH1 3.75Å |
| 137 | A | 85.4 | Confident | 85.6 | Confident | 62 Ų | 62 | 61.7 Ų | 61.7 | 51% | 0.512 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -64.2 | -47.9 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | G133 G134 T140 L141 | G133-A137 WeakPolarHBondContact O-CB 3.4Å; G133-A137 PolarHBondContact O-N 2.95Å; G134-A137 PolarHBondContact O-N 2.9Å; A137-T140 PolarHBondContact O-N 3.09Å; A137-L141 WeakPolarHBondContact O-CB 3.33Å; A137-L141 PolarHBondContact O-N 2.92Å |
| 138 | V | 90.6 | Very high | 85.7 | Confident | 74 Ų | 74 | 58.8 Ų | 58.8 | 45% | 0.448 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -61.6 | -47.9 | 178.4 | 168.4 | 0 | 0 | 0 | 0 | 111 | G134 T140 L141 L142 V193 | G134-V138 WeakPolarHBondContact O-CB 3.16Å; G134-V138 VanDerWaalsContact O-CG2 3.3Å; G134-V138 WeakPolarHBondContact O-CG2 3.39Å; G134-V138 PolarHBondContact O-N 3.33Å; V138-T140 VanDerWaalsContact C-N 3.29Å; V138-T140 PolarHBondContact O-N 3.27Å; V138-L141 PolarHBondContact O-N 3.21Å; V138-L142 HydrophobicContact CG1-CD1 3.7Å; V138-L142 HydrophobicContact CG1-CG 4.23Å; V138-L142 WeakPolarHBondContact O-CB 3.3Å; V138-L142 VanDerWaalsContact O-CG 3.31Å; V138-L142 WeakPolarHBondContact O-CG 3.37Å; V138-L142 PolarHBondContact O-N 2.94Å; V138-V193 HydrophobicContact CG1-CG1 4.49Å |
| 139 | S | 89.1 | Confident | 85.7 | Confident | 0 Ų | 0 | 59 Ų | 59 | 0% | 0 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -63.1 | -35.1 | 178.4 | 57.3 | 0 | 0 | 0 | 0 | 112.7 | V135 E136 G143 R196 | V135-S139 VanDerWaalsContact O-CB 3.3Å; V135-S139 WeakPolarHBondContact O-CB 3.43Å; V135-S139 PolarHBondContact O-N 3.38Å; V135-S139 PolarHBondContact O-OG 3.45Å; E136-S139 WeakPolarHBondContact CA-OG 3.45Å; E136-S139 PolarHBondContact O-OG 3.15Å; S139-G143 PolarHBondContact O-N 2.85Å; S139-R196 WeakPolarHBondContact OG-CD 3.49Å; S139-R196 PolarHBondContact OG-NH1 3.49Å |
| 140 | T | 84.3 | Confident | 85.9 | Confident | 76 Ų | 76 | 56.7 Ų | 56.7 | 47% | 0.466 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -68.3 | -45.9 | 175.4 | -57.8 | 0 | 0 | 0 | 0 | 111.5 | E136 A137 V138 G143 A144 R196 | E136-T140 WeakPolarHBondContact O-CB 3.24Å; E136-T140 PolarHBondContact O-N 3.39Å; E136-T140 PolarHBondContact O-OG1 3.49Å; A137-T140 PolarHBondContact O-N 3.09Å; V138-T140 VanDerWaalsContact C-N 3.29Å; V138-T140 PolarHBondContact O-N 3.27Å; T140-G143 PolarHBondContact O-N 3.04Å; T140-A144 PolarHBondContact O-N 3.07Å; T140-R196 PolarHBondContact OG1-NH1 2.96Å |
| 141 | L | 83.4 | Confident | 85.4 | Confident | 116 Ų | 116 | 56.9 Ų | 56.9 | 61% | 0.607 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -61.6 | -50.1 | 177.5 | 177.4 | 63.2 | 0 | 0 | 0 | 111.5 | A137 V138 G143 A144 V145 | A137-L141 WeakPolarHBondContact O-CB 3.33Å; A137-L141 PolarHBondContact O-N 2.92Å; V138-L141 PolarHBondContact O-N 3.21Å; L141-G143 VanDerWaalsContact C-N 3.3Å; L141-G143 PolarHBondContact O-N 3.48Å; L141-A144 WeakPolarHBondContact O-CB 3.34Å; L141-A144 PolarHBondContact O-N 2.91Å; L141-V145 WeakPolarHBondContact O-CG2 3.38Å; L141-V145 PolarHBondContact O-N 3.34Å |
| 142 | L | 87.6 | Confident | 84.9 | Confident | 72 Ų | 72 | 58.9 Ų | 58.9 | 38% | 0.377 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -66.6 | -34.3 | 179 | -65.3 | 178.6 | 0 | 0 | 0 | 111.8 | V138 V145 A146 V193 I197 | V138-L142 HydrophobicContact CG1-CD1 3.7Å; V138-L142 HydrophobicContact CG1-CG 4.23Å; V138-L142 WeakPolarHBondContact O-CB 3.3Å; V138-L142 VanDerWaalsContact O-CG 3.31Å; V138-L142 WeakPolarHBondContact O-CG 3.37Å; V138-L142 PolarHBondContact O-N 2.94Å; L142-V145 PolarHBondContact O-N 2.91Å; L142-A146 WeakPolarHBondContact O-CB 3.39Å; L142-A146 PolarHBondContact O-N 2.96Å; L142-V193 HydrophobicContact CD1-CG1 3.88Å; L142-I197 HydrophobicContact CB-CD1 3.54Å; L142-I197 HydrophobicContact CB-CG1 3.77Å; L142-I197 HydrophobicContact CD1-CD1 3.83Å; L142-I197 HydrophobicContact CG-CD1 4.33Å |
| 143 | G | 84.8 | Confident | 84.4 | Confident | 2 Ų | 2 | 60.7 Ų | 60.7 | 2% | 0.021 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -58.6 | -48.1 | 169.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | S139 T140 L141 V145 A146 V147 | S139-G143 PolarHBondContact O-N 2.85Å; T140-G143 PolarHBondContact O-N 3.04Å; L141-G143 VanDerWaalsContact C-N 3.3Å; L141-G143 PolarHBondContact O-N 3.48Å; G143-V145 VanDerWaalsContact C-N 3.33Å; G143-V145 PolarHBondContact O-N 3.41Å; G143-A146 WeakPolarHBondContact O-CB 3.44Å; G143-A146 PolarHBondContact O-N 2.87Å; G143-A146 VanDerWaalsContact O-N 3.16Å; G143-V147 VanDerWaalsContact O-CG2 3.29Å; G143-V147 WeakPolarHBondContact O-CG2 3.38Å; G143-V147 PolarHBondContact O-N 3.24Å |
| 144 | A | 80.7 | Confident | 84.1 | Confident | 58 Ų | 58 | 68 Ų | 68 | 48% | 0.479 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -60.7 | -40.6 | 177 | 0 | 0 | 0 | 0 | 0 | 112.6 | T140 L141 V147 F148 | T140-A144 PolarHBondContact O-N 3.07Å; L141-A144 WeakPolarHBondContact O-CB 3.34Å; L141-A144 PolarHBondContact O-N 2.91Å; A144-V147 PolarHBondContact O-N 3.41Å; A144-F148 PolarHBondContact O-N 3.29Å |
| 145 | V | 81.4 | Confident | 83.9 | Confident | 89 Ų | 89 | 69.3 Ų | 69.3 | 54% | 0.539 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -61.4 | -45.2 | 173.7 | 173.3 | 0 | 0 | 0 | 0 | 111.1 | L141 L142 G143 V147 F148 A149 | L141-V145 WeakPolarHBondContact O-CG2 3.38Å; L141-V145 PolarHBondContact O-N 3.34Å; L142-V145 PolarHBondContact O-N 2.91Å; G143-V145 VanDerWaalsContact C-N 3.33Å; G143-V145 PolarHBondContact O-N 3.41Å; V145-V147 PolarHBondContact O-N 2.92Å; V145-F148 PolarHBondContact O-N 3.49Å; V145-A149 PolarHBondContact O-N 3.41Å |
| 146 | A | 82.8 | Confident | 83.5 | Confident | 13 Ų | 13 | 71.5 Ų | 71.5 | 11% | 0.107 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -62.8 | -41.8 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | L142 G143 F148 A149 V150 I197 L201 | L142-A146 WeakPolarHBondContact O-CB 3.39Å; L142-A146 PolarHBondContact O-N 2.96Å; G143-A146 WeakPolarHBondContact O-CB 3.44Å; G143-A146 PolarHBondContact O-N 2.87Å; G143-A146 VanDerWaalsContact O-N 3.16Å; A146-F148 VanDerWaalsContact C-N 3.35Å; A146-F148 PolarHBondContact O-N 3.48Å; A146-A149 WeakPolarHBondContact O-CB 3.42Å; A146-A149 PolarHBondContact O-N 2.93Å; A146-A149 VanDerWaalsContact O-N 3.15Å; A146-V150 PolarHBondContact O-N 2.99Å; A146-V150 VanDerWaalsContact O-N 3.16Å; A146-I197 HydrophobicContact CB-CG2 3.88Å; A146-L201 HydrophobicContact CB-CB 4.5Å; A146-L201 HydrophobicContact CB-CD1 4.13Å |
| 147 | V | 83.6 | Confident | 83.4 | Confident | 51 Ų | 51 | 70.8 Ų | 70.8 | 31% | 0.309 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -59.5 | -44.6 | 174.6 | 169.5 | 0 | 0 | 0 | 0 | 111.1 | G143 A144 V145 A149 V150 M200 T204 | G143-V147 VanDerWaalsContact O-CG2 3.29Å; G143-V147 WeakPolarHBondContact O-CG2 3.38Å; G143-V147 PolarHBondContact O-N 3.24Å; A144-V147 PolarHBondContact O-N 3.41Å; V145-V147 PolarHBondContact O-N 2.92Å; V147-A149 VanDerWaalsContact C-N 3.3Å; V147-A149 PolarHBondContact O-N 3.35Å; V147-V150 WeakPolarHBondContact O-CB 3.31Å; V147-V150 PolarHBondContact O-N 3.47Å; V147-M200 HydrophobicContact CG2-CB 4.21Å; V147-T204 HydrophobicContact CG1-CG2 3.96Å; V147-T204 VanDerWaalsContact CG2-OG1 3.32Å; V147-T204 WeakPolarHBondContact CG2-OG1 3.21Å |
| 148 | F | 78.6 | Confident | 83.3 | Confident | 140 Ų | 140 | 72.2 Ų | 72.2 | 61% | 0.614 | 41% | 0.41 | S | S | * | . | H | α-helix | trans | -62.6 | -39.1 | 175.4 | -169.6 | -99.2 | 0 | 0 | 0 | 111.8 | A144 V145 A146 V150 G151 Y152 | A144-F148 PolarHBondContact O-N 3.29Å; V145-F148 PolarHBondContact O-N 3.49Å; A146-F148 VanDerWaalsContact C-N 3.35Å; A146-F148 PolarHBondContact O-N 3.48Å; F148-V150 PolarHBondContact O-N 3.49Å; F148-G151 PolarHBondContact O-N 3.4Å; F148-Y152 AromaticContact CD1-CE2 3.92Å; F148-Y152 HydrophobicContact CD1-CE2 3.92Å; F148-Y152 AromaticContact CE1-CE2 3.61Å; F148-Y152 HydrophobicContact CE1-CE2 3.61Å; F148-Y152 HydrophobicContact CZ-CE2 4.35Å |
| 149 | A | 80.3 | Confident | 82.8 | Confident | 44 Ų | 44 | 71 Ų | 71 | 36% | 0.364 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -63.1 | -27.2 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | V145 A146 V147 G151 Y152 | V145-A149 PolarHBondContact O-N 3.41Å; A146-A149 WeakPolarHBondContact O-CB 3.42Å; A146-A149 PolarHBondContact O-N 2.93Å; A146-A149 VanDerWaalsContact O-N 3.15Å; V147-A149 VanDerWaalsContact C-N 3.3Å; V147-A149 PolarHBondContact O-N 3.35Å; A149-G151 PolarHBondContact O-N 3.31Å; A149-Y152 PolarHBondContact O-N 2.95Å |
| 150 | V | 79.5 | Confident | 82.8 | Confident | 18 Ų | 18 | 78 Ų | 78 | 11% | 0.109 | 43% | 0.43 | C | S | . | . | H | α-helix | trans | -55.4 | -35.4 | 176.9 | 175.5 | 0 | 0 | 0 | 0 | 111.8 | A146 V147 F148 Y152 I153 L201 T204 I205 | A146-V150 PolarHBondContact O-N 2.99Å; A146-V150 VanDerWaalsContact O-N 3.16Å; V147-V150 WeakPolarHBondContact O-CB 3.31Å; V147-V150 PolarHBondContact O-N 3.47Å; F148-V150 PolarHBondContact O-N 3.49Å; V150-Y152 PolarHBondContact O-N 2.67Å; V150-Y152 VanDerWaalsContact O-N 3.1Å; V150-I153 WeakPolarHBondContact O-CB 3.29Å; V150-I153 PolarHBondContact O-N 3.33Å; V150-L201 HydrophobicContact CG2-CD1 3.67Å; V150-L201 HydrophobicContact CG2-CG 4.05Å; V150-T204 HydrophobicContact CB-CG2 4.22Å; V150-T204 HydrophobicContact CG1-CG2 4.19Å; V150-T204 HydrophobicContact CG2-CG2 4.17Å; V150-I205 HydrophobicContact CG1-CG1 3.64Å; V150-I205 HydrophobicContact CG2-CD1 4.38Å; V150-I205 HydrophobicContact CG2-CG1 4.02Å |
| 151 | G | 75.4 | Confident | 83.1 | Confident | 73 Ų | 73 | 74.5 Ų | 74.5 | 75% | 0.753 | 41% | 0.408 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.3 | -18.9 | 178.6 | 0 | 0 | 0 | 0 | 0 | 114.5 | F148 A149 | F148-G151 PolarHBondContact O-N 3.4Å; A149-G151 PolarHBondContact O-N 3.31Å |
| 152 | Y | 80.6 | Confident | 83.6 | Confident | 167 Ų | 167 | 70.2 Ų | 70.2 | 66% | 0.655 | 39% | 0.385 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -98 | -6.7 | 178.5 | -59.2 | -85.4 | 0 | 0 | 0 | 113.3 | F148 A149 V150 K154 | F148-Y152 AromaticContact CD1-CE2 3.92Å; F148-Y152 HydrophobicContact CD1-CE2 3.92Å; F148-Y152 AromaticContact CE1-CE2 3.61Å; F148-Y152 HydrophobicContact CE1-CE2 3.61Å; F148-Y152 HydrophobicContact CZ-CE2 4.35Å; A149-Y152 PolarHBondContact O-N 2.95Å; V150-Y152 PolarHBondContact O-N 2.67Å; V150-Y152 VanDerWaalsContact O-N 3.1Å; Y152-K154 PolarHBondContact O-N 3.01Å |
| 153 | I | 82.9 | Confident | 83.8 | Confident | 58 Ų | 58 | 69.7 Ų | 69.7 | 30% | 0.297 | 38% | 0.381 | S | S | . | . | trans | -79.4 | 111.2 | -176.7 | -60.6 | 178.9 | 0 | 0 | 0 | 110.3 | V150 I155 W157 L201 | V150-I153 WeakPolarHBondContact O-CB 3.29Å; V150-I153 PolarHBondContact O-N 3.33Å; I153-I155 HydrophobicContact CG2-CB 4.04Å; I153-I155 HydrophobicContact CG2-CD1 3.5Å; I153-I155 HydrophobicContact CG2-CG1 3.56Å; I153-I155 PolarHBondContact O-N 3.48Å; I153-W157 HydrophobicContact CB-CZ2 4.45Å; I153-W157 HydrophobicContact CG2-CH2 4.19Å; I153-W157 HydrophobicContact CG2-CZ2 3.71Å; I153-L201 HydrophobicContact CD1-CD1 4.49Å | ||
| 154 | K | 83.4 | Confident | 84.3 | Confident | 210 Ų | 210 | 70.5 Ų | 70.5 | 91% | 0.913 | 39% | 0.386 | S | S | * | . | trans | -98.1 | 66.5 | 176.9 | -62.8 | -176.1 | -178.7 | 179.3 | 0 | 111.6 | Y152 | Y152-K154 PolarHBondContact O-N 3.01Š| ||
| 155 | I | 84.1 | Confident | 85 | Confident | 71 Ų | 71 | 67.8 Ų | 67.8 | 36% | 0.364 | 36% | 0.364 | S | S | . | . | trans | -104.4 | 140.1 | 177 | -68.3 | 174.7 | 0 | 0 | 0 | 110.3 | I153 W157 W160 | I153-I155 HydrophobicContact CG2-CB 4.04Å; I153-I155 HydrophobicContact CG2-CD1 3.5Å; I153-I155 HydrophobicContact CG2-CG1 3.56Å; I153-I155 PolarHBondContact O-N 3.48Å; I155-W157 VanDerWaalsContact C-N 3.34Å; I155-W157 HydrophobicContact CB-CD2 4.39Å; I155-W157 HydrophobicContact CB-CH2 4.34Å; I155-W157 HydrophobicContact CB-CZ2 4.09Å; I155-W157 HydrophobicContact CD1-CH2 4.23Å; I155-W157 HydrophobicContact CG2-CD2 4.26Å; I155-W157 HydrophobicContact CG2-CE3 4.19Å; I155-W157 HydrophobicContact CG2-CZ3 4.32Å; I155-W157 PolarHBondContact O-N 3.45Å; I155-W157 PolarHBondContact O-NE1 2.91Å; I155-W160 HydrophobicContact CG2-CB 3.92Å | ||
| 156 | S | 86.1 | Confident | 85.7 | Confident | 60 Ų | 60 | 64 Ų | 64 | 42% | 0.42 | 34% | 0.341 | S | S | . | . | trans | -72.4 | 88.8 | 167.7 | 174.3 | 0 | 0 | 0 | 0 | 109.9 | S158 T159 W160 | S156-S158 PolarHBondContact O-N 3.38Å; S156-S158 PolarHBondContact OG-OG 2.95Å; S156-T159 PolarHBondContact O-N 3.42Å; S156-T159 PolarHBondContact OG-OG1 2.92Å; S156-W160 PolarHBondContact O-N 2.94Å | ||
| 157 | W | 87.8 | Confident | 86.4 | Confident | 32 Ų | 32 | 67.9 Ų | 67.9 | 12% | 0.121 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -61.9 | -24.1 | -179.1 | -61.2 | 109.2 | 0 | 0 | 0 | 113.7 | W97 I153 I155 T159 G161 T164 I205 Q209 | W97-W157 AromaticContact CH2-CE3 3.87Å; W97-W157 HydrophobicContact CH2-CE3 3.87Å; W97-W157 HydrophobicContact CH2-CZ3 4.29Å; W97-W157 HydrophobicContact CZ2-CB 4.29Å; W97-W157 HydrophobicContact CZ2-CE3 4.02Å; I153-W157 HydrophobicContact CB-CZ2 4.45Å; I153-W157 HydrophobicContact CG2-CH2 4.19Å; I153-W157 HydrophobicContact CG2-CZ2 3.71Å; I155-W157 VanDerWaalsContact C-N 3.34Å; I155-W157 HydrophobicContact CB-CD2 4.39Å; I155-W157 HydrophobicContact CB-CH2 4.34Å; I155-W157 HydrophobicContact CB-CZ2 4.09Å; I155-W157 HydrophobicContact CD1-CH2 4.23Å; I155-W157 HydrophobicContact CG2-CD2 4.26Å; I155-W157 HydrophobicContact CG2-CE3 4.19Å; I155-W157 HydrophobicContact CG2-CZ3 4.32Å; I155-W157 PolarHBondContact O-N 3.45Å; I155-W157 PolarHBondContact O-NE1 2.91Å; W157-T159 PolarHBondContact O-N 3.39Å; W157-G161 VanDerWaalsContact O-CA 3.28Å; W157-G161 WeakPolarHBondContact O-CA 3.34Å; W157-G161 PolarHBondContact O-N 3.42Å; W157-T164 HydrophobicContact CZ3-CG2 4Å; W157-I205 HydrophobicContact CD2-CG2 4.08Å; W157-I205 HydrophobicContact CE3-CG2 3.86Å; W157-I205 HydrophobicContact CH2-CD1 3.58Å; W157-I205 HydrophobicContact CH2-CG1 4.04Å; W157-I205 HydrophobicContact CH2-CG2 3.72Å; W157-I205 HydrophobicContact CZ2-CD1 4.15Å; W157-I205 HydrophobicContact CZ2-CG1 4.18Å; W157-I205 HydrophobicContact CZ2-CG2 3.92Å; W157-I205 HydrophobicContact CZ3-CD1 4.27Å; W157-I205 HydrophobicContact CZ3-CG2 3.68Å; W157-Q209 HydrophobicContact CB-CG 4.25Å; W157-Q209 HydrophobicContact CG-CG 4.27Å; W157-Q209 VanDerWaalsContact CG-NE2 3.28Å |
| 158 | S | 81.6 | Confident | 87.1 | Confident | 93 Ų | 93 | 68.1 Ų | 68.1 | 65% | 0.65 | 36% | 0.357 | S | S | * | . | H | α-helix | trans | -70.5 | -15.7 | 173.3 | 64.7 | 0 | 0 | 0 | 0 | 114.2 | S156 K280 | S156-S158 PolarHBondContact O-N 3.38Å; S156-S158 PolarHBondContact OG-OG 2.95Å; S158-K280 PolarHBondContact O-NZ 2.69Å |
| 159 | T | 81.8 | Confident | 88 | Confident | 49 Ų | 49 | 61.5 Ų | 61.5 | 30% | 0.301 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -112.4 | -44.5 | 179.8 | -57.1 | 0 | 0 | 0 | 0 | 111.9 | S156 W157 K280 | S156-T159 PolarHBondContact O-N 3.42Å; S156-T159 PolarHBondContact OG-OG1 2.92Å; W157-T159 PolarHBondContact O-N 3.39Å; T159-K280 PolarHBondContact OG1-NZ 3.44Å |
| 160 | W | 88.4 | Confident | 88.9 | Confident | 147 Ų | 147 | 64 Ų | 64 | 56% | 0.557 | 33% | 0.334 | S | S | * | . | H | α-helix | trans | -101.3 | -6.4 | -173.2 | -64.9 | 97.4 | 0 | 0 | 0 | 113.5 | I155 S156 E162 M163 T164 | I155-W160 HydrophobicContact CG2-CB 3.92Å; S156-W160 PolarHBondContact O-N 2.94Å; W160-E162 PolarHBondContact O-N 3.2Å; W160-M163 HydrophobicContact CE3-CB 4.39Å; W160-M163 PolarHBondContact O-N 3.47Å; W160-T164 WeakPolarHBondContact O-CB 3.46Å; W160-T164 PolarHBondContact O-N 3.34Å; W160-T164 PolarHBondContact O-OG1 2.89Å |
