| 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 | 38.3 | Very low | 44 | Very low | 242 Ų | 242 | 163.9 Ų | 163.9 | 100% | 1.192 | 82% | 0.823 | S | S | * | * | 0 | 107.4 | 0 | -152.4 | 168.4 | 171.9 | 0 | 0 | 106.6 | |||||
| 2 | R | 32 | Very low | 44.5 | Very low | 243 Ų | 243 | 161.5 Ų | 161.5 | 92% | 0.917 | 81% | 0.813 | S | S | * | * | trans | -70.4 | 127.7 | -174.1 | -82.1 | 177.1 | 170.7 | 169.2 | -3.7 | 109.7 | V4 | R2-V4 PolarHBondContact O-N 3.35Š| ||
| 3 | I | 36.2 | Very low | 45.7 | Very low | 162 Ų | 162 | 160.6 Ų | 160.6 | 83% | 0.831 | 81% | 0.807 | S | S | * | * | trans | -76 | 113.4 | 168.7 | -62.8 | 171.7 | 0 | 0 | 0 | 106.9 | ||||
| 4 | V | 36.3 | Very low | 46.6 | Very low | 123 Ų | 123 | 155.1 Ų | 155.1 | 75% | 0.745 | 78% | 0.781 | S | S | * | * | trans | -82.9 | 110 | 173 | 177 | 0 | 0 | 0 | 0 | 107.1 | R2 Q6 | R2-V4 PolarHBondContact O-N 3.35Å; V4-Q6 PolarHBondContact O-N 3.32Å | ||
| 5 | L | 39.8 | Very low | 47.4 | Very low | 156 Ų | 156 | 148.8 Ų | 148.8 | 82% | 0.817 | 75% | 0.75 | S | S | * | * | trans | -72.7 | 106.6 | 166 | -85.3 | 158 | 0 | 0 | 0 | 108.1 | L7 | L5-L7 PolarHBondContact O-N 3.37Š| ||
| 6 | Q | 39.4 | Very low | 48 | Very low | 185 Ų | 185 | 144.8 Ų | 144.8 | 86% | 0.864 | 74% | 0.736 | S | S | * | * | trans | -72.4 | 104.5 | 173.2 | -135.1 | 164 | -13.3 | 0 | 0 | 107.7 | V4 A8 | V4-Q6 PolarHBondContact O-N 3.32Å; Q6-A8 PolarHBondContact O-N 3.08Å; Q6-A8 VanDerWaalsContact O-N 3.09Å | ||
| 7 | L | 41.6 | Very low | 48.8 | Very low | 163 Ų | 163 | 144.8 Ų | 144.8 | 85% | 0.853 | 73% | 0.729 | S | S | * | * | trans | -64.1 | 109.7 | 170.6 | -115.4 | 90.2 | 0 | 0 | 0 | 108 | L5 K9 | L5-L7 PolarHBondContact O-N 3.37Å; L7-K9 PolarHBondContact O-N 3.32Å; L7-K9 VanDerWaalsContact O-N 3.16Å | ||
| 8 | A | 51.7 | Low | 49.3 | Very low | 88 Ų | 88 | 141.2 Ų | 141.2 | 73% | 0.727 | 71% | 0.712 | S | S | * | * | trans | -60.1 | 116.8 | 168.4 | 0 | 0 | 0 | 0 | 0 | 108.3 | Q6 M10 | Q6-A8 PolarHBondContact O-N 3.08Å; Q6-A8 VanDerWaalsContact O-N 3.09Å; A8-M10 PolarHBondContact O-N 3.15Å | ||
| 9 | K | 52.5 | Low | 49.7 | Very low | 209 Ų | 209 | 140.6 Ų | 140.6 | 91% | 0.909 | 70% | 0.704 | S | S | * | * | trans | -68.4 | 95.6 | 172.8 | -77.8 | 180 | 176.2 | 177.8 | 0 | 108.3 | L7 | L7-K9 PolarHBondContact O-N 3.32Å; L7-K9 VanDerWaalsContact O-N 3.16Å | ||
| 10 | M | 52.2 | Low | 50 | Low | 116 Ų | 116 | 137 Ų | 137 | 57% | 0.571 | 69% | 0.693 | S | S | * | * | trans | -65.7 | 129.6 | 168.9 | -73.3 | 173.6 | 62.3 | 0 | 0 | 109.2 | A8 I15 I18 | A8-M10 PolarHBondContact O-N 3.15Å; M10-I15 HydrophobicContact CB-CG1 4.49Å; M10-I15 HydrophobicContact CE-CG1 4.21Å; M10-I18 HydrophobicContact CE-CD1 3.65Å | ||