| 161 | G | 91.4 | Very high | 89.8 | Confident | 2 Ų | 2 | 66.7 Ų | 66.7 | 2% | 0.021 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -52 | -55.1 | -175.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | W157 M163 T164 L165 | W157-G161 VanDerWaalsContact O-CA 3.28Å; W157-G161 WeakPolarHBondContact O-CA 3.34Å; W157-G161 PolarHBondContact O-N 3.42Å; G161-M163 VanDerWaalsContact C-N 3.35Å; G161-M163 PolarHBondContact O-N 2.97Å; G161-T164 WeakPolarHBondContact O-CB 3.32Å; G161-T164 PolarHBondContact O-N 2.72Å; G161-L165 VanDerWaalsContact O-CG 3.3Å; G161-L165 WeakPolarHBondContact O-CG 3.26Å; G161-L165 PolarHBondContact O-N 3.09Å |
| 162 | E | 93.3 | Very high | 90.9 | Very high | 25 Ų | 25 | 63.2 Ų | 63.2 | 12% | 0.117 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -63.5 | -38.5 | -178.8 | -62.1 | 177 | 131.8 | 0 | 0 | 112.7 | R92 C96 W160 L165 S166 S272 G273 S276 | R92-E162 IonicContact CZ-OE1 3.93Å; R92-E162 IonicContact NH2-OE1 3.54Å; C96-E162 PolarHBondContact SG-OE1 2.97Å; W160-E162 PolarHBondContact O-N 3.2Å; E162-L165 PolarHBondContact O-N 2.94Å; E162-S166 WeakPolarHBondContact O-CB 3.2Å; E162-S166 PolarHBondContact O-N 3.49Å; E162-S272 WeakPolarHBondContact OE1-CB 3.34Å; E162-S272 PolarHBondContact OE1-OG 2.94Å; E162-G273 WeakPolarHBondContact OE2-CA 3.04Å; E162-G273 PolarHBondContact OE2-N 3.08Å; E162-S276 WeakPolarHBondContact OE2-CB 3.39Å; E162-S276 PolarHBondContact OE2-OG 2.87Å |
| 163 | M | 92.3 | Very high | 91.8 | Very high | 61 Ų | 61 | 55.5 Ų | 55.5 | 30% | 0.3 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -67.2 | -40.1 | 176.7 | -63.5 | -60.2 | -68.4 | 0 | 0 | 111.3 | W160 G161 S166 L167 L270 | W160-M163 HydrophobicContact CE3-CB 4.39Å; W160-M163 PolarHBondContact O-N 3.47Å; G161-M163 VanDerWaalsContact C-N 3.35Å; G161-M163 PolarHBondContact O-N 2.97Å; M163-S166 PolarHBondContact O-N 2.9Å; M163-L167 WeakPolarHBondContact O-CB 3.39Å; M163-L167 PolarHBondContact O-N 3.45Å; M163-L270 HydrophobicContact CE-CD1 3.89Å; M163-L270 HydrophobicContact SD-CD1 4.22Å |
| 164 | T | 93.6 | Very high | 92.5 | Very high | 20 Ų | 20 | 54.8 Ų | 54.8 | 12% | 0.123 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -63.4 | -47.3 | 174.1 | -59.3 | 0 | 0 | 0 | 0 | 110.8 | W157 W160 G161 S166 L167 F168 L202 | W157-T164 HydrophobicContact CZ3-CG2 4Å; W160-T164 WeakPolarHBondContact O-CB 3.46Å; W160-T164 PolarHBondContact O-N 3.34Å; W160-T164 PolarHBondContact O-OG1 2.89Å; G161-T164 WeakPolarHBondContact O-CB 3.32Å; G161-T164 PolarHBondContact O-N 2.72Å; T164-S166 VanDerWaalsContact C-N 3.29Å; T164-S166 PolarHBondContact O-N 2.96Å; T164-L167 PolarHBondContact O-N 2.89Å; T164-F168 HydrophobicContact CG2-CD2 3.53Å; T164-F168 HydrophobicContact CG2-CE2 3.69Å; T164-F168 WeakPolarHBondContact O-CD2 3.45Å; T164-F168 PolarHBondContact O-N 3.31Å; T164-L202 HydrophobicContact CG2-CD2 4.3Å |
| 165 | L | 95.8 | Very high | 93.2 | Very high | 1 Ų | 1 | 45 Ų | 45 | 1% | 0.005 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -57.2 | -44.6 | 176.1 | -71.3 | 179.9 | 0 | 0 | 0 | 111.3 | W97 W100 G161 E162 S169 L202 F269 | W97-L165 HydrophobicContact CD2-CD1 4.29Å; W97-L165 HydrophobicContact CE3-CD1 3.82Å; W97-L165 HydrophobicContact CE3-CD2 3.87Å; W97-L165 HydrophobicContact CE3-CG 4.16Å; W97-L165 HydrophobicContact CH2-CD1 4.39Å; W97-L165 HydrophobicContact CH2-CD2 4.12Å; W97-L165 HydrophobicContact CH2-CG 4.1Å; W97-L165 HydrophobicContact CZ3-CD1 3.9Å; W97-L165 HydrophobicContact CZ3-CD2 3.35Å; W97-L165 HydrophobicContact CZ3-CG 3.71Å; W100-L165 HydrophobicContact CB-CD1 3.82Å; W100-L165 HydrophobicContact CB-CD2 4.32Å; W100-L165 HydrophobicContact CD2-CD2 3.4Å; W100-L165 HydrophobicContact CD2-CG 4.44Å; W100-L165 HydrophobicContact CE3-CD2 3.88Å; W100-L165 HydrophobicContact CG-CB 4.37Å; W100-L165 HydrophobicContact CG-CD1 3.85Å; W100-L165 HydrophobicContact CG-CD2 3.55Å; W100-L165 HydrophobicContact CG-CG 4.11Å; W100-L165 HydrophobicContact CZ2-CD2 4.41Å; G161-L165 VanDerWaalsContact O-CG 3.3Å; G161-L165 WeakPolarHBondContact O-CG 3.26Å; G161-L165 PolarHBondContact O-N 3.09Å; E162-L165 PolarHBondContact O-N 2.94Å; L165-S169 WeakPolarHBondContact O-CB 3.36Å; L165-S169 PolarHBondContact O-N 2.92Å; L165-S169 PolarHBondContact O-OG 3.19Å; L165-S169 VanDerWaalsContact O-OG 3.04Å; L165-L202 HydrophobicContact CD2-CD2 4.44Å; L165-F269 HydrophobicContact CB-CB 4.28Å; L165-F269 HydrophobicContact CB-CD1 4Å; L165-F269 HydrophobicContact CB-CG 4.09Å; L165-F269 HydrophobicContact CD1-CD1 3.71Å; L165-F269 HydrophobicContact CD1-CE1 3.62Å; L165-F269 HydrophobicContact CD1-CG 4.5Å; L165-F269 HydrophobicContact CD1-CZ 4.38Å |
| 166 | S | 97.2 | Very high | 93.9 | Very high | 8 Ų | 8 | 41.7 Ų | 41.7 | 6% | 0.056 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -60.9 | -54.4 | 176.6 | 178.1 | 0 | 0 | 0 | 0 | 112.7 | E162 M163 T164 F168 S169 L170 A266 L270 | E162-S166 WeakPolarHBondContact O-CB 3.2Å; E162-S166 PolarHBondContact O-N 3.49Å; M163-S166 PolarHBondContact O-N 2.9Å; T164-S166 VanDerWaalsContact C-N 3.29Å; T164-S166 PolarHBondContact O-N 2.96Å; S166-F168 PolarHBondContact O-N 3.27Å; S166-S169 PolarHBondContact O-N 3.3Å; S166-L170 PolarHBondContact O-N 3.35Å; S166-A266 WeakPolarHBondContact CB-O 3.34Å; S166-A266 WeakPolarHBondContact O-CB 3.08Å; S166-A266 PolarHBondContact OG-O 3.37Å; S166-L270 VanDerWaalsContact OG-CB 3.31Å; S166-L270 WeakPolarHBondContact OG-CB 3.23Å; S166-L270 PolarHBondContact OG-N 2.88Å |
| 167 | L | 97.3 | Very high | 94.5 | Very high | 96 Ų | 96 | 44.5 Ų | 44.5 | 50% | 0.503 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -57.6 | -51.5 | -177.2 | 173.3 | 62.1 | 0 | 0 | 0 | 111.4 | M163 T164 L170 L171 | M163-L167 WeakPolarHBondContact O-CB 3.39Å; M163-L167 PolarHBondContact O-N 3.45Å; T164-L167 PolarHBondContact O-N 2.89Å; L167-L170 WeakPolarHBondContact O-CB 3.31Å; L167-L170 PolarHBondContact O-N 3.12Å; L167-L171 HydrophobicContact CG-CD1 4.48Å; L167-L171 WeakPolarHBondContact O-CG 3.16Å; L167-L171 PolarHBondContact O-N 2.97Å |
| 168 | F | 97.5 | Very high | 95 | Very high | 56 Ų | 56 | 46 Ų | 46 | 25% | 0.246 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -75.4 | -27.3 | -175.9 | -76.9 | -80.8 | 0 | 0 | 0 | 112.5 | T164 S166 L170 L171 I172 I198 L201 L202 | T164-F168 HydrophobicContact CG2-CD2 3.53Å; T164-F168 HydrophobicContact CG2-CE2 3.69Å; T164-F168 WeakPolarHBondContact O-CD2 3.45Å; T164-F168 PolarHBondContact O-N 3.31Å; S166-F168 PolarHBondContact O-N 3.27Å; F168-L170 VanDerWaalsContact C-N 3.31Å; F168-L171 HydrophobicContact CD1-CD1 3.85Å; F168-L171 HydrophobicContact CE1-CD1 4.21Å; F168-L171 HydrophobicContact CG-CD1 4.5Å; F168-L171 PolarHBondContact O-N 3.4Å; F168-I172 WeakPolarHBondContact O-CG1 3.42Å; F168-I172 PolarHBondContact O-N 2.83Å; F168-I198 HydrophobicContact CB-CG2 3.79Å; F168-I198 HydrophobicContact CD1-CG1 4.32Å; F168-I198 HydrophobicContact CD1-CG2 3.59Å; F168-I198 HydrophobicContact CG-CG2 4.13Å; F168-L201 HydrophobicContact CE1-CD2 4.37Å; F168-L201 HydrophobicContact CZ-CD2 4.31Å; F168-L202 HydrophobicContact CB-CD1 3.49Å; F168-L202 VanDerWaalsContact CB-CD1 3.49Å; F168-L202 HydrophobicContact CB-CD2 3.89Å; F168-L202 HydrophobicContact CB-CG 3.91Å; F168-L202 HydrophobicContact CD2-CD2 4.08Å; F168-L202 HydrophobicContact CG-CD1 4.49Å; F168-L202 HydrophobicContact CG-CD2 4.13Å; F168-L202 HydrophobicContact CG-CG 4.42Å |
| 169 | S | 98.5 | Very high | 95.7 | Very high | 0 Ų | 0 | 41.6 Ų | 41.6 | 0% | 0 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -64.2 | -35.6 | 166.8 | -75.3 | 0 | 0 | 0 | 0 | 112.2 | W100 L165 S166 I172 A173 | W100-S169 PolarHBondContact NE1-OG 3.37Å; L165-S169 WeakPolarHBondContact O-CB 3.36Å; L165-S169 PolarHBondContact O-N 2.92Å; L165-S169 PolarHBondContact O-OG 3.19Å; L165-S169 VanDerWaalsContact O-OG 3.04Å; S166-S169 PolarHBondContact O-N 3.3Å; S169-I172 PolarHBondContact O-N 3Å; S169-A173 WeakPolarHBondContact O-CB 3.2Å; S169-A173 PolarHBondContact O-N 2.92Å |
| 170 | L | 98.4 | Very high | 96.2 | Very high | 96 Ų | 96 | 40.4 Ų | 40.4 | 50% | 0.503 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -67.4 | -40.2 | 173.4 | -175.8 | 64.3 | 0 | 0 | 0 | 111.5 | S166 L167 F168 I172 A173 A174 A266 | S166-L170 PolarHBondContact O-N 3.35Å; L167-L170 WeakPolarHBondContact O-CB 3.31Å; L167-L170 PolarHBondContact O-N 3.12Å; F168-L170 VanDerWaalsContact C-N 3.31Å; L170-I172 VanDerWaalsContact C-N 3.34Å; L170-A173 WeakPolarHBondContact O-CB 3.41Å; L170-A173 PolarHBondContact O-N 3.01Å; L170-A174 PolarHBondContact O-N 3.23Å; L170-A266 HydrophobicContact CB-CB 3.88Å |
| 171 | L | 98.6 | Very high | 96.5 | Very high | 76 Ų | 76 | 36.6 Ų | 36.6 | 40% | 0.398 | 19% | 0.193 | S | C | . | . | H | α-helix | trans | -64.6 | -38.7 | 174.6 | -66 | 176 | 0 | 0 | 0 | 112 | L167 F168 A174 A175 I198 | L167-L171 HydrophobicContact CG-CD1 4.48Å; L167-L171 WeakPolarHBondContact O-CG 3.16Å; L167-L171 PolarHBondContact O-N 2.97Å; F168-L171 HydrophobicContact CD1-CD1 3.85Å; F168-L171 HydrophobicContact CE1-CD1 4.21Å; F168-L171 HydrophobicContact CG-CD1 4.5Å; F168-L171 PolarHBondContact O-N 3.4Å; L171-A174 PolarHBondContact O-N 3.17Å; L171-A175 WeakPolarHBondContact O-CB 3.37Å; L171-A175 PolarHBondContact O-N 2.97Å; L171-I198 HydrophobicContact CB-CD1 3.76Å; L171-I198 HydrophobicContact CD1-CD1 4.47Å |
| 172 | I | 98.7 | Very high | 96.5 | Very high | 0 Ų | 0 | 40.1 Ų | 40.1 | 0% | 0 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -59.9 | -48.8 | 170.5 | -74.9 | 166.6 | 0 | 0 | 0 | 110.2 | F168 S169 L170 A174 A175 V176 F195 I198 L202 F262 | F168-I172 WeakPolarHBondContact O-CG1 3.42Å; F168-I172 PolarHBondContact O-N 2.83Å; S169-I172 PolarHBondContact O-N 3Å; L170-I172 VanDerWaalsContact C-N 3.34Å; I172-A174 VanDerWaalsContact C-N 3.32Å; I172-A174 PolarHBondContact O-N 2.95Å; I172-A175 PolarHBondContact O-N 3.5Å; I172-V176 HydrophobicContact CG2-CG2 4.27Å; I172-V176 VanDerWaalsContact O-CG2 3.31Å; I172-V176 WeakPolarHBondContact O-CG2 3.29Å; I172-V176 PolarHBondContact O-N 2.85Å; I172-F195 HydrophobicContact CG1-CD2 4.35Å; I172-F195 HydrophobicContact CG2-CD2 3.76Å; I172-F195 HydrophobicContact CG2-CE2 3.98Å; I172-I198 HydrophobicContact CD1-CG2 3.84Å; I172-I198 HydrophobicContact CG1-CB 4.08Å; I172-I198 HydrophobicContact CG1-CG2 3.63Å; I172-L202 HydrophobicContact CD1-CD1 4.25Å; I172-F262 HydrophobicContact CB-CD1 4.37Å; I172-F262 HydrophobicContact CB-CG 4.42Å; I172-F262 HydrophobicContact CG2-CB 3.98Å; I172-F262 HydrophobicContact CG2-CD1 3.55Å; I172-F262 HydrophobicContact CG2-CD2 3.51Å; I172-F262 HydrophobicContact CG2-CE1 3.78Å; I172-F262 HydrophobicContact CG2-CE2 3.75Å; I172-F262 HydrophobicContact CG2-CG 3.41Å; I172-F262 VanDerWaalsContact CG2-CG 3.41Å; I172-F262 HydrophobicContact CG2-CZ 3.87Å |
| 173 | A | 98.7 | Very high | 96.4 | Very high | 5 Ų | 5 | 41.6 Ų | 41.6 | 4% | 0.041 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -57.5 | -45.3 | 179.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | S169 L170 V176 Y177 A259 F262 A263 | S169-A173 WeakPolarHBondContact O-CB 3.2Å; S169-A173 PolarHBondContact O-N 2.92Å; L170-A173 WeakPolarHBondContact O-CB 3.41Å; L170-A173 PolarHBondContact O-N 3.01Å; A173-V176 PolarHBondContact O-N 3.01Å; A173-Y177 WeakPolarHBondContact O-CB 3.47Å; A173-Y177 PolarHBondContact O-N 2.91Å; A173-A259 WeakPolarHBondContact CB-O 3.47Å; A173-F262 HydrophobicContact CB-CB 3.78Å; A173-A263 HydrophobicContact CB-CB 4.02Å |
| 174 | A | 98.6 | Very high | 96.4 | Very high | 43 Ų | 43 | 42.2 Ų | 42.2 | 36% | 0.355 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -62.3 | -45.7 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | L170 L171 I172 V176 Y177 I178 | L170-A174 PolarHBondContact O-N 3.23Å; L171-A174 PolarHBondContact O-N 3.17Å; I172-A174 VanDerWaalsContact C-N 3.32Å; I172-A174 PolarHBondContact O-N 2.95Å; A174-V176 PolarHBondContact O-N 2.72Å; A174-Y177 PolarHBondContact O-N 3.21Å; A174-I178 WeakPolarHBondContact O-CB 3.05Å; A174-I178 WeakPolarHBondContact O-CD1 3.31Å; A174-I178 VanDerWaalsContact O-CG1 3.23Å; A174-I178 WeakPolarHBondContact O-CG1 3.47Å; A174-I178 PolarHBondContact O-N 3.44Å |
| 175 | A | 98.6 | Very high | 96.5 | Very high | 5 Ų | 5 | 41.9 Ų | 41.9 | 4% | 0.041 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -59.9 | -47.4 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | L171 I172 Y177 I178 M179 V194 F195 | L171-A175 WeakPolarHBondContact O-CB 3.37Å; L171-A175 PolarHBondContact O-N 2.97Å; I172-A175 PolarHBondContact O-N 3.5Å; A175-Y177 VanDerWaalsContact C-N 3.34Å; A175-Y177 PolarHBondContact O-N 3.28Å; A175-I178 PolarHBondContact O-N 2.9Å; A175-M179 VanDerWaalsContact O-CG 3.3Å; A175-M179 WeakPolarHBondContact O-CG 3.41Å; A175-M179 PolarHBondContact O-N 3.45Å; A175-V194 HydrophobicContact CB-CG1 4.4Å; A175-F195 HydrophobicContact CB-CB 4.05Å |
| 176 | V | 98.6 | Very high | 96.5 | Very high | 0 Ų | 0 | 49.7 Ų | 49.7 | 0% | 0 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -63.9 | -38.1 | 178.1 | 176.7 | 0 | 0 | 0 | 0 | 111.6 | V111 I172 A173 A174 M179 F195 F255 A259 | V111-V176 HydrophobicContact CG1-CG2 4.42Å; V111-V176 HydrophobicContact CG2-CG1 4.06Å; V111-V176 HydrophobicContact CG2-CG2 3.89Å; I172-V176 HydrophobicContact CG2-CG2 4.27Å; I172-V176 VanDerWaalsContact O-CG2 3.31Å; I172-V176 WeakPolarHBondContact O-CG2 3.29Å; I172-V176 PolarHBondContact O-N 2.85Å; A173-V176 PolarHBondContact O-N 3.01Å; A174-V176 PolarHBondContact O-N 2.72Å; V176-M179 WeakPolarHBondContact O-CB 3.35Å; V176-M179 PolarHBondContact O-N 3.3Å; V176-F195 HydrophobicContact CG2-CD2 3.95Å; V176-F195 HydrophobicContact CG2-CE2 4.31Å; V176-F195 HydrophobicContact CG2-CG 4.36Å; V176-F255 HydrophobicContact CG1-CD1 3.93Å; V176-A259 HydrophobicContact CB-CB 4.26Å; V176-A259 HydrophobicContact CG1-CB 4.06Å |
| 177 | Y | 98.3 | Very high | 96.5 | Very high | 119 Ų | 119 | 51.7 Ų | 51.7 | 47% | 0.467 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -65.7 | -42.1 | 175.1 | -178.2 | -104.3 | 0 | 0 | 0 | 112.5 | A173 A174 A175 M179 D180 T181 L256 | A173-Y177 WeakPolarHBondContact O-CB 3.47Å; A173-Y177 PolarHBondContact O-N 2.91Å; A174-Y177 PolarHBondContact O-N 3.21Å; A175-Y177 VanDerWaalsContact C-N 3.34Å; A175-Y177 PolarHBondContact O-N 3.28Å; Y177-M179 VanDerWaalsContact C-N 3.29Å; Y177-M179 PolarHBondContact O-N 2.91Å; Y177-D180 PolarHBondContact O-N 3.42Å; Y177-T181 HydrophobicContact CD1-CG2 4.27Å; Y177-T181 HydrophobicContact CD2-CG2 4.15Å; Y177-T181 HydrophobicContact CE1-CG2 3.87Å; Y177-T181 HydrophobicContact CE2-CG2 3.74Å; Y177-T181 HydrophobicContact CG-CG2 4.41Å; Y177-T181 WeakPolarHBondContact O-CG2 3.33Å; Y177-T181 PolarHBondContact O-N 3.29Å; Y177-T181 PolarHBondContact O-OG1 2.93Å; Y177-L256 HydrophobicContact CD2-CD1 3.98Å; Y177-L256 HydrophobicContact CE2-CD1 3.81Å |
| 178 | I | 98.2 | Very high | 96.4 | Very high | 64 Ų | 64 | 47.2 Ų | 47.2 | 33% | 0.328 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -65.4 | -34.4 | 177.9 | -70.3 | 161.9 | 0 | 0 | 0 | 111.2 | A174 A175 D180 V182 V187 S191 | A174-I178 WeakPolarHBondContact O-CB 3.05Å; A174-I178 WeakPolarHBondContact O-CD1 3.31Å; A174-I178 VanDerWaalsContact O-CG1 3.23Å; A174-I178 WeakPolarHBondContact O-CG1 3.47Å; A174-I178 PolarHBondContact O-N 3.44Å; A175-I178 PolarHBondContact O-N 2.9Å; I178-D180 PolarHBondContact O-N 3.31Å; I178-V182 HydrophobicContact CG2-CG2 3.83Å; I178-V187 HydrophobicContact CG2-CG1 3.59Å; I178-S191 WeakPolarHBondContact CG2-OG 3.13Å |
| 179 | M | 97.3 | Very high | 96.5 | Very high | 1 Ų | 1 | 45 Ų | 45 | 1% | 0.005 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -55.9 | -37.2 | 179 | -74.5 | 170.2 | 62.4 | 0 | 0 | 112.9 | V111 T115 L118 A175 V176 Y177 C188 Y192 F255 | V111-M179 HydrophobicContact CG1-CE 4.28Å; T115-M179 WeakPolarHBondContact OG1-CE 3.47Å; L118-M179 HydrophobicContact CD2-CB 3.94Å; L118-M179 HydrophobicContact CD2-CE 4.18Å; A175-M179 VanDerWaalsContact O-CG 3.3Å; A175-M179 WeakPolarHBondContact O-CG 3.41Å; A175-M179 PolarHBondContact O-N 3.45Å; V176-M179 WeakPolarHBondContact O-CB 3.35Å; V176-M179 PolarHBondContact O-N 3.3Å; Y177-M179 VanDerWaalsContact C-N 3.29Å; Y177-M179 PolarHBondContact O-N 2.91Å; M179-C188 PolarHBondContact O-SG 3.35Å; M179-Y192 HydrophobicContact CE-CD2 3.68Å; M179-Y192 HydrophobicContact CE-CG 4.25Å; M179-Y192 HydrophobicContact SD-CD2 4.25Å; M179-F255 HydrophobicContact CE-CD1 4.49Å; M179-F255 HydrophobicContact CE-CE1 3.63Å; M179-F255 HydrophobicContact CE-CZ 4.34Å; M179-F255 HydrophobicContact SD-CE1 4.46Å |
| 180 | D | 92.1 | Very high | 96.4 | Very high | 24 Ų | 24 | 47.6 Ų | 47.6 | 13% | 0.128 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -90 | -41.5 | -178.6 | 173.9 | 62.8 | 0 | 0 | 0 | 112.8 | L118 Y177 I178 T252 F255 | L118-D180 HydrophobicContact CD1-CB 4.32Å; Y177-D180 PolarHBondContact O-N 3.42Å; I178-D180 PolarHBondContact O-N 3.31Å; D180-T252 VanDerWaalsContact OD1-CA 3.23Å; D180-T252 WeakPolarHBondContact OD1-CA 3.4Å; D180-T252 VanDerWaalsContact OD1-CB 3.27Å; D180-T252 WeakPolarHBondContact OD1-CB 3.3Å; D180-T252 VanDerWaalsContact OD1-CG2 3.31Å; D180-T252 WeakPolarHBondContact OD1-CG2 3.35Å; D180-T252 PolarHBondContact OD1-OG1 2.81Å; D180-T252 WeakPolarHBondContact OD2-CG2 3.45Å; D180-F255 HydrophobicContact CB-CB 3.94Å |
| 181 | T | 93.4 | Very high | 96.4 | Very high | 67 Ų | 67 | 43.6 Ų | 43.6 | 41% | 0.411 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -77.6 | -28.2 | -165.5 | 49.4 | 0 | 0 | 0 | 0 | 115.8 | Y177 | Y177-T181 HydrophobicContact CD1-CG2 4.27Å; Y177-T181 HydrophobicContact CD2-CG2 4.15Å; Y177-T181 HydrophobicContact CE1-CG2 3.87Å; Y177-T181 HydrophobicContact CE2-CG2 3.74Å; Y177-T181 HydrophobicContact CG-CG2 4.41Å; Y177-T181 WeakPolarHBondContact O-CG2 3.33Å; Y177-T181 PolarHBondContact O-N 3.29Å; Y177-T181 PolarHBondContact O-OG1 2.93Å |
| 182 | V | 92.4 | Very high | 96.4 | Very high | 75 Ų | 75 | 40 Ų | 40 | 46% | 0.455 | 23% | 0.228 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -81.5 | -19.5 | -170.4 | -179.9 | 0 | 0 | 0 | 0 | 113 | I178 N184 V187 | I178-V182 HydrophobicContact CG2-CG2 3.83Å; V182-N184 HydrophobicContact CG1-CB 4.15Å; V182-N184 PolarHBondContact O-N 2.93Å; V182-N184 VanDerWaalsContact O-N 3.09Å; V182-V187 HydrophobicContact CB-CB 4.34Å; V182-V187 HydrophobicContact CB-CG1 3.95Å; V182-V187 HydrophobicContact CG1-CB 3.94Å; V182-V187 HydrophobicContact CG1-CG1 3.87Å; V182-V187 HydrophobicContact CG1-CG2 4Å; V182-V187 HydrophobicContact CG2-CG1 4Å |
| 183 | G | 90.1 | Very high | 96.4 | Very high | 56 Ų | 56 | 41 Ų | 41 | 58% | 0.577 | 24% | 0.235 | S | C | * | . | trans | 63 | 15.6 | 177.8 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 184 | N | 93.6 | Very high | 96.4 | Very high | 74 Ų | 74 | 44.1 Ų | 44.1 | 40% | 0.396 | 25% | 0.253 | S | S | . | . | trans | -117.5 | 125.9 | 176.8 | -175.2 | -64.7 | 0 | 0 | 0 | 110.1 | V182 W186 V187 C188 | V182-N184 HydrophobicContact CG1-CB 4.15Å; V182-N184 PolarHBondContact O-N 2.93Å; V182-N184 VanDerWaalsContact O-N 3.09Å; N184-W186 VanDerWaalsContact C-N 3.32Å; N184-W186 PolarHBondContact O-N 3.42Å; N184-W186 WeakPolarHBondContact OD1-CB 3.39Å; N184-W186 PolarHBondContact OD1-N 3.25Å; N184-V187 HydrophobicContact CB-CB 4.29Å; N184-V187 HydrophobicContact CB-CG2 4.12Å; N184-V187 PolarHBondContact O-N 3.09Å; N184-V187 PolarHBondContact OD1-N 3.02Å; N184-C188 WeakPolarHBondContact O-CB 3.3Å; N184-C188 PolarHBondContact O-N 3.34Å | ||
| 185 | I | 94.4 | Very high | 96.4 | Very high | 14 Ų | 14 | 42 Ų | 42 | 7% | 0.072 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -62.3 | -35.8 | -175 | -166.5 | 62.5 | 0 | 0 | 0 | 113.2 | W119 V122 M123 C188 Y189 | W119-I185 HydrophobicContact CB-CD1 4.06Å; W119-I185 HydrophobicContact CG-CD1 4.11Å; V122-I185 HydrophobicContact CB-CD1 4.38Å; V122-I185 HydrophobicContact CG1-CB 4.12Å; V122-I185 HydrophobicContact CG1-CD1 4.22Å; M123-I185 HydrophobicContact CB-CB 4.09Å; M123-I185 HydrophobicContact CB-CD1 4.23Å; M123-I185 HydrophobicContact CB-CG1 4.13Å; M123-I185 HydrophobicContact CE-CG1 4.06Å; M123-I185 HydrophobicContact CE-CG2 4.32Å; M123-I185 HydrophobicContact SD-CB 4.3Å; M123-I185 HydrophobicContact SD-CG1 4.4Å; M123-I185 HydrophobicContact SD-CG2 3.82Å; I185-C188 WeakPolarHBondContact O-CB 3.47Å; I185-C188 PolarHBondContact O-N 2.82Å; I185-Y189 HydrophobicContact CD1-CD1 4.11Å; I185-Y189 HydrophobicContact CD1-CE1 3.59Å; I185-Y189 HydrophobicContact CD1-CE2 4.29Å; I185-Y189 HydrophobicContact CG1-CD1 4.28Å; I185-Y189 HydrophobicContact CG1-CD2 4.05Å; I185-Y189 HydrophobicContact CG1-CE1 3.83Å; I185-Y189 HydrophobicContact CG1-CE2 3.57Å; I185-Y189 HydrophobicContact CG1-CG 4.39Å; I185-Y189 VanDerWaalsContact CG1-CZ 3.45Å; I185-Y189 WeakPolarHBondContact O-CB 3.43Å; I185-Y189 WeakPolarHBondContact O-CD2 3.26Å; I185-Y189 PolarHBondContact O-N 3.38Å |
| 186 | W | 95.8 | Very high | 96.3 | Very high | 164 Ų | 164 | 42.7 Ų | 42.7 | 62% | 0.621 | 24% | 0.237 | S | C | * | . | H | α-helix | trans | -69.4 | -39.2 | 179.6 | -63 | 106.6 | 0 | 0 | 0 | 111.8 | Y131 N184 Y189 A190 | Y131-W186 HydrophobicContact CD2-CH2 4.02Å; Y131-W186 HydrophobicContact CE2-CH2 4.09Å; Y131-W186 HydrophobicContact CE2-CZ2 4.37Å; N184-W186 VanDerWaalsContact C-N 3.32Å; N184-W186 PolarHBondContact O-N 3.42Å; N184-W186 WeakPolarHBondContact OD1-CB 3.39Å; N184-W186 PolarHBondContact OD1-N 3.25Å; W186-Y189 HydrophobicContact CE3-CD2 4.32Å; W186-Y189 PolarHBondContact O-N 3.03Å; W186-A190 VanDerWaalsContact O-CB 3.3Å; W186-A190 WeakPolarHBondContact O-CB 3.28Å; W186-A190 PolarHBondContact O-N 3.27Å |
| 187 | V | 97.3 | Very high | 96.2 | Very high | 51 Ų | 51 | 44.8 Ų | 44.8 | 31% | 0.309 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -67.5 | -40.7 | 173.6 | 179.6 | 0 | 0 | 0 | 0 | 110.2 | I178 V182 N184 A190 S191 | I178-V187 HydrophobicContact CG2-CG1 3.59Å; V182-V187 HydrophobicContact CB-CB 4.34Å; V182-V187 HydrophobicContact CB-CG1 3.95Å; V182-V187 HydrophobicContact CG1-CB 3.94Å; V182-V187 HydrophobicContact CG1-CG1 3.87Å; V182-V187 HydrophobicContact CG1-CG2 4Å; V182-V187 HydrophobicContact CG2-CG1 4Å; N184-V187 HydrophobicContact CB-CB 4.29Å; N184-V187 HydrophobicContact CB-CG2 4.12Å; N184-V187 PolarHBondContact O-N 3.09Å; N184-V187 PolarHBondContact OD1-N 3.02Å; V187-A190 PolarHBondContact O-N 3.35Å; V187-S191 VanDerWaalsContact O-CB 3.31Å; V187-S191 WeakPolarHBondContact O-CB 3.2Å; V187-S191 PolarHBondContact O-N 3.34Å; V187-S191 PolarHBondContact O-OG 3.4Å; V187-S191 VanDerWaalsContact O-OG 3.07Å |
| 188 | C | 96.5 | Very high | 96.2 | Very high | 2 Ų | 2 | 40 Ų | 40 | 1% | 0.014 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -60.4 | -47.1 | 174.9 | -168.7 | 0 | 0 | 0 | 0 | 111.9 | W119 M179 N184 I185 S191 Y192 | W119-C188 PolarHBondContact NE1-SG 3.38Å; M179-C188 PolarHBondContact O-SG 3.35Å; N184-C188 WeakPolarHBondContact O-CB 3.3Å; N184-C188 PolarHBondContact O-N 3.34Å; I185-C188 WeakPolarHBondContact O-CB 3.47Å; I185-C188 PolarHBondContact O-N 2.82Å; C188-S191 PolarHBondContact O-N 3.29Å; C188-Y192 WeakPolarHBondContact O-CB 3.31Å; C188-Y192 PolarHBondContact O-N 3.46Å |
| 189 | Y | 97.7 | Very high | 96.1 | Very high | 8 Ų | 8 | 37.5 Ų | 37.5 | 3% | 0.031 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -62 | -46.9 | 175.6 | -70.8 | -21.3 | 0 | 0 | 0 | 112.6 | W119 Y131 N132 V135 I185 W186 S191 Y192 V193 | W119-Y189 AromaticContact CD1-CE1 3.99Å; W119-Y189 HydrophobicContact CD2-CD1 4.06Å; W119-Y189 AromaticContact CD2-CE1 3.59Å; W119-Y189 HydrophobicContact CD2-CE1 3.59Å; W119-Y189 AromaticContact CE2-CD1 3.53Å; W119-Y189 AromaticContact CE2-CE1 3.59Å; W119-Y189 HydrophobicContact CE3-CE1 4.06Å; W119-Y189 HydrophobicContact CG-CD1 4.38Å; W119-Y189 AromaticContact CG-CE1 3.84Å; W119-Y189 HydrophobicContact CG-CE1 3.84Å; W119-Y189 HydrophobicContact CH2-CD1 4.42Å; W119-Y189 HydrophobicContact CH2-CE1 4.41Å; W119-Y189 AromaticContact CZ2-CD1 3.75Å; W119-Y189 HydrophobicContact CZ2-CD1 3.75Å; W119-Y189 HydrophobicContact CZ2-CE1 4.03Å; W119-Y189 HydrophobicContact CZ3-CE1 4.42Å; W119-Y189 AromaticContact NE1-CD1 3.63Å; W119-Y189 AromaticContact NE1-CE1 3.87Å; Y131-Y189 PolarHBondContact N-OH 3.12Å; N132-Y189 PolarHBondContact N-OH 3.21Å; N132-Y189 WeakPolarHBondContact OD1-CE1 3.45Å; N132-Y189 PolarHBondContact OD1-OH 3.45Å; V135-Y189 HydrophobicContact CB-CD1 4.36Å; V135-Y189 HydrophobicContact CB-CG 4.43Å; V135-Y189 HydrophobicContact CG1-CD1 4.14Å; V135-Y189 HydrophobicContact CG1-CG 4.23Å; V135-Y189 HydrophobicContact CG2-CD1 3.75Å; V135-Y189 HydrophobicContact CG2-CD2 3.57Å; V135-Y189 HydrophobicContact CG2-CE1 4.09Å; V135-Y189 HydrophobicContact CG2-CE2 3.94Å; V135-Y189 HydrophobicContact CG2-CG 3.46Å; V135-Y189 VanDerWaalsContact CG2-CG 3.46Å; I185-Y189 HydrophobicContact CD1-CD1 4.11Å; I185-Y189 HydrophobicContact CD1-CE1 3.59Å; I185-Y189 HydrophobicContact CD1-CE2 4.29Å; I185-Y189 HydrophobicContact CG1-CD1 4.28Å; I185-Y189 HydrophobicContact CG1-CD2 4.05Å; I185-Y189 HydrophobicContact CG1-CE1 3.83Å; I185-Y189 HydrophobicContact CG1-CE2 3.57Å; I185-Y189 HydrophobicContact CG1-CG 4.39Å; I185-Y189 VanDerWaalsContact CG1-CZ 3.45Å; I185-Y189 WeakPolarHBondContact O-CB 3.43Å; I185-Y189 WeakPolarHBondContact O-CD2 3.26Å; I185-Y189 PolarHBondContact O-N 3.38Å; W186-Y189 HydrophobicContact CE3-CD2 4.32Å; W186-Y189 PolarHBondContact O-N 3.03Å; Y189-S191 PolarHBondContact O-N 2.92Å; Y189-Y192 PolarHBondContact O-N 3.48Å; Y189-V193 VanDerWaalsContact O-CG2 3.29Å; Y189-V193 WeakPolarHBondContact O-CG2 3.35Å; Y189-V193 PolarHBondContact O-N 2.92Å |
| 190 | A | 98.2 | Very high | 95.8 | Very high | 55 Ų | 55 | 39.7 Ų | 39.7 | 46% | 0.455 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -61.4 | -46 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | W186 V187 Y192 V193 V194 | W186-A190 VanDerWaalsContact O-CB 3.3Å; W186-A190 WeakPolarHBondContact O-CB 3.28Å; W186-A190 PolarHBondContact O-N 3.27Å; V187-A190 PolarHBondContact O-N 3.35Å; A190-Y192 PolarHBondContact O-N 3.15Å; A190-V193 PolarHBondContact O-N 3.45Å; A190-V194 WeakPolarHBondContact O-CG2 3.39Å; A190-V194 PolarHBondContact O-N 3.42Å |
| 191 | S | 98.3 | Very high | 95.7 | Very high | 13 Ų | 13 | 39.8 Ų | 39.8 | 9% | 0.091 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -64.1 | -38.6 | 176.8 | -66.2 | 0 | 0 | 0 | 0 | 112.4 | I178 V187 C188 Y189 V194 F195 | I178-S191 WeakPolarHBondContact CG2-OG 3.13Å; V187-S191 VanDerWaalsContact O-CB 3.31Å; V187-S191 WeakPolarHBondContact O-CB 3.2Å; V187-S191 PolarHBondContact O-N 3.34Å; V187-S191 PolarHBondContact O-OG 3.4Å; V187-S191 VanDerWaalsContact O-OG 3.07Å; C188-S191 PolarHBondContact O-N 3.29Å; Y189-S191 PolarHBondContact O-N 2.92Å; S191-V194 PolarHBondContact O-N 3.41Å; S191-F195 WeakPolarHBondContact O-CB 3.37Å; S191-F195 PolarHBondContact O-N 2.89Å |
| 192 | Y | 98.4 | Very high | 95.8 | Very high | 0 Ų | 0 | 36.6 Ų | 36.6 | 0% | 0 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -61.3 | -43.6 | 172.8 | 179.1 | -106.2 | 0 | 0 | 0 | 112.4 | V112 T115 W119 V135 E136 M179 C188 Y189 A190 F195 R196 | V112-Y192 HydrophobicContact CG2-CE2 4.42Å; T115-Y192 HydrophobicContact CG2-CD2 4.36Å; T115-Y192 HydrophobicContact CG2-CE2 3.82Å; W119-Y192 AromaticContact CH2-CD1 3.8Å; W119-Y192 HydrophobicContact CH2-CD1 3.8Å; W119-Y192 AromaticContact CH2-CE1 3.74Å; W119-Y192 HydrophobicContact CH2-CE1 3.74Å; W119-Y192 HydrophobicContact CH2-CG 4.32Å; W119-Y192 AromaticContact CZ2-CD1 3.57Å; W119-Y192 HydrophobicContact CZ2-CD1 3.57Å; W119-Y192 HydrophobicContact CZ2-CD2 4.25Å; W119-Y192 AromaticContact CZ2-CE1 3.96Å; W119-Y192 HydrophobicContact CZ2-CE1 3.96Å; W119-Y192 AromaticContact CZ2-CG 3.68Å; W119-Y192 HydrophobicContact CZ2-CG 3.68Å; V135-Y192 HydrophobicContact CG1-CD1 3.85Å; V135-Y192 HydrophobicContact CG1-CE1 4.48Å; E136-Y192 VanDerWaalsContact CD-OH 3.29Å; E136-Y192 PolarHBondContact OE1-OH 3.38Å; E136-Y192 PolarHBondContact OE2-OH 2.94Å; M179-Y192 HydrophobicContact CE-CD2 3.68Å; M179-Y192 HydrophobicContact CE-CG 4.25Å; M179-Y192 HydrophobicContact SD-CD2 4.25Å; C188-Y192 WeakPolarHBondContact O-CB 3.31Å; C188-Y192 PolarHBondContact O-N 3.46Å; Y189-Y192 PolarHBondContact O-N 3.48Å; A190-Y192 PolarHBondContact O-N 3.15Å; Y192-F195 AromaticContact CD2-CD1 3.96Å; Y192-F195 HydrophobicContact CD2-CD1 3.96Å; Y192-F195 HydrophobicContact CD2-CE1 4.43Å; Y192-F195 HydrophobicContact CE2-CD1 4.17Å; Y192-F195 HydrophobicContact CE2-CE1 4.23Å; Y192-F195 WeakPolarHBondContact O-CB 3.31Å; Y192-F195 PolarHBondContact O-N 2.82Å; Y192-R196 HydrophobicContact CD1-CG 4.42Å; Y192-R196 HydrophobicContact CE1-CG 4.07Å; Y192-R196 HydrophobicContact CE2-CG 4.15Å; Y192-R196 VanDerWaalsContact CZ-CD 3.47Å; Y192-R196 WeakPolarHBondContact O-CG 3.38Å; Y192-R196 PolarHBondContact O-N 3.25Å; Y192-R196 WeakPolarHBondContact OH-CD 3.19Å |
| 193 | V | 98.4 | Very high | 95.9 | Very high | 21 Ų | 21 | 34 Ų | 34 | 13% | 0.127 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -61.3 | -45.8 | 176.2 | 170.7 | 0 | 0 | 0 | 0 | 110.6 | V135 V138 L142 Y189 A190 R196 I197 | V135-V193 HydrophobicContact CG1-CG2 3.81Å; V138-V193 HydrophobicContact CG1-CG1 4.49Å; L142-V193 HydrophobicContact CD1-CG1 3.88Å; Y189-V193 VanDerWaalsContact O-CG2 3.29Å; Y189-V193 WeakPolarHBondContact O-CG2 3.35Å; Y189-V193 PolarHBondContact O-N 2.92Å; A190-V193 PolarHBondContact O-N 3.45Å; V193-R196 PolarHBondContact O-N 2.9Å; V193-I197 HydrophobicContact CG1-CD1 3.69Å; V193-I197 HydrophobicContact CG1-CG1 4.43Å; V193-I197 VanDerWaalsContact O-CG1 3.26Å; V193-I197 WeakPolarHBondContact O-CG1 3.41Å; V193-I197 PolarHBondContact O-N 3.22Å |
| 194 | V | 98.4 | Very high | 95.9 | Very high | 70 Ų | 70 | 33.2 Ų | 33.2 | 42% | 0.424 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -59.1 | -48.9 | 175.7 | 170.1 | 0 | 0 | 0 | 0 | 111 | A175 A190 S191 R196 I197 I198 | A175-V194 HydrophobicContact CB-CG1 4.4Å; A190-V194 WeakPolarHBondContact O-CG2 3.39Å; A190-V194 PolarHBondContact O-N 3.42Å; S191-V194 PolarHBondContact O-N 3.41Å; V194-R196 PolarHBondContact O-N 3.3Å; V194-I197 PolarHBondContact O-N 2.9Å; V194-I198 HydrophobicContact CG1-CD1 3.65Å; V194-I198 HydrophobicContact CG1-CG1 4.4Å; V194-I198 VanDerWaalsContact O-CG1 3.31Å; V194-I198 WeakPolarHBondContact O-CG1 3.43Å; V194-I198 PolarHBondContact O-N 3.49Å |