| 11 | N | 63.4 | Low | 50.1 | Low | 116 Ų | 116 | 137.6 Ų | 137.6 | 62% | 0.62 | 70% | 0.697 | S | S | * | * | trans | -77.8 | 149.2 | -177.7 | -129.5 | -10.3 | 0 | 0 | 0 | 110 | M13 D14 I15 | N11-M13 PolarHBondContact O-N 2.8Å; N11-M13 VanDerWaalsContact O-N 3.1Å; N11-D14 WeakPolarHBondContact CB-OD2 3.18Å; N11-D14 PolarHBondContact N-OD2 3.46Å; N11-D14 WeakPolarHBondContact O-CB 3.25Å; N11-D14 PolarHBondContact O-N 2.96Å; N11-I15 PolarHBondContact O-N 3.43Å | ||
| 12 | L | 50.6 | Low | 50.8 | Low | 135 Ų | 135 | 132 Ų | 132 | 71% | 0.707 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -58.7 | -27.5 | -177.7 | -165.7 | 71.9 | 0 | 0 | 0 | 112.8 | T16 | L12-T16 PolarHBondContact O-N 3.13Å; L12-T16 VanDerWaalsContact O-N 3.11Å; L12-T16 PolarHBondContact O-OG1 2.89Å |
| 13 | M | 59.7 | Low | 51.2 | Low | 150 Ų | 150 | 125.3 Ų | 125.3 | 74% | 0.739 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -70.1 | -30 | 173.3 | -77.8 | 179.9 | 172.8 | 0 | 0 | 113.8 | N11 T16 K17 | N11-M13 PolarHBondContact O-N 2.8Å; N11-M13 VanDerWaalsContact O-N 3.1Å; M13-T16 VanDerWaalsContact CA-OG1 3.24Å; M13-T16 WeakPolarHBondContact CA-OG1 3.31Å; M13-T16 PolarHBondContact O-OG1 3.25Å; M13-T16 VanDerWaalsContact O-OG1 3.14Å; M13-K17 PolarHBondContact O-N 3.14Å; M13-K17 VanDerWaalsContact O-N 3.13Å |
| 14 | D | 58.9 | Low | 51.7 | Low | 83 Ų | 83 | 121.1 Ų | 121.1 | 44% | 0.444 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -77.2 | -36.5 | 177.1 | -61.6 | -43.5 | 0 | 0 | 0 | 110.6 | N11 K17 I18 | N11-D14 WeakPolarHBondContact CB-OD2 3.18Å; N11-D14 PolarHBondContact N-OD2 3.46Å; N11-D14 WeakPolarHBondContact O-CB 3.25Å; N11-D14 PolarHBondContact O-N 2.96Å; D14-K17 PolarHBondContact O-N 3.49Å; D14-I18 WeakPolarHBondContact O-CB 3.48Å; D14-I18 WeakPolarHBondContact O-CD1 3.44Å; D14-I18 WeakPolarHBondContact O-CG1 3.38Å; D14-I18 PolarHBondContact O-N 3.09Å |
| 15 | I | 59 | Low | 51.9 | Low | 61 Ų | 61 | 121 Ų | 121 | 31% | 0.313 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -64.5 | -45.7 | 174.2 | -64.3 | 172.2 | 0 | 0 | 0 | 110.2 | M10 N11 K17 I18 F19 | M10-I15 HydrophobicContact CB-CG1 4.49Å; M10-I15 HydrophobicContact CE-CG1 4.21Å; N11-I15 PolarHBondContact O-N 3.43Å; I15-K17 PolarHBondContact O-N 2.98Å; I15-I18 PolarHBondContact O-N 3.16Å; I15-F19 HydrophobicContact CG2-CD2 3.58Å; I15-F19 HydrophobicContact CG2-CE2 3.54Å; I15-F19 WeakPolarHBondContact O-CD2 3.24Å; I15-F19 PolarHBondContact O-N 3.25Å |
| 16 | T | 56.5 | Low | 52.2 | Low | 85 Ų | 85 | 120.2 Ų | 120.2 | 52% | 0.521 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -65.2 | -35.9 | 177.5 | 33.3 | 0 | 0 | 0 | 0 | 112.9 | L12 M13 F19 S20 | L12-T16 PolarHBondContact O-N 3.13Å; L12-T16 VanDerWaalsContact O-N 3.11Å; L12-T16 PolarHBondContact O-OG1 2.89Å; M13-T16 VanDerWaalsContact CA-OG1 3.24Å; M13-T16 WeakPolarHBondContact CA-OG1 3.31Å; M13-T16 PolarHBondContact O-OG1 3.25Å; M13-T16 VanDerWaalsContact O-OG1 3.14Å; T16-F19 PolarHBondContact O-N 3.2Å; T16-S20 PolarHBondContact O-N 3.38Å; T16-S20 PolarHBondContact O-OG 2.69Å |