| 195 | F | 98.4 | Very high | 95.8 | Very high | 0 Ų | 0 | 29.8 Ų | 29.8 | 0% | 0 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -52.8 | -50.5 | 174.9 | 154.5 | -106.5 | 0 | 0 | 0 | 111.8 | Y108 V111 V112 I172 A175 V176 S191 Y192 I197 I198 Y199 F262 | Y108-F195 AromaticContact CD2-CE1 3.95Å; Y108-F195 HydrophobicContact CD2-CE1 3.95Å; Y108-F195 HydrophobicContact CD2-CE2 4.32Å; Y108-F195 AromaticContact CD2-CZ 3.47Å; Y108-F195 HydrophobicContact CD2-CZ 3.47Å; Y108-F195 VanDerWaalsContact CD2-CZ 3.47Å; Y108-F195 HydrophobicContact CE2-CE1 4.19Å; Y108-F195 HydrophobicContact CE2-CZ 4.18Å; Y108-F195 HydrophobicContact CG-CZ 4.3Å; V111-F195 HydrophobicContact CB-CE1 3.94Å; V111-F195 HydrophobicContact CB-CE2 4.42Å; V111-F195 HydrophobicContact CB-CZ 3.7Å; V111-F195 HydrophobicContact CG1-CD1 3.92Å; V111-F195 HydrophobicContact CG1-CE1 3.43Å; V111-F195 VanDerWaalsContact CG1-CE1 3.43Å; V111-F195 HydrophobicContact CG1-CE2 4.39Å; V111-F195 HydrophobicContact CG1-CZ 3.69Å; V111-F195 HydrophobicContact CG2-CE2 4.43Å; V111-F195 HydrophobicContact CG2-CZ 4.18Å; V112-F195 HydrophobicContact CG2-CE1 4.24Å; I172-F195 HydrophobicContact CG1-CD2 4.35Å; I172-F195 HydrophobicContact CG2-CD2 3.76Å; I172-F195 HydrophobicContact CG2-CE2 3.98Å; A175-F195 HydrophobicContact CB-CB 4.05Å; V176-F195 HydrophobicContact CG2-CD2 3.95Å; V176-F195 HydrophobicContact CG2-CE2 4.31Å; V176-F195 HydrophobicContact CG2-CG 4.36Å; S191-F195 WeakPolarHBondContact O-CB 3.37Å; S191-F195 PolarHBondContact O-N 2.89Å; Y192-F195 AromaticContact CD2-CD1 3.96Å; Y192-F195 HydrophobicContact CD2-CD1 3.96Å; Y192-F195 HydrophobicContact CD2-CE1 4.43Å; Y192-F195 HydrophobicContact CE2-CD1 4.17Å; Y192-F195 HydrophobicContact CE2-CE1 4.23Å; Y192-F195 WeakPolarHBondContact O-CB 3.31Å; Y192-F195 PolarHBondContact O-N 2.82Å; F195-I197 PolarHBondContact O-N 3.31Å; F195-I198 PolarHBondContact O-N 2.93Å; F195-Y199 WeakPolarHBondContact O-CB 3.38Å; F195-Y199 PolarHBondContact O-N 2.91Å; F195-F262 HydrophobicContact CE2-CE2 4.41Å; F195-F262 HydrophobicContact CE2-CZ 4.45Å |
| 196 | R | 96.9 | Very high | 95.7 | Very high | 18 Ų | 18 | 29.1 Ų | 29.1 | 7% | 0.068 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -64.5 | -41.6 | -178.9 | -74.2 | -156.1 | 74.6 | -140.2 | 8.8 | 112.5 | Y108 E136 S139 T140 Y192 V193 V194 Y199 M200 | Y108-R196 HydrophobicContact CE2-CG 4.49Å; Y108-R196 PolarHBondContact OH-NE 3.49Å; Y108-R196 PolarHBondContact OH-NH2 3.03Å; Y108-R196 VanDerWaalsContact OH-NH2 3.14Å; E136-R196 IonicContact OE2-NH1 3.75Å; S139-R196 WeakPolarHBondContact OG-CD 3.49Å; S139-R196 PolarHBondContact OG-NH1 3.49Å; T140-R196 PolarHBondContact OG1-NH1 2.96Å; Y192-R196 HydrophobicContact CD1-CG 4.42Å; Y192-R196 HydrophobicContact CE1-CG 4.07Å; Y192-R196 HydrophobicContact CE2-CG 4.15Å; Y192-R196 VanDerWaalsContact CZ-CD 3.47Å; Y192-R196 WeakPolarHBondContact O-CG 3.38Å; Y192-R196 PolarHBondContact O-N 3.25Å; Y192-R196 WeakPolarHBondContact OH-CD 3.19Å; V193-R196 PolarHBondContact O-N 2.9Å; V194-R196 PolarHBondContact O-N 3.3Å; R196-Y199 PolarHBondContact O-N 3.39Å; R196-M200 VanDerWaalsContact NH2-CE 3.34Å; R196-M200 WeakPolarHBondContact O-CB 3.34Å; R196-M200 WeakPolarHBondContact O-CG 3.32Å; R196-M200 PolarHBondContact O-N 2.98Å |
| 197 | I | 96.1 | Very high | 95.5 | Very high | 45 Ų | 45 | 23.3 Ų | 23.3 | 23% | 0.231 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -62.3 | -48.2 | 178.1 | -68.5 | 164.8 | 0 | 0 | 0 | 110.5 | L142 A146 V193 V194 F195 Y199 M200 L201 | L142-I197 HydrophobicContact CB-CD1 3.54Å; L142-I197 HydrophobicContact CB-CG1 3.77Å; L142-I197 HydrophobicContact CD1-CD1 3.83Å; L142-I197 HydrophobicContact CG-CD1 4.33Å; A146-I197 HydrophobicContact CB-CG2 3.88Å; V193-I197 HydrophobicContact CG1-CD1 3.69Å; V193-I197 HydrophobicContact CG1-CG1 4.43Å; V193-I197 VanDerWaalsContact O-CG1 3.26Å; V193-I197 WeakPolarHBondContact O-CG1 3.41Å; V193-I197 PolarHBondContact O-N 3.22Å; V194-I197 PolarHBondContact O-N 2.9Å; F195-I197 PolarHBondContact O-N 3.31Å; I197-Y199 PolarHBondContact O-N 3.44Å; I197-M200 PolarHBondContact O-N 2.93Å; I197-L201 WeakPolarHBondContact O-CB 3.31Å; I197-L201 PolarHBondContact O-N 3.12Å |
| 198 | I | 97.4 | Very high | 95.1 | Very high | 17 Ų | 17 | 26.7 Ų | 26.7 | 9% | 0.087 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -63 | -45.5 | -179.6 | -65.2 | 169.2 | 0 | 0 | 0 | 110.6 | F168 L171 I172 V194 F195 L201 L202 | F168-I198 HydrophobicContact CB-CG2 3.79Å; F168-I198 HydrophobicContact CD1-CG1 4.32Å; F168-I198 HydrophobicContact CD1-CG2 3.59Å; F168-I198 HydrophobicContact CG-CG2 4.13Å; L171-I198 HydrophobicContact CB-CD1 3.76Å; L171-I198 HydrophobicContact CD1-CD1 4.47Å; I172-I198 HydrophobicContact CD1-CG2 3.84Å; I172-I198 HydrophobicContact CG1-CB 4.08Å; I172-I198 HydrophobicContact CG1-CG2 3.63Å; V194-I198 HydrophobicContact CG1-CD1 3.65Å; V194-I198 HydrophobicContact CG1-CG1 4.4Å; V194-I198 VanDerWaalsContact O-CG1 3.31Å; V194-I198 WeakPolarHBondContact O-CG1 3.43Å; V194-I198 PolarHBondContact O-N 3.49Å; F195-I198 PolarHBondContact O-N 2.93Å; I198-L201 PolarHBondContact O-N 2.94Å; I198-L202 HydrophobicContact CG2-CD1 4.31Å; I198-L202 HydrophobicContact CG2-CG 4.44Å; I198-L202 WeakPolarHBondContact O-CG 3.42Å; I198-L202 PolarHBondContact O-N 2.95Å |
| 199 | Y | 97.2 | Very high | 94.8 | Very high | 13 Ų | 13 | 27.6 Ų | 27.6 | 5% | 0.051 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -60 | -48 | 177.2 | 172.9 | -97.1 | 0 | 0 | 0 | 111.8 | T105 Y108 F195 R196 I197 L201 L202 I203 | T105-Y199 PolarHBondContact OG1-OH 3.48Å; Y108-Y199 VanDerWaalsContact CB-CE2 3.41Å; Y108-Y199 HydrophobicContact CD1-CD1 4.34Å; Y108-Y199 AromaticContact CD1-CE1 3.68Å; Y108-Y199 HydrophobicContact CD1-CE1 3.68Å; Y108-Y199 AromaticContact CD1-CZ 3.76Å; Y108-Y199 AromaticContact CD2-CD1 3.16Å; Y108-Y199 HydrophobicContact CD2-CD1 3.16Å; Y108-Y199 AromaticContact CD2-CD2 3.9Å; Y108-Y199 HydrophobicContact CD2-CD2 3.9Å; Y108-Y199 AromaticContact CD2-CE1 3.38Å; Y108-Y199 HydrophobicContact CD2-CE1 3.38Å; Y108-Y199 HydrophobicContact CD2-CE2 4.09Å; Y108-Y199 AromaticContact CD2-CG 3.43Å; Y108-Y199 HydrophobicContact CD2-CG 3.43Å; Y108-Y199 VanDerWaalsContact CD2-CG 3.43Å; Y108-Y199 AromaticContact CD2-CZ 3.83Å; Y108-Y199 HydrophobicContact CE1-CD1 4.49Å; Y108-Y199 AromaticContact CE1-CE1 3.91Å; Y108-Y199 HydrophobicContact CE1-CE1 3.91Å; Y108-Y199 AromaticContact CE2-CD1 3.35Å; Y108-Y199 HydrophobicContact CE2-CD1 3.35Å; Y108-Y199 AromaticContact CE2-CE1 3.62Å; Y108-Y199 HydrophobicContact CE2-CE1 3.62Å; Y108-Y199 HydrophobicContact CE2-CG 4.02Å; Y108-Y199 AromaticContact CG-CD1 3.72Å; Y108-Y199 HydrophobicContact CG-CD1 3.72Å; Y108-Y199 HydrophobicContact CG-CD2 4.04Å; Y108-Y199 AromaticContact CG-CE1 3.41Å; Y108-Y199 HydrophobicContact CG-CE1 3.41Å; Y108-Y199 VanDerWaalsContact CG-CE1 3.41Å; Y108-Y199 AromaticContact CG-CE2 3.77Å; Y108-Y199 HydrophobicContact CG-CE2 3.77Å; Y108-Y199 HydrophobicContact CG-CG 4Å; Y108-Y199 AromaticContact CG-CZ 3.42Å; Y108-Y199 VanDerWaalsContact CG-CZ 3.42Å; Y108-Y199 AromaticContact CZ-CE1 3.88Å; F195-Y199 WeakPolarHBondContact O-CB 3.38Å; F195-Y199 PolarHBondContact O-N 2.91Å; R196-Y199 PolarHBondContact O-N 3.39Å; I197-Y199 PolarHBondContact O-N 3.44Å; Y199-L201 VanDerWaalsContact C-N 3.34Å; Y199-L201 PolarHBondContact O-N 3.12Å; Y199-L202 PolarHBondContact O-N 2.96Å; Y199-I203 HydrophobicContact CD1-CG2 4.5Å; Y199-I203 HydrophobicContact CE1-CB 4.37Å; Y199-I203 HydrophobicContact CE1-CG2 4.18Å; Y199-I203 HydrophobicContact CE2-CB 4.45Å; Y199-I203 HydrophobicContact CE2-CD1 4.37Å; Y199-I203 WeakPolarHBondContact O-CB 3.29Å; Y199-I203 WeakPolarHBondContact O-CG2 3.48Å; Y199-I203 PolarHBondContact O-N 3.12Å |
| 200 | M | 91.3 | Very high | 94.4 | Very high | 47 Ų | 47 | 27.2 Ų | 27.2 | 23% | 0.232 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -62.2 | -40.1 | 179.9 | -72.5 | -62.9 | 179.9 | 0 | 0 | 112.2 | V147 R196 I197 I203 T204 | V147-M200 HydrophobicContact CG2-CB 4.21Å; R196-M200 VanDerWaalsContact NH2-CE 3.34Å; R196-M200 WeakPolarHBondContact O-CB 3.34Å; R196-M200 WeakPolarHBondContact O-CG 3.32Å; R196-M200 PolarHBondContact O-N 2.98Å; I197-M200 PolarHBondContact O-N 2.93Å; M200-I203 WeakPolarHBondContact O-CG2 3.41Å; M200-I203 HydrophobicContact SD-CG2 4.45Å; M200-T204 WeakPolarHBondContact O-CB 3.48Å; M200-T204 PolarHBondContact O-N 2.95Å; M200-T204 PolarHBondContact O-OG1 2.94Å; M200-T204 VanDerWaalsContact O-OG1 3.11Å |
| 201 | L | 90.4 | Very high | 93.8 | Very high | 26 Ų | 26 | 26.2 Ų | 26.2 | 14% | 0.136 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -60.1 | -52.6 | 174 | -175.3 | 100.7 | 0 | 0 | 0 | 111.2 | A146 V150 I153 F168 I197 I198 Y199 T204 I205 | A146-L201 HydrophobicContact CB-CB 4.5Å; A146-L201 HydrophobicContact CB-CD1 4.13Å; V150-L201 HydrophobicContact CG2-CD1 3.67Å; V150-L201 HydrophobicContact CG2-CG 4.05Å; I153-L201 HydrophobicContact CD1-CD1 4.49Å; F168-L201 HydrophobicContact CE1-CD2 4.37Å; F168-L201 HydrophobicContact CZ-CD2 4.31Å; I197-L201 WeakPolarHBondContact O-CB 3.31Å; I197-L201 PolarHBondContact O-N 3.12Å; I198-L201 PolarHBondContact O-N 2.94Å; Y199-L201 VanDerWaalsContact C-N 3.34Å; Y199-L201 PolarHBondContact O-N 3.12Å; L201-T204 PolarHBondContact O-N 3.1Å; L201-I205 HydrophobicContact CD2-CD1 4.08Å; L201-I205 HydrophobicContact CG-CD1 3.99Å; L201-I205 WeakPolarHBondContact O-CG1 3.29Å; L201-I205 PolarHBondContact O-N 2.87Å |
| 202 | L | 95.4 | Very high | 93.1 | Very high | 0 Ų | 0 | 28.7 Ų | 28.7 | 0% | 0 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -68.7 | -39.3 | -175.8 | -72.2 | -175.7 | 0 | 0 | 0 | 113.1 | W100 T164 L165 F168 I172 I198 Y199 T204 I205 A206 | W100-L202 HydrophobicContact CH2-CB 3.21Å; W100-L202 HydrophobicContact CH2-CD1 3.68Å; W100-L202 HydrophobicContact CH2-CG 4.15Å; W100-L202 HydrophobicContact CZ2-CB 3.68Å; W100-L202 HydrophobicContact CZ2-CD1 3.18Å; W100-L202 HydrophobicContact CZ2-CG 4.12Å; W100-L202 HydrophobicContact CZ3-CB 3.88Å; T164-L202 HydrophobicContact CG2-CD2 4.3Å; L165-L202 HydrophobicContact CD2-CD2 4.44Å; F168-L202 HydrophobicContact CB-CD1 3.49Å; F168-L202 VanDerWaalsContact CB-CD1 3.49Å; F168-L202 HydrophobicContact CB-CD2 3.89Å; F168-L202 HydrophobicContact CB-CG 3.91Å; F168-L202 HydrophobicContact CD2-CD2 4.08Å; F168-L202 HydrophobicContact CG-CD1 4.49Å; F168-L202 HydrophobicContact CG-CD2 4.13Å; F168-L202 HydrophobicContact CG-CG 4.42Å; I172-L202 HydrophobicContact CD1-CD1 4.25Å; I198-L202 HydrophobicContact CG2-CD1 4.31Å; I198-L202 HydrophobicContact CG2-CG 4.44Å; I198-L202 WeakPolarHBondContact O-CG 3.42Å; I198-L202 PolarHBondContact O-N 2.95Å; Y199-L202 PolarHBondContact O-N 2.96Å; L202-T204 VanDerWaalsContact C-N 3.27Å; L202-T204 PolarHBondContact O-N 3.14Å; L202-I205 PolarHBondContact O-N 3.37Å; L202-A206 WeakPolarHBondContact O-CB 3.39Å; L202-A206 PolarHBondContact O-N 2.86Å |
| 203 | I | 93.9 | Very high | 92.3 | Very high | 21 Ų | 21 | 32.8 Ų | 32.8 | 11% | 0.108 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -65 | -35.2 | 178.8 | -160.7 | 71 | 0 | 0 | 0 | 110.8 | W100 W101 Y199 M200 T207 | W100-I203 HydrophobicContact CZ3-CD1 4.22Å; W101-I203 HydrophobicContact CB-CD1 4.48Å; W101-I203 HydrophobicContact CD2-CD1 3.99Å; W101-I203 HydrophobicContact CG-CD1 3.69Å; W101-I203 VanDerWaalsContact NE1-CD1 3.35Å; Y199-I203 HydrophobicContact CD1-CG2 4.5Å; Y199-I203 HydrophobicContact CE1-CB 4.37Å; Y199-I203 HydrophobicContact CE1-CG2 4.18Å; Y199-I203 HydrophobicContact CE2-CB 4.45Å; Y199-I203 HydrophobicContact CE2-CD1 4.37Å; Y199-I203 WeakPolarHBondContact O-CB 3.29Å; Y199-I203 WeakPolarHBondContact O-CG2 3.48Å; Y199-I203 PolarHBondContact O-N 3.12Å; M200-I203 WeakPolarHBondContact O-CG2 3.41Å; M200-I203 HydrophobicContact SD-CG2 4.45Å; I203-T207 WeakPolarHBondContact O-CB 3.46Å; I203-T207 PolarHBondContact O-N 2.86Å; I203-T207 PolarHBondContact O-OG1 3Å |
| 204 | T | 90.3 | Very high | 91.4 | Very high | 39 Ų | 39 | 33 Ų | 33 | 24% | 0.239 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -65.4 | -46.7 | 172.1 | -67.8 | 0 | 0 | 0 | 0 | 111.6 | V147 V150 M200 L201 L202 A206 T207 F208 | V147-T204 HydrophobicContact CG1-CG2 3.96Å; V147-T204 VanDerWaalsContact CG2-OG1 3.32Å; V147-T204 WeakPolarHBondContact CG2-OG1 3.21Å; V150-T204 HydrophobicContact CB-CG2 4.22Å; V150-T204 HydrophobicContact CG1-CG2 4.19Å; V150-T204 HydrophobicContact CG2-CG2 4.17Å; M200-T204 WeakPolarHBondContact O-CB 3.48Å; M200-T204 PolarHBondContact O-N 2.95Å; M200-T204 PolarHBondContact O-OG1 2.94Å; M200-T204 VanDerWaalsContact O-OG1 3.11Å; L201-T204 PolarHBondContact O-N 3.1Å; L202-T204 VanDerWaalsContact C-N 3.27Å; L202-T204 PolarHBondContact O-N 3.14Å; T204-A206 PolarHBondContact O-N 3.28Å; T204-T207 PolarHBondContact O-N 2.91Å; T204-F208 WeakPolarHBondContact O-CB 3.21Å; T204-F208 PolarHBondContact O-N 3.29Å |
| 205 | I | 90.6 | Very high | 90.3 | Very high | 2 Ų | 2 | 32.2 Ų | 32.2 | 1% | 0.01 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -60.2 | -47.9 | 176.7 | -66.9 | 159.7 | 0 | 0 | 0 | 110.3 | W97 V150 W157 L201 L202 T207 F208 Q209 | W97-I205 HydrophobicContact CH2-CG2 3.61Å; W97-I205 HydrophobicContact CZ2-CG2 4.46Å; W97-I205 HydrophobicContact CZ3-CG2 3.79Å; V150-I205 HydrophobicContact CG1-CG1 3.64Å; V150-I205 HydrophobicContact CG2-CD1 4.38Å; V150-I205 HydrophobicContact CG2-CG1 4.02Å; W157-I205 HydrophobicContact CD2-CG2 4.08Å; W157-I205 HydrophobicContact CE3-CG2 3.86Å; W157-I205 HydrophobicContact CH2-CD1 3.58Å; W157-I205 HydrophobicContact CH2-CG1 4.04Å; W157-I205 HydrophobicContact CH2-CG2 3.72Å; W157-I205 HydrophobicContact CZ2-CD1 4.15Å; W157-I205 HydrophobicContact CZ2-CG1 4.18Å; W157-I205 HydrophobicContact CZ2-CG2 3.92Å; W157-I205 HydrophobicContact CZ3-CD1 4.27Å; W157-I205 HydrophobicContact CZ3-CG2 3.68Å; L201-I205 HydrophobicContact CD2-CD1 4.08Å; L201-I205 HydrophobicContact CG-CD1 3.99Å; L201-I205 WeakPolarHBondContact O-CG1 3.29Å; L201-I205 PolarHBondContact O-N 2.87Å; L202-I205 PolarHBondContact O-N 3.37Å; I205-T207 PolarHBondContact O-N 2.81Å; I205-F208 PolarHBondContact O-N 2.9Å; I205-Q209 HydrophobicContact CG2-CG 4.24Å; I205-Q209 WeakPolarHBondContact O-CB 3.2Å; I205-Q209 VanDerWaalsContact O-CG 3.28Å; I205-Q209 WeakPolarHBondContact O-CG 3.34Å; I205-Q209 PolarHBondContact O-N 2.95Å |
| 206 | A | 93.9 | Very high | 88.9 | Confident | 0 Ų | 0 | 40.2 Ų | 40.2 | 0% | 0 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -61.1 | -44.9 | 179.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | W97 W100 W101 L202 T204 Q209 I210 | W97-A206 HydrophobicContact CE3-CB 3.73Å; W97-A206 HydrophobicContact CZ3-CB 4.24Å; W100-A206 HydrophobicContact CE3-CB 3.84Å; W100-A206 HydrophobicContact CZ3-CB 3.92Å; W101-A206 HydrophobicContact CB-CB 4.45Å; L202-A206 WeakPolarHBondContact O-CB 3.39Å; L202-A206 PolarHBondContact O-N 2.86Å; T204-A206 PolarHBondContact O-N 3.28Å; A206-Q209 PolarHBondContact O-N 3Å; A206-I210 WeakPolarHBondContact O-CB 3.49Å; A206-I210 WeakPolarHBondContact O-CD1 3.32Å; A206-I210 WeakPolarHBondContact O-CG1 3.45Å; A206-I210 PolarHBondContact O-N 2.68Å |
| 207 | T | 90.7 | Very high | 87.6 | Confident | 42 Ų | 42 | 44.2 Ų | 44.2 | 26% | 0.258 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -60 | -47.4 | 176 | -61.6 | 0 | 0 | 0 | 0 | 111 | W101 I203 T204 I205 Q209 I210 A211 F223 | W101-T207 PolarHBondContact NE1-OG1 2.72Å; I203-T207 WeakPolarHBondContact O-CB 3.46Å; I203-T207 PolarHBondContact O-N 2.86Å; I203-T207 PolarHBondContact O-OG1 3Å; T204-T207 PolarHBondContact O-N 2.91Å; I205-T207 PolarHBondContact O-N 2.81Å; T207-Q209 PolarHBondContact O-N 3.22Å; T207-I210 PolarHBondContact O-N 2.93Å; T207-A211 VanDerWaalsContact O-CB 3.25Å; T207-A211 WeakPolarHBondContact O-CB 3.3Å; T207-A211 PolarHBondContact O-N 3.02Å; T207-F223 HydrophobicContact CG2-CE1 3.75Å; T207-F223 HydrophobicContact CG2-CZ 3.64Å |
| 208 | F | 88.3 | Confident | 86.5 | Confident | 121 Ų | 121 | 44.5 Ų | 44.5 | 53% | 0.531 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -61 | -44.9 | 176.7 | 173.6 | -98.5 | 0 | 0 | 0 | 112.1 | T204 I205 A211 A212 | T204-F208 WeakPolarHBondContact O-CB 3.21Å; T204-F208 PolarHBondContact O-N 3.29Å; I205-F208 PolarHBondContact O-N 2.9Å; F208-A211 PolarHBondContact O-N 3.13Å; F208-A212 VanDerWaalsContact O-CB 3.24Å; F208-A212 WeakPolarHBondContact O-CB 3.41Å; F208-A212 PolarHBondContact O-N 3.41Å |
| 209 | Q | 90.5 | Very high | 85.5 | Confident | 21 Ų | 21 | 48.4 Ų | 48.4 | 10% | 0.098 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -66.7 | -39.2 | 179.5 | -72.2 | -61.1 | -47.1 | 0 | 0 | 112.2 | W97 W157 I205 A206 T207 N213 | W97-Q209 HydrophobicContact CD2-CB 3.88Å; W97-Q209 HydrophobicContact CD2-CG 4.19Å; W97-Q209 HydrophobicContact CG-CB 3.91Å; W97-Q209 HydrophobicContact CH2-CG 4.35Å; W97-Q209 HydrophobicContact CZ2-CB 4.43Å; W97-Q209 HydrophobicContact CZ2-CG 3.83Å; W157-Q209 HydrophobicContact CB-CG 4.25Å; W157-Q209 HydrophobicContact CG-CG 4.27Å; W157-Q209 VanDerWaalsContact CG-NE2 3.28Å; I205-Q209 HydrophobicContact CG2-CG 4.24Å; I205-Q209 WeakPolarHBondContact O-CB 3.2Å; I205-Q209 VanDerWaalsContact O-CG 3.28Å; I205-Q209 WeakPolarHBondContact O-CG 3.34Å; I205-Q209 PolarHBondContact O-N 2.95Å; A206-Q209 PolarHBondContact O-N 3Å; T207-Q209 PolarHBondContact O-N 3.22Å; Q209-N213 PolarHBondContact O-N 2.98Å; Q209-N213 PolarHBondContact O-ND2 2.99Å |
| 210 | I | 90.3 | Very high | 84.6 | Confident | 0 Ų | 0 | 48.3 Ų | 48.3 | 0% | 0 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -64.7 | -47.8 | 174.2 | -68 | 162.8 | 0 | 0 | 0 | 109.7 | W97 W101 A206 T207 A212 N213 L214 V222 F223 | W97-I210 HydrophobicContact CB-CD1 4.26Å; W97-I210 HydrophobicContact CB-CG1 3.81Å; W101-I210 HydrophobicContact CB-CD1 4.23Å; W101-I210 HydrophobicContact CG-CD1 4.33Å; A206-I210 WeakPolarHBondContact O-CB 3.49Å; A206-I210 WeakPolarHBondContact O-CD1 3.32Å; A206-I210 WeakPolarHBondContact O-CG1 3.45Å; A206-I210 PolarHBondContact O-N 2.68Å; T207-I210 PolarHBondContact O-N 2.93Å; I210-A212 PolarHBondContact O-N 2.86Å; I210-N213 PolarHBondContact O-N 3.45Å; I210-L214 HydrophobicContact CG2-CD1 3.57Å; I210-L214 WeakPolarHBondContact O-CD1 3.3Å; I210-L214 VanDerWaalsContact O-CG 3.29Å; I210-L214 WeakPolarHBondContact O-CG 3.42Å; I210-L214 PolarHBondContact O-N 2.88Å; I210-V222 HydrophobicContact CG2-CG1 3.66Å; I210-F223 HydrophobicContact CB-CE2 4.46Å; I210-F223 HydrophobicContact CB-CZ 4.13Å; I210-F223 HydrophobicContact CG2-CE2 3.82Å; I210-F223 HydrophobicContact CG2-CZ 3.92Å |
| 211 | A | 85.6 | Confident | 84.2 | Confident | 34 Ų | 34 | 47.1 Ų | 47.1 | 28% | 0.281 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -61.2 | -45.9 | -179.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | T207 F208 N213 L214 Y219 | T207-A211 VanDerWaalsContact O-CB 3.25Å; T207-A211 WeakPolarHBondContact O-CB 3.3Å; T207-A211 PolarHBondContact O-N 3.02Å; F208-A211 PolarHBondContact O-N 3.13Å; A211-N213 PolarHBondContact O-N 3.28Å; A211-L214 PolarHBondContact O-N 3.42Å; A211-Y219 HydrophobicContact CB-CD2 4.18Å; A211-Y219 HydrophobicContact CB-CE2 3.73Å |
| 212 | A | 83.9 | Confident | 84 | Confident | 65 Ų | 65 | 46 Ų | 46 | 54% | 0.537 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -67.5 | -19.3 | -177.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | F208 I210 | F208-A212 VanDerWaalsContact O-CB 3.24Å; F208-A212 WeakPolarHBondContact O-CB 3.41Å; F208-A212 PolarHBondContact O-N 3.41Å; I210-A212 PolarHBondContact O-N 2.86Å |
| 213 | N | 80.6 | Confident | 83.6 | Confident | 87 Ų | 87 | 47.2 Ų | 47.2 | 47% | 0.465 | 25% | 0.25 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -104.9 | 6.5 | -179.3 | -69.9 | -65.8 | 0 | 0 | 0 | 113.2 | L94 Q209 I210 A211 | L94-N213 HydrophobicContact CD1-CB 4.39Å; Q209-N213 PolarHBondContact O-N 2.98Å; Q209-N213 PolarHBondContact O-ND2 2.99Å; I210-N213 PolarHBondContact O-N 3.45Å; A211-N213 PolarHBondContact O-N 3.28Å |
| 214 | L | 80 | Confident | 83.2 | Confident | 26 Ų | 26 | 46.2 Ų | 46.2 | 14% | 0.136 | 25% | 0.245 | C | C | . | . | S | Bend | trans | -114 | 149.2 | 178.8 | -75.4 | 172.6 | 0 | 0 | 0 | 111.7 | C88 L94 I210 A211 R218 V222 | C88-L214 HydrophobicContact CB-CD2 4.12Å; C88-L214 WeakPolarHBondContact SG-CD2 3.29Å; L94-L214 HydrophobicContact CD1-CD2 3.58Å; L94-L214 HydrophobicContact CD1-CG 3.85Å; I210-L214 HydrophobicContact CG2-CD1 3.57Å; I210-L214 WeakPolarHBondContact O-CD1 3.3Å; I210-L214 VanDerWaalsContact O-CG 3.29Å; I210-L214 WeakPolarHBondContact O-CG 3.42Å; I210-L214 PolarHBondContact O-N 2.88Å; A211-L214 PolarHBondContact O-N 3.42Å; L214-R218 HydrophobicContact CD2-CB 4.18Å; L214-V222 HydrophobicContact CD1-CB 3.64Å; L214-V222 HydrophobicContact CD1-CG1 3.94Å; L214-V222 HydrophobicContact CD1-CG2 3.66Å; L214-V222 HydrophobicContact CD2-CG2 3.92Å; L214-V222 HydrophobicContact CG-CG2 4.46Å |
| 215 | S | 75.2 | Confident | 83.1 | Confident | 52 Ų | 52 | 45.2 Ų | 45.2 | 36% | 0.364 | 24% | 0.239 | S | C | . | . | trans | -70.9 | 150.6 | 162.1 | 58.4 | 0 | 0 | 0 | 0 | 109.8 | E217 R218 Y219 | S215-E217 PolarHBondContact O-N 2.85Å; S215-R218 PolarHBondContact O-N 3.32Å; S215-R218 WeakPolarHBondContact OG-CD 3.31Å; S215-R218 WeakPolarHBondContact OG-CG 3.13Å; S215-Y219 PolarHBondContact O-N 3.41Å | ||
| 216 | M | 69.6 | Low | 83.2 | Confident | 168 Ų | 168 | 45.1 Ų | 45.1 | 83% | 0.828 | 24% | 0.239 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -53 | -30.1 | 178.6 | -66.4 | -66.4 | -92.9 | 0 | 0 | 112.2 | R218 | M216-R218 VanDerWaalsContact C-N 3.34Å; M216-R218 PolarHBondContact O-N 3.4Å |
| 217 | E | 69 | Low | 83 | Confident | 103 Ų | 103 | 47 Ų | 47 | 48% | 0.481 | 25% | 0.25 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -72.9 | -24.1 | -178.8 | -63.5 | 174.2 | 178.1 | 0 | 0 | 114.4 | P51 S215 | P51-E217 HydrophobicContact CB-CB 4.17Å; P51-E217 HydrophobicContact CB-CG 4.48Å; P51-E217 WeakPolarHBondContact CB-O 3.41Å; P51-E217 WeakPolarHBondContact CG-O 3.17Å; S215-E217 PolarHBondContact O-N 2.85Å |
| 218 | R | 72.1 | Confident | 83 | Confident | 51 Ų | 51 | 48.9 Ų | 48.9 | 19% | 0.192 | 26% | 0.255 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -105.8 | -7.6 | -173.1 | -63.3 | 174.3 | -178.8 | 171.1 | -8.5 | 113.1 | D84 M87 C88 L214 S215 M216 A220 L221 V222 | D84-R218 HydrophobicContact CB-CG 4.25Å; D84-R218 IonicContact OD1-CZ 3.16Å; D84-R218 IonicContact OD1-NE 2.97Å; D84-R218 PolarHBondContact OD1-NE 3.28Å; D84-R218 IonicContact OD1-NH2 2.73Å; D84-R218 PolarHBondContact OD1-NH2 3.25Å; M87-R218 VanDerWaalsContact SD-CZ 3.59Å; M87-R218 PolarHBondContact SD-NH1 3.29Å; M87-R218 PolarHBondContact SD-NH2 3.46Å; C88-R218 VanDerWaalsContact SG-CD 3.57Å; L214-R218 HydrophobicContact CD2-CB 4.18Å; S215-R218 PolarHBondContact O-N 3.32Å; S215-R218 WeakPolarHBondContact OG-CD 3.31Å; S215-R218 WeakPolarHBondContact OG-CG 3.13Å; M216-R218 VanDerWaalsContact C-N 3.34Å; M216-R218 PolarHBondContact O-N 3.4Å; R218-A220 PolarHBondContact O-N 3.09Å; R218-L221 PolarHBondContact O-N 3.15Å; R218-V222 PolarHBondContact O-N 2.89Å; R218-V222 VanDerWaalsContact O-N 3.17Å |
| 219 | Y | 77.6 | Confident | 83.3 | Confident | 98 Ų | 98 | 46.5 Ų | 46.5 | 38% | 0.384 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -53.4 | -55.4 | 178.7 | -179.5 | -87.7 | 0 | 0 | 0 | 111.9 | A211 S215 L221 V222 F223 | A211-Y219 HydrophobicContact CB-CD2 4.18Å; A211-Y219 HydrophobicContact CB-CE2 3.73Å; S215-Y219 PolarHBondContact O-N 3.41Å; Y219-L221 VanDerWaalsContact C-N 3.28Å; Y219-L221 PolarHBondContact O-N 3.43Å; Y219-V222 PolarHBondContact O-N 3.41Å; Y219-F223 AromaticContact CD1-CD2 3.95Å; Y219-F223 HydrophobicContact CD1-CD2 3.95Å; Y219-F223 HydrophobicContact CD1-CE2 4.45Å; Y219-F223 AromaticContact CD2-CD2 3.86Å; Y219-F223 HydrophobicContact CD2-CD2 3.86Å; Y219-F223 AromaticContact CD2-CE2 3.59Å; Y219-F223 HydrophobicContact CD2-CE2 3.59Å; Y219-F223 AromaticContact CE1-CD2 3.66Å; Y219-F223 HydrophobicContact CE1-CD2 3.66Å; Y219-F223 HydrophobicContact CE1-CE2 4.05Å; Y219-F223 HydrophobicContact CE1-CG 4.41Å; Y219-F223 AromaticContact CE2-CD2 3.6Å; Y219-F223 HydrophobicContact CE2-CD2 3.6Å; Y219-F223 AromaticContact CE2-CE2 3.11Å; Y219-F223 HydrophobicContact CE2-CE2 3.11Å; Y219-F223 HydrophobicContact CE2-CZ 4Å; Y219-F223 HydrophobicContact CG-CD2 4.03Å; Y219-F223 HydrophobicContact CG-CE2 4.23Å; Y219-F223 AromaticContact CZ-CD2 3.47Å; Y219-F223 VanDerWaalsContact CZ-CD2 3.47Å; Y219-F223 AromaticContact CZ-CE2 3.35Å; Y219-F223 WeakPolarHBondContact O-CD2 3.27Å; Y219-F223 PolarHBondContact O-N 3.15Å; Y219-F223 VanDerWaalsContact O-N 3.09Å |
| 220 | A | 78.2 | Confident | 83.5 | Confident | 12 Ų | 12 | 45.6 Ų | 45.6 | 10% | 0.099 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -63.4 | -34.7 | -176.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | R47 P51 R218 G224 | R47-A220 HydrophobicContact CB-CB 4.18Å; R47-A220 WeakPolarHBondContact O-CB 3.31Å; P51-A220 HydrophobicContact CG-CB 4.23Å; R218-A220 PolarHBondContact O-N 3.09Å; A220-G224 PolarHBondContact O-N 2.85Å |
| 221 | L | 82 | Confident | 83.7 | Confident | 22 Ų | 22 | 48.6 Ų | 48.6 | 12% | 0.115 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -65 | -48.4 | 177.4 | -179.4 | 62.6 | 0 | 0 | 0 | 111.2 | L46 L81 D84 F85 R218 Y219 G224 V225 | L46-L221 HydrophobicContact CD2-CD1 3.89Å; L81-L221 HydrophobicContact CD2-CD1 4.42Å; L81-L221 HydrophobicContact CD2-CD2 4.35Å; D84-L221 HydrophobicContact CB-CD2 4.18Å; F85-L221 HydrophobicContact CB-CD2 4.27Å; R218-L221 PolarHBondContact O-N 3.15Å; Y219-L221 VanDerWaalsContact C-N 3.28Å; Y219-L221 PolarHBondContact O-N 3.43Å; L221-G224 PolarHBondContact O-N 2.9Å; L221-V225 HydrophobicContact CD1-CG2 4.4Å; L221-V225 VanDerWaalsContact O-CG2 3.31Å; L221-V225 WeakPolarHBondContact O-CG2 3.37Å; L221-V225 PolarHBondContact O-N 2.94Å |
| 222 | V | 85.7 | Confident | 84.2 | Confident | 1 Ų | 1 | 49.1 Ų | 49.1 | 1% | 0.006 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -66.7 | -46.5 | -177.9 | 173.3 | 0 | 0 | 0 | 0 | 111.6 | C88 L94 I210 L214 R218 Y219 G224 V225 N226 | C88-V222 HydrophobicContact CB-CG2 3.89Å; L94-V222 HydrophobicContact CD2-CG1 4.47Å; I210-V222 HydrophobicContact CG2-CG1 3.66Å; L214-V222 HydrophobicContact CD1-CB 3.64Å; L214-V222 HydrophobicContact CD1-CG1 3.94Å; L214-V222 HydrophobicContact CD1-CG2 3.66Å; L214-V222 HydrophobicContact CD2-CG2 3.92Å; L214-V222 HydrophobicContact CG-CG2 4.46Å; R218-V222 PolarHBondContact O-N 2.89Å; R218-V222 VanDerWaalsContact O-N 3.17Å; Y219-V222 PolarHBondContact O-N 3.41Å; V222-G224 VanDerWaalsContact C-N 3.33Å; V222-G224 PolarHBondContact O-N 2.88Å; V222-V225 PolarHBondContact O-N 3.33Å; V222-N226 WeakPolarHBondContact O-CB 3.32Å; V222-N226 PolarHBondContact O-N 2.78Å; V222-N226 PolarHBondContact O-OD1 3.32Å |
| 223 | F | 87.3 | Confident | 84.7 | Confident | 26 Ų | 26 | 48.6 Ų | 48.6 | 11% | 0.114 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -64.8 | -37.3 | 176.8 | -80.6 | -78.4 | 0 | 0 | 0 | 112.5 | W101 T207 I210 Y219 N226 T227 | W101-F223 HydrophobicContact CZ2-CD1 4.34Å; T207-F223 HydrophobicContact CG2-CE1 3.75Å; T207-F223 HydrophobicContact CG2-CZ 3.64Å; I210-F223 HydrophobicContact CB-CE2 4.46Å; I210-F223 HydrophobicContact CB-CZ 4.13Å; I210-F223 HydrophobicContact CG2-CE2 3.82Å; I210-F223 HydrophobicContact CG2-CZ 3.92Å; Y219-F223 AromaticContact CD1-CD2 3.95Å; Y219-F223 HydrophobicContact CD1-CD2 3.95Å; Y219-F223 HydrophobicContact CD1-CE2 4.45Å; Y219-F223 AromaticContact CD2-CD2 3.86Å; Y219-F223 HydrophobicContact CD2-CD2 3.86Å; Y219-F223 AromaticContact CD2-CE2 3.59Å; Y219-F223 HydrophobicContact CD2-CE2 3.59Å; Y219-F223 AromaticContact CE1-CD2 3.66Å; Y219-F223 HydrophobicContact CE1-CD2 3.66Å; Y219-F223 HydrophobicContact CE1-CE2 4.05Å; Y219-F223 HydrophobicContact CE1-CG 4.41Å; Y219-F223 AromaticContact CE2-CD2 3.6Å; Y219-F223 HydrophobicContact CE2-CD2 3.6Å; Y219-F223 AromaticContact CE2-CE2 3.11Å; Y219-F223 HydrophobicContact CE2-CE2 3.11Å; Y219-F223 HydrophobicContact CE2-CZ 4Å; Y219-F223 HydrophobicContact CG-CD2 4.03Å; Y219-F223 HydrophobicContact CG-CE2 4.23Å; Y219-F223 AromaticContact CZ-CD2 3.47Å; Y219-F223 VanDerWaalsContact CZ-CD2 3.47Å; Y219-F223 AromaticContact CZ-CE2 3.35Å; Y219-F223 WeakPolarHBondContact O-CD2 3.27Å; Y219-F223 PolarHBondContact O-N 3.15Å; Y219-F223 VanDerWaalsContact O-N 3.09Å; F223-N226 PolarHBondContact O-N 3.49Å; F223-T227 VanDerWaalsContact O-CB 3.31Å; F223-T227 WeakPolarHBondContact O-CB 3.24Å; F223-T227 PolarHBondContact O-N 3.32Å; F223-T227 PolarHBondContact O-OG1 3.42Å |
| 224 | G | 86.6 | Confident | 85.5 | Confident | 1 Ų | 1 | 46.2 Ų | 46.2 | 1% | 0.01 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -62.8 | -46.8 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | A220 L221 V222 T227 F228 | A220-G224 PolarHBondContact O-N 2.85Å; L221-G224 PolarHBondContact O-N 2.9Å; V222-G224 VanDerWaalsContact C-N 3.33Å; V222-G224 PolarHBondContact O-N 2.88Å; G224-T227 PolarHBondContact O-N 3.34Å; G224-F228 WeakPolarHBondContact O-CB 3.39Å; G224-F228 PolarHBondContact O-N 3.29Å |
| 225 | V | 86.9 | Confident | 86.1 | Confident | 18 Ų | 18 | 47.2 Ų | 47.2 | 11% | 0.109 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -61.7 | -47.8 | 175.1 | 167.5 | 0 | 0 | 0 | 0 | 111.4 | F85 Y89 L221 V222 T227 F228 I229 | F85-V225 HydrophobicContact CD2-CG2 4.13Å; F85-V225 HydrophobicContact CE2-CG1 3.94Å; F85-V225 HydrophobicContact CE2-CG2 4Å; Y89-V225 HydrophobicContact CE2-CG1 4.29Å; Y89-V225 WeakPolarHBondContact OH-CG1 3.23Å; L221-V225 HydrophobicContact CD1-CG2 4.4Å; L221-V225 VanDerWaalsContact O-CG2 3.31Å; L221-V225 WeakPolarHBondContact O-CG2 3.37Å; L221-V225 PolarHBondContact O-N 2.94Å; V222-V225 PolarHBondContact O-N 3.33Å; V225-T227 VanDerWaalsContact C-N 3.3Å; V225-T227 PolarHBondContact O-N 2.92Å; V225-F228 WeakPolarHBondContact O-CB 3.49Å; V225-F228 PolarHBondContact O-N 3.43Å; V225-I229 HydrophobicContact CG1-CD1 3.71Å; V225-I229 HydrophobicContact CG1-CG1 4.38Å; V225-I229 WeakPolarHBondContact O-CG1 3.23Å; V225-I229 PolarHBondContact O-N 3Å |
| 226 | N | 92.7 | Very high | 87.1 | Confident | 0 Ų | 0 | 49.4 Ų | 49.4 | 0% | 0 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -59.7 | -44.6 | -179.6 | -71.5 | -2.9 | 0 | 0 | 0 | 111.3 | Y89 S98 W101 V222 F223 F228 I229 A230 | Y89-N226 PolarHBondContact OH-OD1 2.83Å; S98-N226 WeakPolarHBondContact CB-OD1 3.4Å; S98-N226 PolarHBondContact OG-ND2 3.29Å; S98-N226 PolarHBondContact OG-OD1 3.46Å; W101-N226 HydrophobicContact CD2-CB 4.14Å; W101-N226 HydrophobicContact CE3-CB 3.43Å; W101-N226 VanDerWaalsContact CE3-CB 3.43Å; W101-N226 HydrophobicContact CH2-CB 4.37Å; W101-N226 VanDerWaalsContact CZ3-C 3.41Å; W101-N226 HydrophobicContact CZ3-CB 3.58Å; V222-N226 WeakPolarHBondContact O-CB 3.32Å; V222-N226 PolarHBondContact O-N 2.78Å; V222-N226 PolarHBondContact O-OD1 3.32Å; F223-N226 PolarHBondContact O-N 3.49Å; N226-F228 VanDerWaalsContact C-N 3.35Å; N226-I229 PolarHBondContact O-N 3.32Å; N226-A230 WeakPolarHBondContact O-CB 3.13Å; N226-A230 PolarHBondContact O-N 2.71Å |
| 227 | T | 91.3 | Very high | 88.3 | Confident | 38 Ų | 38 | 42.7 Ų | 42.7 | 23% | 0.233 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -61.6 | -45 | 177.4 | -56.9 | 0 | 0 | 0 | 0 | 110.7 | W101 F223 G224 V225 I229 A230 L231 | W101-T227 WeakPolarHBondContact CH2-OG1 3.2Å; F223-T227 VanDerWaalsContact O-CB 3.31Å; F223-T227 WeakPolarHBondContact O-CB 3.24Å; F223-T227 PolarHBondContact O-N 3.32Å; F223-T227 PolarHBondContact O-OG1 3.42Å; G224-T227 PolarHBondContact O-N 3.34Å; V225-T227 VanDerWaalsContact C-N 3.3Å; V225-T227 PolarHBondContact O-N 2.92Å; T227-I229 PolarHBondContact O-N 2.59Å; T227-A230 PolarHBondContact O-N 3.29Å; T227-L231 HydrophobicContact CG2-CD1 3.96Å; T227-L231 HydrophobicContact CG2-CG 4.35Å; T227-L231 VanDerWaalsContact O-CG 3.32Å; T227-L231 WeakPolarHBondContact O-CG 3.4Å; T227-L231 PolarHBondContact O-N 2.94Å |