| 17 | K | 60.8 | Low | 52.4 | Low | 144 Ų | 144 | 119.5 Ų | 119.5 | 63% | 0.626 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -65.5 | -40.4 | 171.4 | -88.3 | -178 | 176.5 | 178.9 | 0 | 113.4 | M13 D14 I15 F19 S20 L21 | M13-K17 PolarHBondContact O-N 3.14Å; M13-K17 VanDerWaalsContact O-N 3.13Å; D14-K17 PolarHBondContact O-N 3.49Å; I15-K17 PolarHBondContact O-N 2.98Å; K17-F19 VanDerWaalsContact C-N 3.34Å; K17-S20 VanDerWaalsContact CA-OG 3.25Å; K17-S20 WeakPolarHBondContact CA-OG 3.42Å; K17-S20 PolarHBondContact O-N 2.68Å; K17-S20 PolarHBondContact O-OG 2.8Å; K17-L21 VanDerWaalsContact O-CG 3.31Å; K17-L21 WeakPolarHBondContact O-CG 3.46Å; K17-L21 PolarHBondContact O-N 3.39Å; K17-L21 VanDerWaalsContact O-N 3.08Å |
| 18 | I | 59.2 | Low | 52.5 | Low | 80 Ų | 80 | 118.3 Ų | 118.3 | 41% | 0.41 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -64.4 | -41.3 | 174.7 | -69.7 | 163.2 | 0 | 0 | 0 | 110.2 | M10 D14 I15 L21 L22 | M10-I18 HydrophobicContact CE-CD1 3.65Å; D14-I18 WeakPolarHBondContact O-CB 3.48Å; D14-I18 WeakPolarHBondContact O-CD1 3.44Å; D14-I18 WeakPolarHBondContact O-CG1 3.38Å; D14-I18 PolarHBondContact O-N 3.09Å; I15-I18 PolarHBondContact O-N 3.16Å; I18-L21 PolarHBondContact O-N 3.03Å; I18-L22 HydrophobicContact CG2-CD1 3.85Å; I18-L22 WeakPolarHBondContact O-CD1 3.35Å; I18-L22 WeakPolarHBondContact O-CG 3.4Å; I18-L22 PolarHBondContact O-N 3.29Å; I18-L22 VanDerWaalsContact O-N 3.15Å |
| 19 | F | 55.8 | Low | 52.3 | Low | 130 Ų | 130 | 119.2 Ų | 119.2 | 57% | 0.57 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -67.8 | -34.1 | 175.4 | -85.9 | -72.2 | 0 | 0 | 0 | 113.3 | I15 T16 K17 L21 L22 Q23 | I15-F19 HydrophobicContact CG2-CD2 3.58Å; I15-F19 HydrophobicContact CG2-CE2 3.54Å; I15-F19 WeakPolarHBondContact O-CD2 3.24Å; I15-F19 PolarHBondContact O-N 3.25Å; T16-F19 PolarHBondContact O-N 3.2Å; K17-F19 VanDerWaalsContact C-N 3.34Å; F19-L21 VanDerWaalsContact C-N 3.34Å; F19-L22 PolarHBondContact O-N 3.14Å; F19-Q23 PolarHBondContact O-N 3Å |
| 20 | S | 56.2 | Low | 52.3 | Low | 69 Ų | 69 | 114.9 Ų | 114.9 | 48% | 0.483 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -71.7 | -26.6 | 173.9 | 52.5 | 0 | 0 | 0 | 0 | 113.5 | T16 K17 L22 | T16-S20 PolarHBondContact O-N 3.38Å; T16-S20 PolarHBondContact O-OG 2.69Å; K17-S20 VanDerWaalsContact CA-OG 3.25Å; K17-S20 WeakPolarHBondContact CA-OG 3.42Å; K17-S20 PolarHBondContact O-N 2.68Å; K17-S20 PolarHBondContact O-OG 2.8Å; S20-L22 VanDerWaalsContact C-N 3.33Å |
| 21 | L | 52.8 | Low | 52.4 | Low | 149 Ų | 149 | 112.8 Ų | 112.8 | 78% | 0.78 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -82.1 | -12.6 | 173.7 | -70.8 | 166 | 0 | 0 | 0 | 113.1 | K17 I18 F19 | K17-L21 VanDerWaalsContact O-CG 3.31Å; K17-L21 WeakPolarHBondContact O-CG 3.46Å; K17-L21 PolarHBondContact O-N 3.39Å; K17-L21 VanDerWaalsContact O-N 3.08Å; I18-L21 PolarHBondContact O-N 3.03Å; F19-L21 VanDerWaalsContact C-N 3.34Å |