| 228 | F | 90.3 | Very high | 89.5 | Confident | 83 Ų | 83 | 39.2 Ų | 39.2 | 36% | 0.364 | 20% | 0.204 | S | C | . | . | H | α-helix | trans | -57.6 | -50.1 | 176.4 | -179.1 | -110.4 | 0 | 0 | 0 | 112.6 | F42 G224 V225 N226 A230 L231 A232 | F42-F228 HydrophobicContact CB-CD2 3.71Å; F42-F228 HydrophobicContact CB-CE2 4.05Å; F42-F228 HydrophobicContact CD2-CB 3.49Å; F42-F228 VanDerWaalsContact CD2-CB 3.49Å; F42-F228 HydrophobicContact CD2-CD1 4.05Å; F42-F228 AromaticContact CD2-CD2 3.16Å; F42-F228 HydrophobicContact CD2-CD2 3.16Å; F42-F228 AromaticContact CD2-CE2 3.84Å; F42-F228 HydrophobicContact CD2-CE2 3.84Å; F42-F228 AromaticContact CD2-CG 3.26Å; F42-F228 HydrophobicContact CD2-CG 3.26Å; F42-F228 HydrophobicContact CE2-CB 3.77Å; F42-F228 AromaticContact CE2-CD1 3.89Å; F42-F228 HydrophobicContact CE2-CD1 3.89Å; F42-F228 AromaticContact CE2-CD2 3.86Å; F42-F228 HydrophobicContact CE2-CD2 3.86Å; F42-F228 HydrophobicContact CE2-CE1 4.46Å; F42-F228 HydrophobicContact CE2-CE2 4.43Å; F42-F228 AromaticContact CE2-CG 3.53Å; F42-F228 HydrophobicContact CE2-CG 3.53Å; F42-F228 AromaticContact CG-CD2 3.69Å; F42-F228 HydrophobicContact CG-CD2 3.69Å; F42-F228 HydrophobicContact CG-CE2 4.04Å; F42-F228 HydrophobicContact CG-CG 4.23Å; G224-F228 WeakPolarHBondContact O-CB 3.39Å; G224-F228 PolarHBondContact O-N 3.29Å; V225-F228 WeakPolarHBondContact O-CB 3.49Å; V225-F228 PolarHBondContact O-N 3.43Å; N226-F228 VanDerWaalsContact C-N 3.35Å; F228-A230 VanDerWaalsContact C-N 3.32Å; F228-A230 PolarHBondContact O-N 2.96Å; F228-L231 PolarHBondContact O-N 3.27Å; F228-A232 VanDerWaalsContact O-CB 3.24Å; F228-A232 WeakPolarHBondContact O-CB 3.3Å; F228-A232 PolarHBondContact O-N 3.22Å |
| 229 | I | 93.9 | Very high | 90.6 | Very high | 71 Ų | 71 | 41.2 Ų | 41.2 | 36% | 0.364 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -61 | -44.7 | 179.3 | -66.7 | 170.1 | 0 | 0 | 0 | 109.7 | A102 V225 N226 T227 L231 A232 L233 | A102-I229 HydrophobicContact CB-CB 4.13Å; A102-I229 HydrophobicContact CB-CG2 3.88Å; V225-I229 HydrophobicContact CG1-CD1 3.71Å; V225-I229 HydrophobicContact CG1-CG1 4.38Å; V225-I229 WeakPolarHBondContact O-CG1 3.23Å; V225-I229 PolarHBondContact O-N 3Å; N226-I229 PolarHBondContact O-N 3.32Å; T227-I229 PolarHBondContact O-N 2.59Å; I229-L231 PolarHBondContact O-N 3.47Å; I229-A232 PolarHBondContact O-N 3.25Å; I229-L233 HydrophobicContact CG2-CD1 3.76Å; I229-L233 HydrophobicContact CG2-CG 4.22Å; I229-L233 VanDerWaalsContact O-CB 3.31Å; I229-L233 WeakPolarHBondContact O-CB 3.39Å; I229-L233 WeakPolarHBondContact O-CG 3.24Å; I229-L233 PolarHBondContact O-N 2.63Å |
| 230 | A | 95.6 | Very high | 91.4 | Very high | 1 Ų | 1 | 40.4 Ų | 40.4 | 1% | 0.008 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -58 | -48.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | W101 A102 T105 N226 T227 F228 L233 Q234 | W101-A230 HydrophobicContact CZ3-CB 4.25Å; A102-A230 WeakPolarHBondContact O-CB 3.42Å; T105-A230 HydrophobicContact CG2-CB 3.84Å; N226-A230 WeakPolarHBondContact O-CB 3.13Å; N226-A230 PolarHBondContact O-N 2.71Å; T227-A230 PolarHBondContact O-N 3.29Å; F228-A230 VanDerWaalsContact C-N 3.32Å; F228-A230 PolarHBondContact O-N 2.96Å; A230-L233 PolarHBondContact O-N 3.42Å; A230-Q234 VanDerWaalsContact O-CB 3.3Å; A230-Q234 WeakPolarHBondContact O-CB 3.47Å; A230-Q234 PolarHBondContact O-N 3.46Å |
| 231 | L | 94.2 | Very high | 92.3 | Very high | 64 Ų | 64 | 40 Ų | 40 | 34% | 0.335 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -70.7 | -36.5 | -179.5 | -66.5 | 177.6 | 0 | 0 | 0 | 112.6 | F109 T227 F228 I229 Q234 T235 | F109-L231 HydrophobicContact CD2-CD2 4.22Å; F109-L231 HydrophobicContact CE2-CD2 3.76Å; T227-L231 HydrophobicContact CG2-CD1 3.96Å; T227-L231 HydrophobicContact CG2-CG 4.35Å; T227-L231 VanDerWaalsContact O-CG 3.32Å; T227-L231 WeakPolarHBondContact O-CG 3.4Å; T227-L231 PolarHBondContact O-N 2.94Å; F228-L231 PolarHBondContact O-N 3.27Å; I229-L231 PolarHBondContact O-N 3.47Å; L231-Q234 PolarHBondContact O-N 2.99Å; L231-T235 WeakPolarHBondContact O-CB 3.36Å; L231-T235 PolarHBondContact O-N 3.42Å; L231-T235 PolarHBondContact O-OG1 2.79Å |
| 232 | A | 94.5 | Very high | 92.9 | Very high | 45 Ų | 45 | 40.5 Ų | 40.5 | 37% | 0.372 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -64.6 | -46.5 | 174.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | F228 I229 T235 L236 | F228-A232 VanDerWaalsContact O-CB 3.24Å; F228-A232 WeakPolarHBondContact O-CB 3.3Å; F228-A232 PolarHBondContact O-N 3.22Å; I229-A232 PolarHBondContact O-N 3.25Å; A232-T235 PolarHBondContact O-N 2.89Å; A232-L236 WeakPolarHBondContact O-CB 3.5Å; A232-L236 PolarHBondContact O-N 3.15Å |
| 233 | L | 96.3 | Very high | 93.1 | Very high | 54 Ų | 54 | 43.5 Ų | 43.5 | 28% | 0.283 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -63.2 | -41.1 | 174.5 | -71.1 | 174.4 | 0 | 0 | 0 | 111.8 | L103 C106 I229 A230 L236 L237 | L103-L233 HydrophobicContact CD2-CD1 3.79Å; C106-L233 HydrophobicContact CB-CB 3.95Å; I229-L233 HydrophobicContact CG2-CD1 3.76Å; I229-L233 HydrophobicContact CG2-CG 4.22Å; I229-L233 VanDerWaalsContact O-CB 3.31Å; I229-L233 WeakPolarHBondContact O-CB 3.39Å; I229-L233 WeakPolarHBondContact O-CG 3.24Å; I229-L233 PolarHBondContact O-N 2.63Å; A230-L233 PolarHBondContact O-N 3.42Å; L233-L236 PolarHBondContact O-N 3.4Å; L233-L237 VanDerWaalsContact O-CB 3.24Å; L233-L237 WeakPolarHBondContact O-CB 3.41Å; L233-L237 PolarHBondContact O-N 2.83Å |
| 234 | Q | 95.9 | Very high | 93.2 | Very high | 36 Ų | 36 | 46.3 Ų | 46.3 | 17% | 0.168 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -59.7 | -48.8 | 175.5 | 178.7 | -159.6 | -16.7 | 0 | 0 | 110.2 | C106 F109 Q110 N113 A230 L231 L236 L237 T238 | C106-Q234 VanDerWaalsContact SG-CA 3.58Å; C106-Q234 PolarHBondContact SG-N 3.41Å; F109-Q234 HydrophobicContact CB-CG 3.99Å; Q110-Q234 PolarHBondContact NE2-O 3.37Å; N113-Q234 PolarHBondContact ND2-NE2 3.03Å; A230-Q234 VanDerWaalsContact O-CB 3.3Å; A230-Q234 WeakPolarHBondContact O-CB 3.47Å; A230-Q234 PolarHBondContact O-N 3.46Å; L231-Q234 PolarHBondContact O-N 2.99Å; Q234-L236 VanDerWaalsContact C-N 3.35Å; Q234-L236 PolarHBondContact O-N 2.93Å; Q234-L237 PolarHBondContact O-N 2.78Å; Q234-T238 WeakPolarHBondContact O-CB 3.48Å; Q234-T238 PolarHBondContact O-N 3.31Å; Q234-T238 PolarHBondContact O-OG1 3.24Å |
| 235 | T | 93.6 | Very high | 93.4 | Very high | 48 Ų | 48 | 50 Ų | 50 | 29% | 0.294 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -60.8 | -46.6 | -180 | -57.1 | 0 | 0 | 0 | 0 | 110.6 | L231 A232 T238 L239 | L231-T235 WeakPolarHBondContact O-CB 3.36Å; L231-T235 PolarHBondContact O-N 3.42Å; L231-T235 PolarHBondContact O-OG1 2.79Å; A232-T235 PolarHBondContact O-N 2.89Å; T235-T238 PolarHBondContact O-N 3.03Å; T235-L239 HydrophobicContact CG2-CD1 4.12Å; T235-L239 HydrophobicContact CG2-CG 4.48Å; T235-L239 WeakPolarHBondContact O-CB 3.17Å; T235-L239 VanDerWaalsContact O-CG 3.28Å; T235-L239 WeakPolarHBondContact O-CG 3.34Å; T235-L239 PolarHBondContact O-N 2.93Å |
| 236 | L | 95.8 | Very high | 93.6 | Very high | 97 Ų | 97 | 51.1 Ų | 51.1 | 51% | 0.508 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -60.1 | -48 | 177.5 | -178.6 | 64.4 | 0 | 0 | 0 | 111.6 | A232 L233 Q234 T238 L239 I240 | A232-L236 WeakPolarHBondContact O-CB 3.5Å; A232-L236 PolarHBondContact O-N 3.15Å; L233-L236 PolarHBondContact O-N 3.4Å; Q234-L236 VanDerWaalsContact C-N 3.35Å; Q234-L236 PolarHBondContact O-N 2.93Å; L236-T238 VanDerWaalsContact C-N 3.35Å; L236-T238 PolarHBondContact O-N 3.05Å; L236-L239 PolarHBondContact O-N 2.86Å; L236-I240 HydrophobicContact CD1-CD1 3.82Å; L236-I240 HydrophobicContact CD1-CG1 4.34Å; L236-I240 HydrophobicContact CG-CD1 3.84Å; L236-I240 VanDerWaalsContact O-CG1 3.3Å; L236-I240 WeakPolarHBondContact O-CG1 3.21Å; L236-I240 PolarHBondContact O-N 3.43Å |
| 237 | L | 94.6 | Very high | 93.6 | Very high | 28 Ų | 28 | 56.3 Ų | 56.3 | 15% | 0.147 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -64.9 | -40.4 | -179 | -172.8 | 55.4 | 0 | 0 | 0 | 111.2 | Q110 L233 Q234 I240 V241 Y258 | Q110-L237 HydrophobicContact CG-CD2 3.65Å; Q110-L237 HydrophobicContact CG-CG 4.17Å; L233-L237 VanDerWaalsContact O-CB 3.24Å; L233-L237 WeakPolarHBondContact O-CB 3.41Å; L233-L237 PolarHBondContact O-N 2.83Å; Q234-L237 PolarHBondContact O-N 2.78Å; L237-I240 PolarHBondContact O-N 3.4Å; L237-V241 HydrophobicContact CD1-CB 4.48Å; L237-V241 HydrophobicContact CD1-CG2 3.61Å; L237-V241 HydrophobicContact CG-CG2 4.46Å; L237-V241 VanDerWaalsContact O-CB 3.26Å; L237-V241 WeakPolarHBondContact O-CB 3Å; L237-V241 PolarHBondContact O-N 2.86Å; L237-Y258 HydrophobicContact CD2-CD1 4.47Å; L237-Y258 HydrophobicContact CD2-CE1 4.36Å; L237-Y258 HydrophobicContact CG-CE1 4.47Å |
| 238 | T | 94.8 | Very high | 93.7 | Very high | 30 Ų | 30 | 56.4 Ų | 56.4 | 18% | 0.184 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -62.1 | -45.9 | 173.7 | -70.7 | 0 | 0 | 0 | 0 | 111.9 | Q110 Y114 Q234 T235 L236 I240 V242 D243 | Q110-T238 PolarHBondContact NE2-OG1 3.07Å; Q110-T238 PolarHBondContact OE1-OG1 3.41Å; Y114-T238 VanDerWaalsContact OH-CG2 3.29Å; Y114-T238 WeakPolarHBondContact OH-CG2 3.29Å; Q234-T238 WeakPolarHBondContact O-CB 3.48Å; Q234-T238 PolarHBondContact O-N 3.31Å; Q234-T238 PolarHBondContact O-OG1 3.24Å; T235-T238 PolarHBondContact O-N 3.03Å; L236-T238 VanDerWaalsContact C-N 3.35Å; L236-T238 PolarHBondContact O-N 3.05Å; T238-I240 VanDerWaalsContact C-N 3.32Å; T238-I240 PolarHBondContact O-N 2.97Å; T238-V242 HydrophobicContact CG2-CB 4.32Å; T238-V242 WeakPolarHBondContact O-CA 3.38Å; T238-V242 WeakPolarHBondContact O-CB 3.47Å; T238-V242 PolarHBondContact O-N 3.48Å; T238-D243 PolarHBondContact O-N 2.75Å |
| 239 | L | 94.8 | Very high | 93.9 | Very high | 93 Ų | 93 | 54.6 Ų | 54.6 | 49% | 0.487 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -62.6 | -38.7 | 178.2 | -73.4 | 174.1 | 0 | 0 | 0 | 112.3 | T235 L236 D243 G246 | T235-L239 HydrophobicContact CG2-CD1 4.12Å; T235-L239 HydrophobicContact CG2-CG 4.48Å; T235-L239 WeakPolarHBondContact O-CB 3.17Å; T235-L239 VanDerWaalsContact O-CG 3.28Å; T235-L239 WeakPolarHBondContact O-CG 3.34Å; T235-L239 PolarHBondContact O-N 2.93Å; L236-L239 PolarHBondContact O-N 2.86Å; L239-D243 HydrophobicContact CD2-CB 4.44Å; L239-G246 WeakPolarHBondContact O-CA 3.46Å |
| 240 | I | 95.1 | Very high | 94 | Very high | 81 Ų | 81 | 57.8 Ų | 57.8 | 42% | 0.415 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -74.9 | -50.7 | -179.9 | -67.1 | 170.1 | 0 | 0 | 0 | 111 | L236 L237 T238 L247 | L236-I240 HydrophobicContact CD1-CD1 3.82Å; L236-I240 HydrophobicContact CD1-CG1 4.34Å; L236-I240 HydrophobicContact CG-CD1 3.84Å; L236-I240 VanDerWaalsContact O-CG1 3.3Å; L236-I240 WeakPolarHBondContact O-CG1 3.21Å; L236-I240 PolarHBondContact O-N 3.43Å; L237-I240 PolarHBondContact O-N 3.4Å; T238-I240 VanDerWaalsContact C-N 3.32Å; T238-I240 PolarHBondContact O-N 2.97Å; I240-L247 HydrophobicContact CG2-CD1 4.1Å; I240-L247 HydrophobicContact CG2-CG 4.49Å; I240-L247 WeakPolarHBondContact O-CB 3.44Å; I240-L247 VanDerWaalsContact O-CG 3.3Å; I240-L247 WeakPolarHBondContact O-CG 3.3Å; I240-L247 PolarHBondContact O-N 3.01Å |
| 241 | V | 95.9 | Very high | 94.1 | Very high | 4 Ų | 4 | 59.1 Ų | 59.1 | 2% | 0.024 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -89.3 | -37.6 | -166.1 | 167.9 | 0 | 0 | 0 | 0 | 112.5 | L237 L249 Q254 I257 Y258 | L237-V241 HydrophobicContact CD1-CB 4.48Å; L237-V241 HydrophobicContact CD1-CG2 3.61Å; L237-V241 HydrophobicContact CG-CG2 4.46Å; L237-V241 VanDerWaalsContact O-CB 3.26Å; L237-V241 WeakPolarHBondContact O-CB 3Å; L237-V241 PolarHBondContact O-N 2.86Å; V241-L249 HydrophobicContact CG1-CD1 4.3Å; V241-L249 WeakPolarHBondContact O-CB 3.3Å; V241-L249 PolarHBondContact O-N 3.25Å; V241-Q254 HydrophobicContact CG1-CB 4Å; V241-Q254 HydrophobicContact CG1-CG 3.7Å; V241-I257 HydrophobicContact CG1-CD1 4.13Å; V241-I257 HydrophobicContact CG2-CD1 4.01Å; V241-I257 HydrophobicContact CG2-CG2 4.21Å; V241-Y258 HydrophobicContact CG1-CE1 4.35Å |
| 242 | V | 94.1 | Very high | 94.1 | Very high | 32 Ų | 32 | 58.1 Ų | 58.1 | 19% | 0.194 | 35% | 0.35 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -106.7 | -43.7 | -166 | -173.3 | 0 | 0 | 0 | 0 | 112.2 | Y114 T238 | Y114-V242 HydrophobicContact CD1-CG1 4.36Å; Y114-V242 HydrophobicContact CD2-CG2 4.33Å; Y114-V242 HydrophobicContact CE1-CB 4.39Å; Y114-V242 HydrophobicContact CE1-CG1 3.5Å; Y114-V242 VanDerWaalsContact CE1-CG1 3.5Å; Y114-V242 HydrophobicContact CE1-CG2 4.18Å; Y114-V242 HydrophobicContact CE2-CG1 4.5Å; Y114-V242 HydrophobicContact CE2-CG2 3.69Å; Y114-V242 WeakPolarHBondContact OH-CG1 3.5Å; T238-V242 HydrophobicContact CG2-CB 4.32Å; T238-V242 WeakPolarHBondContact O-CA 3.38Å; T238-V242 WeakPolarHBondContact O-CB 3.47Å; T238-V242 PolarHBondContact O-N 3.48Å |
| 243 | D | 91.5 | Very high | 94.2 | Very high | 64 Ų | 64 | 58.8 Ų | 58.8 | 34% | 0.342 | 35% | 0.35 | S | S | . | . | S | Bend | trans | -66.2 | 139.9 | -175.6 | -165.3 | -90.1 | 0 | 0 | 0 | 111.3 | T238 L239 S245 G246 G248 | T238-D243 PolarHBondContact O-N 2.75Å; L239-D243 HydrophobicContact CD2-CB 4.44Å; D243-S245 PolarHBondContact O-N 3.3Å; D243-S245 WeakPolarHBondContact OD1-CA 3.43Å; D243-S245 WeakPolarHBondContact OD1-CB 3.5Å; D243-S245 PolarHBondContact OD1-N 2.91Å; D243-S245 PolarHBondContact OD1-OG 3.39Å; D243-G246 CarbonylContact O-C 3.53Å; D243-G246 WeakPolarHBondContact O-CA 3.49Å; D243-G246 PolarHBondContact O-N 3.46Å; D243-G248 WeakPolarHBondContact O-CA 3.22Å; D243-G248 PolarHBondContact O-N 2.92Å |
| 244 | A | 89.4 | Confident | 94.3 | Very high | 85 Ų | 85 | 56.8 Ų | 56.8 | 70% | 0.702 | 34% | 0.339 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.2 | -16.5 | 178.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||
| 245 | S | 90.3 | Very high | 94.3 | Very high | 79 Ų | 79 | 55.1 Ų | 55.1 | 55% | 0.552 | 33% | 0.331 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.4 | -17.2 | 171.9 | -41.3 | 0 | 0 | 0 | 0 | 112.5 | R27 D243 | R27-S245 PolarHBondContact NH2-OG 3.05Å; D243-S245 PolarHBondContact O-N 3.3Å; D243-S245 WeakPolarHBondContact OD1-CA 3.43Å; D243-S245 WeakPolarHBondContact OD1-CB 3.5Å; D243-S245 PolarHBondContact OD1-N 2.91Å; D243-S245 PolarHBondContact OD1-OG 3.39Å |
| 246 | G | 91.9 | Very high | 94.5 | Very high | 40 Ų | 40 | 56.5 Ų | 56.5 | 41% | 0.412 | 34% | 0.337 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -91.5 | -125.8 | 166.8 | 0 | 0 | 0 | 0 | 0 | 110.8 | L239 D243 | L239-G246 WeakPolarHBondContact O-CA 3.46Å; D243-G246 CarbonylContact O-C 3.53Å; D243-G246 WeakPolarHBondContact O-CA 3.49Å; D243-G246 PolarHBondContact O-N 3.46Å |
| 247 | L | 92.5 | Very high | 94.6 | Very high | 110 Ų | 110 | 54.3 Ų | 54.3 | 58% | 0.576 | 33% | 0.325 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.5 | -22.3 | 179.1 | -61.4 | 173.8 | 0 | 0 | 0 | 113.3 | I240 L249 | I240-L247 HydrophobicContact CG2-CD1 4.1Å; I240-L247 HydrophobicContact CG2-CG 4.49Å; I240-L247 WeakPolarHBondContact O-CB 3.44Å; I240-L247 VanDerWaalsContact O-CG 3.3Å; I240-L247 WeakPolarHBondContact O-CG 3.3Å; I240-L247 PolarHBondContact O-N 3.01Å; L247-L249 VanDerWaalsContact C-N 3.29Å; L247-L249 HydrophobicContact CB-CD1 4.18Å; L247-L249 HydrophobicContact CB-CD2 3.77Å; L247-L249 HydrophobicContact CB-CG 3.63Å; L247-L249 HydrophobicContact CD1-CD1 4Å; L247-L249 HydrophobicContact CD1-CG 4.36Å; L247-L249 PolarHBondContact O-N 2.95Å |
| 248 | G | 92.6 | Very high | 94.8 | Very high | 39 Ų | 39 | 53 Ų | 53 | 40% | 0.402 | 32% | 0.318 | S | S | . | . | trans | 53.1 | 42.8 | -179.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | D243 | D243-G248 WeakPolarHBondContact O-CA 3.22Å; D243-G248 PolarHBondContact O-N 2.92Å | ||