| 22 | L | 51.7 | Low | 52.4 | Low | 125 Ų | 125 | 109.6 Ų | 109.6 | 65% | 0.654 | 56% | 0.559 | S | S | * | * | S | Bend | trans | -99.8 | -5.5 | 175.9 | -78.8 | 163.8 | 0 | 0 | 0 | 112.8 | I18 F19 S20 | I18-L22 HydrophobicContact CG2-CD1 3.85Å; I18-L22 WeakPolarHBondContact O-CD1 3.35Å; I18-L22 WeakPolarHBondContact O-CG 3.4Å; I18-L22 PolarHBondContact O-N 3.29Å; I18-L22 VanDerWaalsContact O-N 3.15Å; F19-L22 PolarHBondContact O-N 3.14Å; S20-L22 VanDerWaalsContact C-N 3.33Å |
| 23 | Q | 42.1 | Very low | 53.7 | Low | 103 Ų | 103 | 106.5 Ų | 106.5 | 48% | 0.481 | 55% | 0.545 | S | S | . | . | S | Bend | trans | -80.5 | 125.4 | 169.6 | -76.4 | 179.3 | 9.9 | 0 | 0 | 107.7 | F19 D25 | F19-Q23 PolarHBondContact O-N 3Å; Q23-D25 PolarHBondContact O-N 3.03Å |
| 24 | P | 46 | Very low | 54.9 | Low | 74 Ų | 74 | 105.6 Ų | 105.6 | 48% | 0.481 | 54% | 0.539 | S | S | . | . | trans | -54.7 | 139.6 | 167.1 | 23.4 | -30.3 | 0 | 0 | 0 | 108.4 | K26 E29 | P24-K26 PolarHBondContact O-N 3.34Å; P24-E29 HydrophobicContact CB-CG 4.36Å; P24-E29 HydrophobicContact CG-CG 4.5Å; P24-E29 WeakPolarHBondContact CG-OE1 3.45Å | ||
| 25 | D | 41 | Very low | 56.4 | Low | 121 Ų | 121 | 102 Ų | 102 | 65% | 0.647 | 52% | 0.52 | S | S | * | . | trans | -55.1 | 110.7 | -178.3 | -74.3 | -48 | 0 | 0 | 0 | 109.4 | Q23 E27 E28 E29 | Q23-D25 PolarHBondContact O-N 3.03Å; D25-E27 PolarHBondContact O-N 3.02Å; D25-E28 PolarHBondContact O-N 3.28Å; D25-E29 PolarHBondContact O-N 3.09Å | ||
| 26 | K | 45.1 | Very low | 57.8 | Low | 138 Ų | 138 | 101.4 Ų | 101.4 | 60% | 0.6 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -58.9 | -22 | -172.7 | -71.5 | -176.7 | 177 | -179.5 | 0 | 113.8 | P24 D30 | P24-K26 PolarHBondContact O-N 3.34Å; K26-D30 PolarHBondContact O-N 3.23Å |
| 27 | E | 43.6 | Very low | 59.4 | Low | 170 Ų | 170 | 103.1 Ų | 103.1 | 79% | 0.794 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -77.9 | -28.4 | 178.8 | -64.5 | -177.2 | 177.8 | 0 | 0 | 112.8 | D25 T31 | D25-E27 PolarHBondContact O-N 3.02Å; E27-T31 PolarHBondContact O-OG1 2.87Å |
| 28 | E | 43.5 | Very low | 60.9 | Low | 139 Ų | 139 | 97.8 Ų | 97.8 | 65% | 0.65 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -80.9 | -32 | 173 | -68.2 | -168.6 | 165.1 | 0 | 0 | 111.6 | D25 T31 D32 | D25-E28 PolarHBondContact O-N 3.28Å; E28-T31 PolarHBondContact O-OG1 3.09Å; E28-D32 WeakPolarHBondContact O-CB 3.2Å; E28-D32 PolarHBondContact O-N 2.83Å |
| 29 | E | 47.1 | Very low | 62.6 | Low | 106 Ų | 106 | 94 Ų | 94 | 50% | 0.495 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -69.4 | -35.8 | 174.3 | -81.7 | -170.8 | 153.8 | 0 | 0 | 113.4 | P24 D25 T33 | P24-E29 HydrophobicContact CB-CG 4.36Å; P24-E29 HydrophobicContact CG-CG 4.5Å; P24-E29 WeakPolarHBondContact CG-OE1 3.45Å; D25-E29 PolarHBondContact O-N 3.09Å; E29-T33 WeakPolarHBondContact O-CB 3.47Å; E29-T33 PolarHBondContact O-N 2.9Å; E29-T33 PolarHBondContact O-OG1 3.3Å |
| 30 | D | 52.4 | Low | 64.4 | Low | 119 Ų | 119 | 88.8 Ų | 88.8 | 64% | 0.636 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -72.4 | -39.6 | -177.8 | -100.3 | -18.9 | 0 | 0 | 0 | 112.7 | K26 T33 | K26-D30 PolarHBondContact O-N 3.23Å; D30-T33 WeakPolarHBondContact O-CB 3.28Å; D30-T33 PolarHBondContact O-N 2.69Å |
| 31 | T | 54.8 | Low | 66.1 | Low | 72 Ų | 72 | 89.6 Ų | 89.6 | 44% | 0.442 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -70.9 | -49.1 | -179.3 | 50.1 | 0 | 0 | 0 | 0 | 111.8 | E27 E28 T33 E34 | E27-T31 PolarHBondContact O-OG1 2.87Å; E28-T31 PolarHBondContact O-OG1 3.09Å; T31-T33 PolarHBondContact O-N 3.46Å; T31-E34 WeakPolarHBondContact O-CB 3.3Å; T31-E34 PolarHBondContact O-N 3.32Å |
| 32 | D | 64.4 | Low | 68.2 | Low | 48 Ų | 48 | 82.8 Ų | 82.8 | 26% | 0.257 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -57.6 | -22.3 | 176.4 | -78.7 | 7.6 | 0 | 0 | 0 | 113.5 | E28 E35 K36 F63 | E28-D32 WeakPolarHBondContact O-CB 3.2Å; E28-D32 PolarHBondContact O-N 2.83Å; D32-E35 WeakPolarHBondContact CA-OE2 3.45Å; D32-K36 WeakPolarHBondContact O-CD 3.45Å; D32-K36 WeakPolarHBondContact O-CE 3.37Å; D32-K36 WeakPolarHBondContact O-CG 3.18Å; D32-K36 PolarHBondContact O-N 3.35Å; D32-F63 HydrophobicContact CB-CE1 4.11Å; D32-F63 HydrophobicContact CB-CZ 3.85Å; D32-F63 WeakPolarHBondContact OD1-CZ 3.35Å; D32-F63 WeakPolarHBondContact OD2-CZ 3.28Å |
| 33 | T | 76.3 | Confident | 70.3 | Confident | 70 Ų | 70 | 76.9 Ų | 76.9 | 43% | 0.429 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -73.9 | -36 | 175.5 | -61.2 | 0 | 0 | 0 | 0 | 111.3 | E29 D30 T31 Q37 | E29-T33 WeakPolarHBondContact O-CB 3.47Å; E29-T33 PolarHBondContact O-N 2.9Å; E29-T33 PolarHBondContact O-OG1 3.3Å; D30-T33 WeakPolarHBondContact O-CB 3.28Å; D30-T33 PolarHBondContact O-N 2.69Å; T31-T33 PolarHBondContact O-N 3.46Å; T33-Q37 WeakPolarHBondContact O-CB 3.26Å; T33-Q37 PolarHBondContact O-N 3.49Å |
| 34 | E | 85.2 | Confident | 72.8 | Confident | 131 Ų | 131 | 78.3 Ų | 78.3 | 61% | 0.612 | 39% | 0.391 | S | S | * | . | H | α-helix | trans | -66.1 | -44.9 | 177.5 | -64.7 | -171.9 | 167.4 | 0 | 0 | 112 | T31 Q37 A38 | T31-E34 WeakPolarHBondContact O-CB 3.3Å; T31-E34 PolarHBondContact O-N 3.32Å; E34-Q37 PolarHBondContact O-N 3.03Å; E34-A38 WeakPolarHBondContact O-CB 3.45Å; E34-A38 PolarHBondContact O-N 3.03Å |