| 249 | L | 95.8 | Very high | 95 | Very high | 46 Ų | 46 | 51.9 Ų | 51.9 | 24% | 0.241 | 31% | 0.312 | C | S | . | . | trans | -70.3 | 150.9 | -169.8 | -60.3 | 178.1 | 0 | 0 | 0 | 111.8 | V241 L247 T253 Q254 I257 | V241-L249 HydrophobicContact CG1-CD1 4.3Å; V241-L249 WeakPolarHBondContact O-CB 3.3Å; V241-L249 PolarHBondContact O-N 3.25Å; L247-L249 VanDerWaalsContact C-N 3.29Å; L247-L249 HydrophobicContact CB-CD1 4.18Å; L247-L249 HydrophobicContact CB-CD2 3.77Å; L247-L249 HydrophobicContact CB-CG 3.63Å; L247-L249 HydrophobicContact CD1-CD1 4Å; L247-L249 HydrophobicContact CD1-CG 4.36Å; L247-L249 PolarHBondContact O-N 2.95Å; L249-T253 HydrophobicContact CB-CG2 4.38Å; L249-T253 HydrophobicContact CD1-CG2 3.88Å; L249-T253 HydrophobicContact CG-CG2 4.49Å; L249-Q254 HydrophobicContact CB-CG 4.21Å; L249-Q254 PolarHBondContact O-NE2 3.28Å; L249-I257 HydrophobicContact CD1-CD1 3.38Å | ||
| 250 | E | 96 | Very high | 95.2 | Very high | 138 Ų | 138 | 50.6 Ų | 50.6 | 65% | 0.645 | 31% | 0.311 | S | S | * | . | trans | -65.6 | 151.2 | 171.7 | -63.1 | -169.6 | 168.6 | 0 | 0 | 111.9 | T252 T253 Q254 | E250-T252 PolarHBondContact O-N 3.11Å; E250-T253 WeakPolarHBondContact O-CB 3.26Å; E250-T253 PolarHBondContact O-N 3.43Å; E250-Q254 WeakPolarHBondContact O-CG 3.4Å; E250-Q254 PolarHBondContact O-N 3.22Å | ||
| 251 | I | 95.9 | Very high | 95.3 | Very high | 28 Ų | 28 | 48.9 Ų | 48.9 | 14% | 0.144 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -52.2 | -35.5 | -173.9 | -165.1 | 64.4 | 0 | 0 | 0 | 114.2 | L118 K121 Q254 F255 | L118-I251 HydrophobicContact CB-CG1 4.06Å; L118-I251 HydrophobicContact CD1-CG1 4.39Å; K121-I251 HydrophobicContact CB-CG2 4.16Å; K121-I251 HydrophobicContact CD-CG2 3.26Å; K121-I251 HydrophobicContact CG-CG2 4.31Å; I251-Q254 WeakPolarHBondContact O-CB 3.44Å; I251-Q254 PolarHBondContact O-N 3.08Å; I251-F255 HydrophobicContact CD1-CD2 4.06Å; I251-F255 HydrophobicContact CD1-CE2 3.88Å; I251-F255 HydrophobicContact CG1-CD2 4.11Å; I251-F255 HydrophobicContact CG1-CE2 4.18Å; I251-F255 WeakPolarHBondContact O-CD2 3.43Å; I251-F255 PolarHBondContact O-N 3.36Å |
| 252 | T | 94.7 | Very high | 95.5 | Very high | 43 Ų | 43 | 48.7 Ų | 48.7 | 26% | 0.264 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -64.5 | -46.6 | 176.9 | -68.6 | 0 | 0 | 0 | 0 | 111.4 | K121 D180 E250 Q254 F255 L256 | K121-T252 PolarHBondContact NZ-OG1 3.43Å; D180-T252 VanDerWaalsContact OD1-CA 3.23Å; D180-T252 WeakPolarHBondContact OD1-CA 3.4Å; D180-T252 VanDerWaalsContact OD1-CB 3.27Å; D180-T252 WeakPolarHBondContact OD1-CB 3.3Å; D180-T252 VanDerWaalsContact OD1-CG2 3.31Å; D180-T252 WeakPolarHBondContact OD1-CG2 3.35Å; D180-T252 PolarHBondContact OD1-OG1 2.81Å; D180-T252 WeakPolarHBondContact OD2-CG2 3.45Å; E250-T252 PolarHBondContact O-N 3.11Å; T252-Q254 VanDerWaalsContact C-N 3.3Å; T252-Q254 PolarHBondContact O-N 3.13Å; T252-F255 PolarHBondContact O-N 2.82Å; T252-L256 PolarHBondContact O-N 2.91Å |
| 253 | T | 96.5 | Very high | 95.7 | Very high | 59 Ų | 59 | 48.8 Ų | 48.8 | 36% | 0.362 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -65.7 | -35.8 | 176.1 | -48.2 | 0 | 0 | 0 | 0 | 111.3 | L249 E250 L256 I257 | L249-T253 HydrophobicContact CB-CG2 4.38Å; L249-T253 HydrophobicContact CD1-CG2 3.88Å; L249-T253 HydrophobicContact CG-CG2 4.49Å; E250-T253 WeakPolarHBondContact O-CB 3.26Å; E250-T253 PolarHBondContact O-N 3.43Å; T253-L256 PolarHBondContact O-N 3.09Å; T253-I257 HydrophobicContact CG2-CD1 4.37Å; T253-I257 VanDerWaalsContact O-CG1 3.31Å; T253-I257 WeakPolarHBondContact O-CG1 3.28Å; T253-I257 PolarHBondContact O-N 3.29Å |
| 254 | Q | 97.9 | Very high | 96 | Very high | 13 Ų | 13 | 51 Ų | 51 | 6% | 0.061 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -59.8 | -48.7 | 174 | -56.5 | -179 | 12.5 | 0 | 0 | 111.2 | V241 L249 E250 I251 T252 L256 I257 Y258 | V241-Q254 HydrophobicContact CG1-CB 4Å; V241-Q254 HydrophobicContact CG1-CG 3.7Å; L249-Q254 HydrophobicContact CB-CG 4.21Å; L249-Q254 PolarHBondContact O-NE2 3.28Å; E250-Q254 WeakPolarHBondContact O-CG 3.4Å; E250-Q254 PolarHBondContact O-N 3.22Å; I251-Q254 WeakPolarHBondContact O-CB 3.44Å; I251-Q254 PolarHBondContact O-N 3.08Å; T252-Q254 VanDerWaalsContact C-N 3.3Å; T252-Q254 PolarHBondContact O-N 3.13Å; Q254-L256 PolarHBondContact O-N 3.45Å; Q254-I257 WeakPolarHBondContact O-CB 3.29Å; Q254-I257 PolarHBondContact O-N 3.49Å; Q254-I257 VanDerWaalsContact O-N 3.13Å; Q254-Y258 HydrophobicContact CB-CE2 3.92Å; Q254-Y258 WeakPolarHBondContact O-CD1 3.29Å; Q254-Y258 VanDerWaalsContact O-CD2 3.32Å; Q254-Y258 WeakPolarHBondContact O-CD2 3.46Å; Q254-Y258 PolarHBondContact O-N 2.85Å |
| 255 | F | 97.8 | Very high | 96.4 | Very high | 0 Ų | 0 | 47.3 Ų | 47.3 | 0% | 0 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -66.6 | -33.9 | 179.2 | -91.2 | -99.7 | 0 | 0 | 0 | 113.3 | V111 L118 V176 M179 D180 I251 T252 I257 Y258 A259 | V111-F255 HydrophobicContact CG1-CE1 4.03Å; V111-F255 HydrophobicContact CG1-CZ 4.45Å; L118-F255 HydrophobicContact CB-CD2 4.28Å; L118-F255 HydrophobicContact CB-CE2 3.79Å; L118-F255 HydrophobicContact CB-CZ 4.02Å; L118-F255 HydrophobicContact CD1-CD2 4.4Å; L118-F255 HydrophobicContact CD2-CD1 3.65Å; L118-F255 HydrophobicContact CD2-CD2 4.1Å; L118-F255 HydrophobicContact CD2-CE1 3.55Å; L118-F255 HydrophobicContact CD2-CE2 4.01Å; L118-F255 HydrophobicContact CD2-CG 3.93Å; L118-F255 HydrophobicContact CD2-CZ 3.74Å; L118-F255 HydrophobicContact CG-CD2 4.5Å; L118-F255 HydrophobicContact CG-CE2 4.39Å; L118-F255 HydrophobicContact CG-CZ 4.49Å; V176-F255 HydrophobicContact CG1-CD1 3.93Å; M179-F255 HydrophobicContact CE-CD1 4.49Å; M179-F255 HydrophobicContact CE-CE1 3.63Å; M179-F255 HydrophobicContact CE-CZ 4.34Å; M179-F255 HydrophobicContact SD-CE1 4.46Å; D180-F255 HydrophobicContact CB-CB 3.94Å; I251-F255 HydrophobicContact CD1-CD2 4.06Å; I251-F255 HydrophobicContact CD1-CE2 3.88Å; I251-F255 HydrophobicContact CG1-CD2 4.11Å; I251-F255 HydrophobicContact CG1-CE2 4.18Å; I251-F255 WeakPolarHBondContact O-CD2 3.43Å; I251-F255 PolarHBondContact O-N 3.36Å; T252-F255 PolarHBondContact O-N 2.82Å; F255-I257 VanDerWaalsContact C-N 3.33Å; F255-Y258 HydrophobicContact CD2-CD2 4.31Å; F255-Y258 HydrophobicContact CD2-CE2 4.38Å; F255-Y258 HydrophobicContact CE2-CE2 4.47Å; F255-Y258 HydrophobicContact CG-CD2 4.35Å; F255-Y258 PolarHBondContact O-N 3Å; F255-A259 WeakPolarHBondContact O-CB 3.21Å; F255-A259 PolarHBondContact O-N 3.39Å |
| 256 | L | 97.3 | Very high | 96.8 | Very high | 78 Ų | 78 | 43.8 Ų | 43.8 | 41% | 0.408 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -62.4 | -41.2 | 170.5 | -177 | 63.4 | 0 | 0 | 0 | 111.8 | Y177 T252 T253 Q254 A259 S260 | Y177-L256 HydrophobicContact CD2-CD1 3.98Å; Y177-L256 HydrophobicContact CE2-CD1 3.81Å; T252-L256 PolarHBondContact O-N 2.91Å; T253-L256 PolarHBondContact O-N 3.09Å; Q254-L256 PolarHBondContact O-N 3.45Å; L256-A259 PolarHBondContact O-N 3.16Å; L256-S260 WeakPolarHBondContact O-CB 3.45Å; L256-S260 PolarHBondContact O-N 2.9Å; L256-S260 PolarHBondContact O-OG 2.81Å |
| 257 | I | 98.2 | Very high | 97.1 | Very high | 51 Ų | 51 | 46.3 Ų | 46.3 | 26% | 0.262 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -64.1 | -43.4 | 174.9 | -69.9 | 167.3 | 0 | 0 | 0 | 110.4 | V241 L249 T253 Q254 F255 S260 Y261 | V241-I257 HydrophobicContact CG1-CD1 4.13Å; V241-I257 HydrophobicContact CG2-CD1 4.01Å; V241-I257 HydrophobicContact CG2-CG2 4.21Å; L249-I257 HydrophobicContact CD1-CD1 3.38Å; T253-I257 HydrophobicContact CG2-CD1 4.37Å; T253-I257 VanDerWaalsContact O-CG1 3.31Å; T253-I257 WeakPolarHBondContact O-CG1 3.28Å; T253-I257 PolarHBondContact O-N 3.29Å; Q254-I257 WeakPolarHBondContact O-CB 3.29Å; Q254-I257 PolarHBondContact O-N 3.49Å; Q254-I257 VanDerWaalsContact O-N 3.13Å; F255-I257 VanDerWaalsContact C-N 3.33Å; I257-S260 PolarHBondContact O-N 2.79Å; I257-Y261 VanDerWaalsContact O-CB 3.3Å; I257-Y261 WeakPolarHBondContact O-CB 3.14Å; I257-Y261 PolarHBondContact O-N 3.29Å |
| 258 | Y | 98.4 | Very high | 97.2 | Very high | 1 Ų | 1 | 44.9 Ų | 44.9 | 0% | 0.004 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -65.1 | -40.9 | 178.7 | -54.5 | -26.8 | 0 | 0 | 0 | 112.3 | Q110 V111 Y114 L237 V241 Q254 F255 Y261 F262 | Q110-Y258 HydrophobicContact CB-CD1 3.85Å; Q110-Y258 HydrophobicContact CB-CD2 4.18Å; Q110-Y258 HydrophobicContact CB-CE1 3.59Å; Q110-Y258 HydrophobicContact CB-CE2 3.95Å; Q110-Y258 HydrophobicContact CB-CG 4.15Å; Q110-Y258 HydrophobicContact CG-CD1 4.26Å; Q110-Y258 HydrophobicContact CG-CE1 3.82Å; Q110-Y258 PolarHBondContact OE1-OH 2.84Å; V111-Y258 HydrophobicContact CG2-CD2 4.29Å; V111-Y258 HydrophobicContact CG2-CG 4.49Å; Y114-Y258 HydrophobicContact CD2-CE2 4.17Å; Y114-Y258 VanDerWaalsContact CD2-OH 3.23Å; Y114-Y258 WeakPolarHBondContact CD2-OH 3.18Å; L237-Y258 HydrophobicContact CD2-CD1 4.47Å; L237-Y258 HydrophobicContact CD2-CE1 4.36Å; L237-Y258 HydrophobicContact CG-CE1 4.47Å; V241-Y258 HydrophobicContact CG1-CE1 4.35Å; Q254-Y258 HydrophobicContact CB-CE2 3.92Å; Q254-Y258 WeakPolarHBondContact O-CD1 3.29Å; Q254-Y258 VanDerWaalsContact O-CD2 3.32Å; Q254-Y258 WeakPolarHBondContact O-CD2 3.46Å; Q254-Y258 PolarHBondContact O-N 2.85Å; F255-Y258 HydrophobicContact CD2-CD2 4.31Å; F255-Y258 HydrophobicContact CD2-CE2 4.38Å; F255-Y258 HydrophobicContact CE2-CE2 4.47Å; F255-Y258 HydrophobicContact CG-CD2 4.35Å; F255-Y258 PolarHBondContact O-N 3Å; Y258-Y261 WeakPolarHBondContact O-CB 3.06Å; Y258-Y261 PolarHBondContact O-N 2.98Å; Y258-F262 WeakPolarHBondContact O-CD2 3.48Å; Y258-F262 PolarHBondContact O-N 2.94Å; Y258-F262 VanDerWaalsContact O-N 3.15Å |
| 259 | A | 98.5 | Very high | 97.4 | Very high | 6 Ų | 6 | 43.3 Ų | 43.3 | 5% | 0.05 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -61.4 | -46.4 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | A173 V176 F255 L256 Y261 F262 A263 | A173-A259 WeakPolarHBondContact CB-O 3.47Å; V176-A259 HydrophobicContact CB-CB 4.26Å; V176-A259 HydrophobicContact CG1-CB 4.06Å; F255-A259 WeakPolarHBondContact O-CB 3.21Å; F255-A259 PolarHBondContact O-N 3.39Å; L256-A259 PolarHBondContact O-N 3.16Å; A259-Y261 VanDerWaalsContact C-N 3.29Å; A259-Y261 PolarHBondContact O-N 2.79Å; A259-F262 PolarHBondContact O-N 2.8Å; A259-A263 PolarHBondContact O-N 2.79Å |
| 260 | S | 98.3 | Very high | 97.4 | Very high | 66 Ų | 66 | 45.2 Ų | 45.2 | 46% | 0.462 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -62.4 | -36.9 | 177.8 | -55.9 | 0 | 0 | 0 | 0 | 112.2 | L256 I257 A263 L264 | L256-S260 WeakPolarHBondContact O-CB 3.45Å; L256-S260 PolarHBondContact O-N 2.9Å; L256-S260 PolarHBondContact O-OG 2.81Å; I257-S260 PolarHBondContact O-N 2.79Å; S260-A263 PolarHBondContact O-N 2.79Å; S260-L264 PolarHBondContact O-N 3.17Å |
| 261 | Y | 98.5 | Very high | 97.2 | Very high | 45 Ų | 45 | 41.3 Ų | 41.3 | 18% | 0.176 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -60.3 | -48.3 | 175.3 | 175.7 | -94.5 | 0 | 0 | 0 | 111.6 | L103 I257 Y258 A259 L264 I265 | L103-Y261 VanDerWaalsContact CA-OH 3.26Å; L103-Y261 WeakPolarHBondContact CA-OH 3.23Å; L103-Y261 WeakPolarHBondContact CB-OH 3.45Å; L103-Y261 WeakPolarHBondContact CD2-OH 3.49Å; L103-Y261 WeakPolarHBondContact O-CE1 3.36Å; L103-Y261 PolarHBondContact O-OH 3.06Å; I257-Y261 VanDerWaalsContact O-CB 3.3Å; I257-Y261 WeakPolarHBondContact O-CB 3.14Å; I257-Y261 PolarHBondContact O-N 3.29Å; Y258-Y261 WeakPolarHBondContact O-CB 3.06Å; Y258-Y261 PolarHBondContact O-N 2.98Å; A259-Y261 VanDerWaalsContact C-N 3.29Å; A259-Y261 PolarHBondContact O-N 2.79Å; Y261-L264 WeakPolarHBondContact O-CB 3.36Å; Y261-L264 PolarHBondContact O-N 2.99Å; Y261-I265 HydrophobicContact CD1-CD1 3.9Å; Y261-I265 HydrophobicContact CE1-CD1 3.44Å; Y261-I265 VanDerWaalsContact CE1-CD1 3.44Å; Y261-I265 HydrophobicContact CE1-CG1 4.44Å; Y261-I265 WeakPolarHBondContact O-CG1 3.13Å; Y261-I265 PolarHBondContact O-N 3.29Å; Y261-I265 VanDerWaalsContact O-N 3.09Å |
| 262 | F | 98.6 | Very high | 97 | Very high | 0 Ų | 0 | 41.3 Ų | 41.3 | 0% | 0 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -68.5 | -33.3 | 176 | -79.8 | -70.4 | 0 | 0 | 0 | 113.1 | V111 I172 A173 F195 Y258 A259 L264 I265 A266 | V111-F262 HydrophobicContact CG2-CE2 4.35Å; I172-F262 HydrophobicContact CB-CD1 4.37Å; I172-F262 HydrophobicContact CB-CG 4.42Å; I172-F262 HydrophobicContact CG2-CB 3.98Å; I172-F262 HydrophobicContact CG2-CD1 3.55Å; I172-F262 HydrophobicContact CG2-CD2 3.51Å; I172-F262 HydrophobicContact CG2-CE1 3.78Å; I172-F262 HydrophobicContact CG2-CE2 3.75Å; I172-F262 HydrophobicContact CG2-CG 3.41Å; I172-F262 VanDerWaalsContact CG2-CG 3.41Å; I172-F262 HydrophobicContact CG2-CZ 3.87Å; A173-F262 HydrophobicContact CB-CB 3.78Å; F195-F262 HydrophobicContact CE2-CE2 4.41Å; F195-F262 HydrophobicContact CE2-CZ 4.45Å; Y258-F262 WeakPolarHBondContact O-CD2 3.48Å; Y258-F262 PolarHBondContact O-N 2.94Å; Y258-F262 VanDerWaalsContact O-N 3.15Å; A259-F262 PolarHBondContact O-N 2.8Å; F262-L264 VanDerWaalsContact C-N 3.33Å; F262-I265 HydrophobicContact CD1-CD1 4.01Å; F262-I265 HydrophobicContact CE1-CD1 4.38Å; F262-I265 PolarHBondContact O-N 2.87Å; F262-A266 PolarHBondContact O-N 3.21Å |
| 263 | A | 98.5 | Very high | 96.7 | Very high | 33 Ų | 33 | 39.3 Ų | 39.3 | 27% | 0.273 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -63.5 | -39.8 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | A173 A259 S260 A266 V267 | A173-A263 HydrophobicContact CB-CB 4.02Å; A259-A263 PolarHBondContact O-N 2.79Å; S260-A263 PolarHBondContact O-N 2.79Å; A263-A266 WeakPolarHBondContact O-CB 3.43Å; A263-A266 PolarHBondContact O-N 3.42Å; A263-V267 WeakPolarHBondContact O-CG2 3.38Å; A263-V267 PolarHBondContact O-N 2.77Å |
| 264 | L | 98.3 | Very high | 96.4 | Very high | 112 Ų | 112 | 38.5 Ų | 38.5 | 59% | 0.586 | 23% | 0.233 | S | C | * | . | H | α-helix | trans | -63.5 | -43.6 | 174.7 | -179.3 | 62.2 | 0 | 0 | 0 | 111.7 | S260 Y261 F262 A266 V267 V268 | S260-L264 PolarHBondContact O-N 3.17Å; Y261-L264 WeakPolarHBondContact O-CB 3.36Å; Y261-L264 PolarHBondContact O-N 2.99Å; F262-L264 VanDerWaalsContact C-N 3.33Å; L264-A266 VanDerWaalsContact C-N 3.28Å; L264-A266 PolarHBondContact O-N 3.06Å; L264-V267 PolarHBondContact O-N 3.29Å; L264-V268 HydrophobicContact CD1-CG2 4.49Å; L264-V268 WeakPolarHBondContact O-CG2 3.21Å; L264-V268 PolarHBondContact O-N 3.4Å |
| 265 | I | 98.2 | Very high | 95.9 | Very high | 7 Ų | 7 | 40.7 Ų | 40.7 | 4% | 0.036 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -55.9 | -47.5 | 172.3 | -65.5 | 170.4 | 0 | 0 | 0 | 109.7 | L103 Y261 F262 V267 V268 F269 | L103-I265 HydrophobicContact CB-CD1 3.78Å; L103-I265 HydrophobicContact CB-CG1 4.31Å; L103-I265 HydrophobicContact CD1-CG1 4.38Å; Y261-I265 HydrophobicContact CD1-CD1 3.9Å; Y261-I265 HydrophobicContact CE1-CD1 3.44Å; Y261-I265 VanDerWaalsContact CE1-CD1 3.44Å; Y261-I265 HydrophobicContact CE1-CG1 4.44Å; Y261-I265 WeakPolarHBondContact O-CG1 3.13Å; Y261-I265 PolarHBondContact O-N 3.29Å; Y261-I265 VanDerWaalsContact O-N 3.09Å; F262-I265 HydrophobicContact CD1-CD1 4.01Å; F262-I265 HydrophobicContact CE1-CD1 4.38Å; F262-I265 PolarHBondContact O-N 2.87Å; I265-V267 VanDerWaalsContact C-N 3.32Å; I265-V267 PolarHBondContact O-N 3.43Å; I265-V268 PolarHBondContact O-N 2.89Å; I265-F269 HydrophobicContact CG2-CD2 3.74Å; I265-F269 HydrophobicContact CG2-CE2 3.99Å; I265-F269 WeakPolarHBondContact O-CD2 3.3Å; I265-F269 PolarHBondContact O-N 2.77Å |