| 35 | E | 90.3 | Very high | 75.2 | Confident | 9 Ų | 9 | 79.3 Ų | 79.3 | 4% | 0.042 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -67.2 | -41.7 | 179.1 | -71.1 | 102.9 | 165.3 | 0 | 0 | 112.8 | D32 Q37 A38 L39 R59 Y60 F63 | D32-E35 WeakPolarHBondContact CA-OE2 3.45Å; E35-Q37 VanDerWaalsContact C-N 3.3Å; E35-Q37 PolarHBondContact O-N 2.97Å; E35-A38 PolarHBondContact O-N 3.45Å; E35-L39 WeakPolarHBondContact O-CG 3.4Å; E35-L39 PolarHBondContact O-N 3.25Å; E35-R59 IonicContact OE1-CZ 3.94Å; E35-R59 IonicContact OE1-NE 2.83Å; E35-R59 PolarHBondContact OE1-NE 3.28Å; E35-R59 IonicContact OE1-NH2 3.84Å; E35-R59 PolarHBondContact OE1-NH2 3.15Å; E35-Y60 HydrophobicContact CB-CD1 3.55Å; E35-Y60 HydrophobicContact CB-CE1 3.74Å; E35-Y60 HydrophobicContact CB-CG 4.42Å; E35-Y60 HydrophobicContact CG-CD1 3.6Å; E35-Y60 HydrophobicContact CG-CE1 3.46Å; E35-Y60 VanDerWaalsContact CG-CE1 3.46Å; E35-Y60 HydrophobicContact CG-CG 4.24Å; E35-F63 HydrophobicContact CB-CD2 3.69Å; E35-F63 HydrophobicContact CB-CE2 4.02Å; E35-F63 HydrophobicContact CG-CD2 4.46Å; E35-F63 HydrophobicContact CG-CE2 4.44Å |
| 36 | K | 89.8 | Confident | 77.8 | Confident | 47 Ų | 47 | 77.1 Ų | 77.1 | 20% | 0.204 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -60.1 | -43.7 | 174.5 | -70.6 | 166.8 | -162.8 | 157.7 | 0 | 110.5 | D32 L39 N40 F63 | D32-K36 WeakPolarHBondContact O-CD 3.45Å; D32-K36 WeakPolarHBondContact O-CE 3.37Å; D32-K36 WeakPolarHBondContact O-CG 3.18Å; D32-K36 PolarHBondContact O-N 3.35Å; K36-L39 PolarHBondContact O-N 3.38Å; K36-N40 WeakPolarHBondContact O-CB 3.47Å; K36-N40 VanDerWaalsContact O-CG 3.28Å; K36-N40 PolarHBondContact O-N 2.89Å; K36-N40 PolarHBondContact O-ND2 2.91Å; K36-F63 HydrophobicContact CD-CD1 4.34Å; K36-F63 HydrophobicContact CG-CB 3.92Å; K36-F63 HydrophobicContact CG-CD1 4.09Å; K36-F63 HydrophobicContact CG-CG 3.98Å |
| 37 | Q | 89.6 | Confident | 80.4 | Confident | 121 Ų | 121 | 73.5 Ų | 73.5 | 57% | 0.565 | 37% | 0.368 | S | S | * | . | H | α-helix | trans | -66.2 | -41.6 | 178.7 | -174.3 | 170.9 | -6.5 | 0 | 0 | 111.7 | T33 E34 E35 N40 Q41 | T33-Q37 WeakPolarHBondContact O-CB 3.26Å; T33-Q37 PolarHBondContact O-N 3.49Å; E34-Q37 PolarHBondContact O-N 3.03Å; E35-Q37 VanDerWaalsContact C-N 3.3Å; E35-Q37 PolarHBondContact O-N 2.97Å; Q37-N40 PolarHBondContact O-N 3.11Å; Q37-Q41 VanDerWaalsContact O-CB 3.23Å; Q37-Q41 WeakPolarHBondContact O-CB 3.43Å; Q37-Q41 PolarHBondContact O-N 3.25Å |
| 38 | A | 93 | Very high | 82.9 | Confident | 32 Ų | 32 | 67.1 Ų | 67.1 | 26% | 0.264 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -62.2 | -43.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | E34 E35 Q41 A42 L54 Y60 | E34-A38 WeakPolarHBondContact O-CB 3.45Å; E34-A38 PolarHBondContact O-N 3.03Å; E35-A38 PolarHBondContact O-N 3.45Å; A38-Q41 PolarHBondContact O-N 2.78Å; A38-A42 WeakPolarHBondContact O-CB 3.37Å; A38-A42 PolarHBondContact O-N 2.94Å; A38-L54 HydrophobicContact CB-CD1 4.3Å; A38-Y60 HydrophobicContact CB-CE1 3.93Å |
| 39 | L | 94.5 | Very high | 85.5 | Confident | 0 Ų | 0 | 67.8 Ų | 67.8 | 0% | 0 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -60.8 | -47.3 | 174.7 | -72.1 | 176.2 | 0 | 0 | 0 | 111.5 | E35 K36 Q41 A42 V43 L51 L54 L55 Y60 F63 P76 | E35-L39 WeakPolarHBondContact O-CG 3.4Å; E35-L39 PolarHBondContact O-N 3.25Å; K36-L39 PolarHBondContact O-N 3.38Å; L39-Q41 VanDerWaalsContact C-N 3.34Å; L39-Q41 PolarHBondContact O-N 3.39Å; L39-A42 PolarHBondContact O-N 3.41Å; L39-V43 WeakPolarHBondContact O-CG2 3.29Å; L39-V43 PolarHBondContact O-N 3.25Å; L39-L51 HydrophobicContact CD2-CD1 3.78Å; L39-L54 HydrophobicContact CD2-CB 3.96Å; L39-L54 HydrophobicContact CD2-CD1 4.33Å; L39-L55 HydrophobicContact CD1-CD2 4.29Å; L39-L55 HydrophobicContact CD2-CD2 3.66Å; L39-L55 HydrophobicContact CD2-CG 3.92Å; L39-Y60 HydrophobicContact CD2-CD1 4.42Å; L39-Y60 HydrophobicContact CG-CD1 4.19Å; L39-F63 HydrophobicContact CD1-CB 4.17Å; L39-P76 HydrophobicContact CB-CG 4.39Å |
| 40 | N | 92.1 | Very high | 88 | Confident | 22 Ų | 22 | 65.4 Ų | 65.4 | 12% | 0.118 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -65.5 | -37.7 | 178.8 | -72 | -15 | 0 | 0 | 0 | 112.6 | K36 Q37 V43 Y44 S68 L79 | K36-N40 WeakPolarHBondContact O-CB 3.47Å; K36-N40 VanDerWaalsContact O-CG 3.28Å; K36-N40 PolarHBondContact O-N 2.89Å; K36-N40 PolarHBondContact O-ND2 2.91Å; Q37-N40 PolarHBondContact O-N 3.11Å; N40-V43 PolarHBondContact O-N 3.02Å; N40-Y44 VanDerWaalsContact O-CB 3.27Å; N40-Y44 WeakPolarHBondContact O-CB 3.42Å; N40-Y44 PolarHBondContact O-N 3.27Å; N40-S68 PolarHBondContact ND2-OG 2.92Å; N40-L79 HydrophobicContact CB-CD1 3.97Å; N40-L79 WeakPolarHBondContact OD1-CD1 3.19Å |
| 41 | Q | 93.1 | Very high | 90.1 | Very high | 86 Ų | 86 | 59.7 Ų | 59.7 | 40% | 0.402 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -65.8 | -45.8 | 178.6 | -171.7 | 60.6 | 47.3 | 0 | 0 | 110.3 | Q37 A38 L39 V43 Y44 D45 | Q37-Q41 VanDerWaalsContact O-CB 3.23Å; Q37-Q41 WeakPolarHBondContact O-CB 3.43Å; Q37-Q41 PolarHBondContact O-N 3.25Å; A38-Q41 PolarHBondContact O-N 2.78Å; L39-Q41 VanDerWaalsContact C-N 3.34Å; L39-Q41 PolarHBondContact O-N 3.39Å; Q41-V43 VanDerWaalsContact C-N 3.28Å; Q41-V43 PolarHBondContact O-N 3.17Å; Q41-Y44 PolarHBondContact O-N 3.02Å; Q41-Y44 VanDerWaalsContact O-N 3.11Å; Q41-D45 WeakPolarHBondContact CG-OD2 3.19Å; Q41-D45 PolarHBondContact NE2-OD1 3.1Å; Q41-D45 PolarHBondContact NE2-OD2 3.44Å; Q41-D45 WeakPolarHBondContact O-CB 3.29Å; Q41-D45 PolarHBondContact O-N 3.37Å |
| 42 | A | 96.7 | Very high | 92.2 | Very high | 6 Ų | 6 | 57.9 Ų | 57.9 | 5% | 0.05 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -59.5 | -39.6 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112 | A38 L39 N46 D47 T50 L51 L54 | A38-A42 WeakPolarHBondContact O-CB 3.37Å; A38-A42 PolarHBondContact O-N 2.94Å; L39-A42 PolarHBondContact O-N 3.41Å; A42-N46 PolarHBondContact O-N 2.91Å; A42-D47 PolarHBondContact O-N 3.07Å; A42-T50 HydrophobicContact CB-CG2 4.4Å; A42-L51 HydrophobicContact CB-CB 4.08Å; A42-L51 HydrophobicContact CB-CD1 4.28Å; A42-L54 HydrophobicContact CB-CD1 4.22Å |