| 266 | A | 98.3 | Very high | 95.3 | Very high | 4 Ų | 4 | 41.6 Ų | 41.6 | 3% | 0.033 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -57.5 | -43.8 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | S166 L170 F262 A263 L264 L270 | S166-A266 WeakPolarHBondContact CB-O 3.34Å; S166-A266 WeakPolarHBondContact O-CB 3.08Å; S166-A266 PolarHBondContact OG-O 3.37Å; L170-A266 HydrophobicContact CB-CB 3.88Å; F262-A266 PolarHBondContact O-N 3.21Å; A263-A266 WeakPolarHBondContact O-CB 3.43Å; A263-A266 PolarHBondContact O-N 3.42Å; L264-A266 VanDerWaalsContact C-N 3.28Å; L264-A266 PolarHBondContact O-N 3.06Å; A266-L270 VanDerWaalsContact O-CB 3.32Å; A266-L270 WeakPolarHBondContact O-CB 3.41Å; A266-L270 PolarHBondContact O-N 3.19Å |
| 267 | V | 97.8 | Very high | 94.7 | Very high | 93 Ų | 93 | 40.6 Ų | 40.6 | 56% | 0.564 | 25% | 0.251 | S | S | * | . | H | α-helix | trans | -64.6 | -44.2 | 177.9 | 171.2 | 0 | 0 | 0 | 0 | 111.8 | A263 L264 I265 F269 L270 A271 | A263-V267 WeakPolarHBondContact O-CG2 3.38Å; A263-V267 PolarHBondContact O-N 2.77Å; L264-V267 PolarHBondContact O-N 3.29Å; I265-V267 VanDerWaalsContact C-N 3.32Å; I265-V267 PolarHBondContact O-N 3.43Å; V267-F269 PolarHBondContact O-N 3.46Å; V267-L270 WeakPolarHBondContact O-CB 3.06Å; V267-L270 PolarHBondContact O-N 2.82Å; V267-A271 PolarHBondContact O-N 2.78Å |
| 268 | V | 96 | Very high | 94.1 | Very high | 80 Ų | 80 | 43.3 Ų | 43.3 | 49% | 0.485 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -60.4 | -46.7 | 178.6 | 169.8 | 0 | 0 | 0 | 0 | 110.9 | L264 I265 A271 S272 | L264-V268 HydrophobicContact CD1-CG2 4.49Å; L264-V268 WeakPolarHBondContact O-CG2 3.21Å; L264-V268 PolarHBondContact O-N 3.4Å; I265-V268 PolarHBondContact O-N 2.89Å; V268-A271 PolarHBondContact O-N 3.29Å; V268-S272 PolarHBondContact O-N 3.26Å |
| 269 | F | 96 | Very high | 93.5 | Very high | 7 Ų | 7 | 49.8 Ų | 49.8 | 3% | 0.031 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -72.7 | -28 | 178.9 | -80 | -83 | 0 | 0 | 0 | 113 | C96 V99 W100 L165 I265 V267 G273 | C96-F269 HydrophobicContact CB-CE1 4.08Å; C96-F269 WeakPolarHBondContact O-CE1 3.31Å; C96-F269 WeakPolarHBondContact O-CZ 3.5Å; V99-F269 HydrophobicContact CG1-CZ 4.46Å; W100-F269 HydrophobicContact CB-CE1 4.06Å; W100-F269 HydrophobicContact CB-CE2 3.8Å; W100-F269 HydrophobicContact CB-CZ 3.46Å; W100-F269 VanDerWaalsContact CB-CZ 3.46Å; W100-F269 AromaticContact CD1-CD2 3.91Å; W100-F269 AromaticContact CD1-CE2 3.74Å; W100-F269 HydrophobicContact CG-CE2 4.19Å; W100-F269 HydrophobicContact CG-CZ 4.23Å; L165-F269 HydrophobicContact CB-CB 4.28Å; L165-F269 HydrophobicContact CB-CD1 4Å; L165-F269 HydrophobicContact CB-CG 4.09Å; L165-F269 HydrophobicContact CD1-CD1 3.71Å; L165-F269 HydrophobicContact CD1-CE1 3.62Å; L165-F269 HydrophobicContact CD1-CG 4.5Å; L165-F269 HydrophobicContact CD1-CZ 4.38Å; I265-F269 HydrophobicContact CG2-CD2 3.74Å; I265-F269 HydrophobicContact CG2-CE2 3.99Å; I265-F269 WeakPolarHBondContact O-CD2 3.3Å; I265-F269 PolarHBondContact O-N 2.77Å; V267-F269 PolarHBondContact O-N 3.46Å; F269-G273 PolarHBondContact O-N 2.95Å |
| 270 | L | 95.3 | Very high | 92.7 | Very high | 85 Ų | 85 | 53.6 Ų | 53.6 | 45% | 0.445 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -64.1 | -48.3 | 172 | -171.4 | 59.3 | 0 | 0 | 0 | 110.7 | M163 S166 A266 V267 G273 A274 | M163-L270 HydrophobicContact CE-CD1 3.89Å; M163-L270 HydrophobicContact SD-CD1 4.22Å; S166-L270 VanDerWaalsContact OG-CB 3.31Å; S166-L270 WeakPolarHBondContact OG-CB 3.23Å; S166-L270 PolarHBondContact OG-N 2.88Å; A266-L270 VanDerWaalsContact O-CB 3.32Å; A266-L270 WeakPolarHBondContact O-CB 3.41Å; A266-L270 PolarHBondContact O-N 3.19Å; V267-L270 WeakPolarHBondContact O-CB 3.06Å; V267-L270 PolarHBondContact O-N 2.82Å; L270-G273 PolarHBondContact O-N 3.03Å; L270-A274 WeakPolarHBondContact O-CB 3.47Å; L270-A274 PolarHBondContact O-N 3.18Å |
| 271 | A | 93 | Very high | 91.8 | Very high | 56 Ų | 56 | 53.5 Ų | 53.5 | 46% | 0.463 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -61.9 | -45.2 | 178 | 0 | 0 | 0 | 0 | 0 | 111.1 | V267 V268 G273 A274 V275 | V267-A271 PolarHBondContact O-N 2.78Å; V268-A271 PolarHBondContact O-N 3.29Å; A271-G273 PolarHBondContact O-N 2.97Å; A271-A274 PolarHBondContact O-N 2.83Å; A271-V275 VanDerWaalsContact O-CG2 3.31Å; A271-V275 WeakPolarHBondContact O-CG2 3.29Å; A271-V275 PolarHBondContact O-N 3.43Å |
| 272 | S | 90.6 | Very high | 91.1 | Very high | 28 Ų | 28 | 59.8 Ų | 59.8 | 20% | 0.196 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -61.3 | -45.1 | 177 | -163.4 | 0 | 0 | 0 | 0 | 112 | R92 E162 V268 V275 S276 | R92-S272 PolarHBondContact NH2-O 3Å; R92-S272 PolarHBondContact NH2-OG 2.96Å; E162-S272 WeakPolarHBondContact OE1-CB 3.34Å; E162-S272 PolarHBondContact OE1-OG 2.94Å; V268-S272 PolarHBondContact O-N 3.26Å; S272-V275 PolarHBondContact O-N 2.87Å; S272-S276 PolarHBondContact O-N 3.49Å; S272-S276 PolarHBondContact O-OG 3.37Å; S272-S276 VanDerWaalsContact O-OG 3.05Å |
| 273 | G | 89.2 | Confident | 90.2 | Very high | 2 Ų | 2 | 68.1 Ų | 68.1 | 2% | 0.021 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -62.5 | -47.2 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113 | E162 F269 L270 A271 V275 S276 V277 | E162-G273 WeakPolarHBondContact OE2-CA 3.04Å; E162-G273 PolarHBondContact OE2-N 3.08Å; F269-G273 PolarHBondContact O-N 2.95Å; L270-G273 PolarHBondContact O-N 3.03Å; A271-G273 PolarHBondContact O-N 2.97Å; G273-V275 VanDerWaalsContact C-N 3.33Å; G273-V275 PolarHBondContact O-N 2.9Å; G273-S276 WeakPolarHBondContact O-CB 3.09Å; G273-S276 PolarHBondContact O-N 3.27Å; G273-S276 VanDerWaalsContact O-N 3.15Å; G273-V277 WeakPolarHBondContact O-CG2 3.34Å; G273-V277 PolarHBondContact O-N 2.87Å |
| 274 | A | 89.3 | Confident | 89 | Confident | 42 Ų | 42 | 72.9 Ų | 72.9 | 35% | 0.347 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -58.5 | -45.2 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | L270 A271 S276 V277 M278 | L270-A274 WeakPolarHBondContact O-CB 3.47Å; L270-A274 PolarHBondContact O-N 3.18Å; A271-A274 PolarHBondContact O-N 2.83Å; A274-S276 VanDerWaalsContact C-N 3.34Å; A274-S276 PolarHBondContact O-N 2.83Å; A274-V277 PolarHBondContact O-N 3.18Å; A274-M278 HydrophobicContact CB-CE 4.43Å; A274-M278 WeakPolarHBondContact O-CB 3.2Å; A274-M278 WeakPolarHBondContact O-CE 3.33Å; A274-M278 VanDerWaalsContact O-CG 3.26Å; A274-M278 WeakPolarHBondContact O-CG 3.33Å; A274-M278 PolarHBondContact O-N 3.08Å |
| 275 | V | 87.9 | Confident | 87.7 | Confident | 59 Ų | 59 | 74.8 Ų | 74.8 | 36% | 0.358 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -61.5 | -41.7 | 176 | 171.3 | 0 | 0 | 0 | 0 | 111.7 | A271 S272 G273 M278 K279 | A271-V275 VanDerWaalsContact O-CG2 3.31Å; A271-V275 WeakPolarHBondContact O-CG2 3.29Å; A271-V275 PolarHBondContact O-N 3.43Å; S272-V275 PolarHBondContact O-N 2.87Å; G273-V275 VanDerWaalsContact C-N 3.33Å; G273-V275 PolarHBondContact O-N 2.9Å; V275-M278 HydrophobicContact CG2-CE 4.11Å; V275-K279 HydrophobicContact CG1-CD 4.26Å; V275-K279 WeakPolarHBondContact O-CB 3.27Å; V275-K279 WeakPolarHBondContact O-CG 3.38Å; V275-K279 PolarHBondContact O-N 3.38Å |
| 276 | S | 85.9 | Confident | 86 | Confident | 18 Ų | 18 | 79.8 Ų | 79.8 | 13% | 0.126 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -63.4 | -43.2 | 177.4 | -65.8 | 0 | 0 | 0 | 0 | 112.6 | R92 E162 S272 G273 A274 K280 | R92-S276 PolarHBondContact NH1-OG 3.49Å; R92-S276 PolarHBondContact NH2-OG 3.49Å; E162-S276 WeakPolarHBondContact OE2-CB 3.39Å; E162-S276 PolarHBondContact OE2-OG 2.87Å; S272-S276 PolarHBondContact O-N 3.49Å; S272-S276 PolarHBondContact O-OG 3.37Å; S272-S276 VanDerWaalsContact O-OG 3.05Å; G273-S276 WeakPolarHBondContact O-CB 3.09Å; G273-S276 PolarHBondContact O-N 3.27Å; G273-S276 VanDerWaalsContact O-N 3.15Å; A274-S276 VanDerWaalsContact C-N 3.34Å; A274-S276 PolarHBondContact O-N 2.83Å; S276-K280 WeakPolarHBondContact O-CG 3.3Å; S276-K280 PolarHBondContact O-N 2.95Å |
| 277 | V | 84.8 | Confident | 83.9 | Confident | 57 Ų | 57 | 83.4 Ų | 83.4 | 35% | 0.345 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -67.2 | -47.8 | 177.5 | 173.6 | 0 | 0 | 0 | 0 | 110.5 | G273 A274 K279 K280 C281 | G273-V277 WeakPolarHBondContact O-CG2 3.34Å; G273-V277 PolarHBondContact O-N 2.87Å; A274-V277 PolarHBondContact O-N 3.18Å; V277-K279 VanDerWaalsContact C-N 3.31Å; V277-K279 PolarHBondContact O-N 2.84Å; V277-K280 PolarHBondContact O-N 2.91Å; V277-C281 PolarHBondContact O-N 2.94Å; V277-C281 PolarHBondContact O-SG 3.36Å; V277-C281 VanDerWaalsContact O-SG 3.4Å |
| 278 | M | 85.1 | Confident | 81.5 | Confident | 108 Ų | 108 | 87.4 Ų | 87.4 | 53% | 0.532 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -57.8 | -41.6 | 178.1 | -73.9 | -173.5 | -67.5 | 0 | 0 | 112.5 | A274 V275 K280 C281 R282 | A274-M278 HydrophobicContact CB-CE 4.43Å; A274-M278 WeakPolarHBondContact O-CB 3.2Å; A274-M278 WeakPolarHBondContact O-CE 3.33Å; A274-M278 VanDerWaalsContact O-CG 3.26Å; A274-M278 WeakPolarHBondContact O-CG 3.33Å; A274-M278 PolarHBondContact O-N 3.08Å; V275-M278 HydrophobicContact CG2-CE 4.11Å; M278-K280 VanDerWaalsContact C-N 3.34Å; M278-K280 PolarHBondContact O-N 3.4Å; M278-C281 PolarHBondContact O-N 3.45Å; M278-R282 WeakPolarHBondContact O-CG 3.33Å; M278-R282 PolarHBondContact O-N 3.49Å |
| 279 | K | 84.9 | Confident | 79 | Confident | 138 Ų | 138 | 87.6 Ų | 87.6 | 60% | 0.6 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -63.5 | -38.5 | 175.6 | -76.9 | -179.6 | 179.7 | -177.3 | 0 | 112.5 | V275 V277 K283 | V275-K279 HydrophobicContact CG1-CD 4.26Å; V275-K279 WeakPolarHBondContact O-CB 3.27Å; V275-K279 WeakPolarHBondContact O-CG 3.38Å; V275-K279 PolarHBondContact O-N 3.38Å; V277-K279 VanDerWaalsContact C-N 3.31Å; V277-K279 PolarHBondContact O-N 2.84Å; K279-K283 WeakPolarHBondContact O-CB 3.31Å; K279-K283 PolarHBondContact O-N 3.48Å |
| 280 | K | 81.8 | Confident | 76.5 | Confident | 86 Ų | 86 | 91.7 Ų | 91.7 | 37% | 0.374 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -68.5 | -42.1 | 176.4 | -75.6 | 179 | 178.2 | 174.7 | 0 | 111.5 | S158 T159 S276 V277 M278 K283 L284 | S158-K280 PolarHBondContact O-NZ 2.69Å; T159-K280 PolarHBondContact OG1-NZ 3.44Å; S276-K280 WeakPolarHBondContact O-CG 3.3Å; S276-K280 PolarHBondContact O-N 2.95Å; V277-K280 PolarHBondContact O-N 2.91Å; M278-K280 VanDerWaalsContact C-N 3.34Å; M278-K280 PolarHBondContact O-N 3.4Å; K280-K283 PolarHBondContact O-N 3.42Å; K280-L284 WeakPolarHBondContact O-CG 3.36Å; K280-L284 PolarHBondContact O-N 3.01Å |
| 281 | C | 80.1 | Confident | 73.9 | Confident | 64 Ų | 64 | 92 Ų | 92 | 43% | 0.432 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -61.8 | -48 | 175.9 | -67.3 | 0 | 0 | 0 | 0 | 111.9 | V277 M278 K283 L284 E285 | V277-C281 PolarHBondContact O-N 2.94Å; V277-C281 PolarHBondContact O-SG 3.36Å; V277-C281 VanDerWaalsContact O-SG 3.4Å; M278-C281 PolarHBondContact O-N 3.45Å; C281-K283 VanDerWaalsContact C-N 3.31Å; C281-K283 PolarHBondContact O-N 2.9Å; C281-L284 WeakPolarHBondContact O-CA 3.5Å; C281-L284 WeakPolarHBondContact O-CB 3.38Å; C281-L284 PolarHBondContact O-N 3.04Å; C281-E285 PolarHBondContact O-N 3.4Å |
| 282 | R | 82.8 | Confident | 71.4 | Confident | 177 Ų | 177 | 97.4 Ų | 97.4 | 67% | 0.668 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -59.3 | -40.5 | 177 | -76.1 | -177.3 | 172.5 | -177.1 | -2.1 | 113 | M278 L284 E285 D286 | M278-R282 WeakPolarHBondContact O-CG 3.33Å; M278-R282 PolarHBondContact O-N 3.49Å; R282-L284 PolarHBondContact O-N 3.35Å; R282-E285 PolarHBondContact O-N 3.26Å; R282-E285 VanDerWaalsContact O-N 3.09Å; R282-D286 PolarHBondContact O-N 3.31Å |
| 283 | K | 80.3 | Confident | 69.3 | Low | 174 Ų | 174 | 102.2 Ų | 102.2 | 76% | 0.757 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -66.3 | -23.5 | 177.5 | -161.6 | 176.9 | -178.2 | -176.5 | 0 | 113 | K279 K280 C281 | K279-K283 WeakPolarHBondContact O-CB 3.31Å; K279-K283 PolarHBondContact O-N 3.48Å; K280-K283 PolarHBondContact O-N 3.42Å; C281-K283 VanDerWaalsContact C-N 3.31Å; C281-K283 PolarHBondContact O-N 2.9Å |
| 284 | L | 73.9 | Confident | 67.2 | Low | 134 Ų | 134 | 108.1 Ų | 108.1 | 70% | 0.702 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -82.8 | -19.2 | 173.9 | -73.2 | 160.8 | 0 | 0 | 0 | 112.9 | K280 C281 R282 P287 | K280-L284 WeakPolarHBondContact O-CG 3.36Å; K280-L284 PolarHBondContact O-N 3.01Å; C281-L284 WeakPolarHBondContact O-CA 3.5Å; C281-L284 WeakPolarHBondContact O-CB 3.38Å; C281-L284 PolarHBondContact O-N 3.04Å; R282-L284 PolarHBondContact O-N 3.35Å; L284-P287 WeakPolarHBondContact O-CD 3.43Å; L284-P287 VanDerWaalsContact O-CG 3.28Å; L284-P287 WeakPolarHBondContact O-CG 3.5Å |
| 285 | E | 70.1 | Confident | 65 | Low | 151 Ų | 151 | 111.7 Ų | 111.7 | 71% | 0.706 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -85.6 | -27.1 | 174.9 | -68.8 | 172.1 | 140.9 | 0 | 0 | 112.7 | C281 R282 P287 | C281-E285 PolarHBondContact O-N 3.4Å; R282-E285 PolarHBondContact O-N 3.26Å; R282-E285 VanDerWaalsContact O-N 3.09Å; E285-P287 WeakPolarHBondContact O-CD 3.48Å |
| 286 | D | 62.5 | Low | 62.5 | Low | 113 Ų | 113 | 118.5 Ų | 118.5 | 60% | 0.604 | 65% | 0.645 | S | S | * | * | G | 310 helix | trans | -82 | 10.8 | 176.4 | -83.1 | -32.1 | 0 | 0 | 0 | 119.8 | R282 Q288 | R282-D286 PolarHBondContact O-N 3.31Å; D286-Q288 PolarHBondContact O-N 3.04Å |
| 287 | P | 54.6 | Low | 61.3 | Low | 80 Ų | 80 | 123.6 Ų | 123.6 | 52% | 0.519 | 67% | 0.671 | S | S | . | * | G | 310 helix | trans | -64.7 | -17.8 | 176.3 | -23.7 | 33.4 | 0 | 0 | 0 | 115.7 | L284 E285 | L284-P287 WeakPolarHBondContact O-CD 3.43Å; L284-P287 VanDerWaalsContact O-CG 3.28Å; L284-P287 WeakPolarHBondContact O-CG 3.5Å; E285-P287 WeakPolarHBondContact O-CD 3.48Å |
| 288 | Q | 47.2 | Very low | 60.1 | Low | 177 Ų | 177 | 127.1 Ų | 127.1 | 83% | 0.827 | 69% | 0.688 | S | S | * | * | G | 310 helix | trans | -85.9 | -8.8 | -172.2 | -78 | -163.7 | -43.8 | 0 | 0 | 115.7 | D286 | D286-Q288 PolarHBondContact O-N 3.04Š|
| 289 | S | 43.7 | Very low | 58.7 | Low | 83 Ų | 83 | 128.1 Ų | 128.1 | 58% | 0.58 | 70% | 0.697 | S | S | * | * | S | Bend | trans | -88.4 | -17.2 | 179.6 | 71.2 | 0 | 0 | 0 | 0 | 114.2 | ||
| 290 | S | 44.2 | Very low | 57.2 | Low | 94 Ų | 94 | 127.5 Ų | 127.5 | 66% | 0.657 | 70% | 0.703 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.1 | -4.4 | -176 | -62.1 | 0 | 0 | 0 | 0 | 114.4 | ||
| 291 | S | 40.1 | Very low | 55.7 | Low | 92 Ų | 92 | 130.1 Ų | 130.1 | 64% | 0.643 | 72% | 0.723 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.4 | -3.7 | 179.4 | -48.7 | 0 | 0 | 0 | 0 | 114.3 | ||
| 292 | Q | 39.8 | Very low | 54 | Low | 168 Ų | 168 | 134.5 Ų | 134.5 | 79% | 0.785 | 74% | 0.743 | S | S | * | * | S | Bend | trans | -99.8 | 1.7 | -178.4 | -87.1 | -166.8 | -19.8 | 0 | 0 | 115.2 | ||
| 293 | V | 46.6 | Very low | 52 | Low | 129 Ų | 129 | 131.5 Ų | 131.5 | 78% | 0.782 | 75% | 0.748 | S | S | * | * | S | Bend | trans | -98.1 | -1.1 | -176 | -173.8 | 0 | 0 | 0 | 0 | 113.5 | ||
| 294 | T | 45.9 | Very low | 49.8 | Very low | 127 Ų | 127 | 128.2 Ų | 128.2 | 78% | 0.779 | 75% | 0.747 | S | S | * | * | S | Bend | trans | -111.8 | 19 | -177.3 | 1 | 0 | 0 | 0 | 0 | 115.9 | ||
| 295 | T | 43 | Very low | 47.8 | Very low | 117 Ų | 117 | 127.8 Ų | 127.8 | 72% | 0.718 | 75% | 0.751 | S | S | * | * | trans | -138.4 | 84.6 | 170.5 | 50.1 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 296 | S | 35.8 | Very low | 45.8 | Very low | 202 Ų | 202 | 125.6 Ų | 125.6 | 100% | 1.413 | 76% | 0.755 | S | S | * | * | trans | -169.7 | 0 | 142.9 | -77.1 | 0 | 0 | 0 | 0 | 109.4 |
Retrieved 296 of 296 residues in 126 ms
(Link to these results)