| 43 | V | 96 | Very high | 93.8 | Very high | 0 Ų | 0 | 59 Ų | 59 | 0% | 0 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -64.3 | -48.3 | 172.4 | 173.1 | 0 | 0 | 0 | 0 | 111.1 | L39 N40 Q41 D45 N46 L51 P76 L79 A80 H85 L92 | L39-V43 WeakPolarHBondContact O-CG2 3.29Å; L39-V43 PolarHBondContact O-N 3.25Å; N40-V43 PolarHBondContact O-N 3.02Å; Q41-V43 VanDerWaalsContact C-N 3.28Å; Q41-V43 PolarHBondContact O-N 3.17Å; V43-D45 VanDerWaalsContact C-N 3.3Å; V43-D45 PolarHBondContact O-N 3.44Å; V43-N46 WeakPolarHBondContact O-CA 3.47Å; V43-N46 PolarHBondContact O-N 3.33Å; V43-L51 HydrophobicContact CG2-CD1 4.03Å; V43-L51 HydrophobicContact CG2-CD2 3.68Å; V43-P76 HydrophobicContact CG2-CB 4.18Å; V43-L79 HydrophobicContact CG1-CB 3.87Å; V43-A80 HydrophobicContact CG1-CB 3.79Å; V43-H85 PolarHBondContact O-CD2 3.16Å; V43-L92 HydrophobicContact CG2-CD1 3.98Å |
| 44 | Y | 93.5 | Very high | 94.8 | Very high | 134 Ų | 134 | 56.8 Ų | 56.8 | 53% | 0.525 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -60.1 | -38.6 | -178.6 | -179.1 | -89.7 | 0 | 0 | 0 | 112.6 | N40 Q41 N46 Y83 | N40-Y44 VanDerWaalsContact O-CB 3.27Å; N40-Y44 WeakPolarHBondContact O-CB 3.42Å; N40-Y44 PolarHBondContact O-N 3.27Å; Q41-Y44 PolarHBondContact O-N 3.02Å; Q41-Y44 VanDerWaalsContact O-N 3.11Å; Y44-N46 PolarHBondContact O-N 3.28Å; Y44-Y83 AromaticContact CD2-CE2 3.92Å; Y44-Y83 HydrophobicContact CD2-CE2 3.92Å; Y44-Y83 AromaticContact CD2-CZ 3.83Å; Y44-Y83 AromaticContact CE2-CZ 3.95Å; Y44-Y83 WeakPolarHBondContact CE2-OH 3.28Å |
| 45 | D | 96.2 | Very high | 95.4 | Very high | 95 Ų | 95 | 50.6 Ų | 50.6 | 51% | 0.508 | 25% | 0.249 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -79.5 | 0.5 | 176.7 | -63.7 | -30.2 | 0 | 0 | 0 | 112.6 | Q41 V43 D47 | Q41-D45 WeakPolarHBondContact CG-OD2 3.19Å; Q41-D45 PolarHBondContact NE2-OD1 3.1Å; Q41-D45 PolarHBondContact NE2-OD2 3.44Å; Q41-D45 WeakPolarHBondContact O-CB 3.29Å; Q41-D45 PolarHBondContact O-N 3.37Å; V43-D45 VanDerWaalsContact C-N 3.3Å; V43-D45 PolarHBondContact O-N 3.44Å; D45-D47 PolarHBondContact O-N 3.25Å |
| 46 | N | 97.4 | Very high | 95.7 | Very high | 75 Ų | 75 | 56.7 Ų | 56.7 | 40% | 0.401 | 27% | 0.272 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 54.9 | 32 | -174.2 | -167 | 31.3 | 0 | 0 | 0 | 113.1 | A42 V43 Y44 S48 H85 | A42-N46 PolarHBondContact O-N 2.91Å; V43-N46 WeakPolarHBondContact O-CA 3.47Å; V43-N46 PolarHBondContact O-N 3.33Å; Y44-N46 PolarHBondContact O-N 3.28Å; N46-S48 PolarHBondContact O-N 3.45Å; N46-H85 VanDerWaalsContact OD1-CB 3.22Å; N46-H85 WeakPolarHBondContact OD1-CB 3.32Å; N46-H85 VanDerWaalsContact OD1-CG 3.29Å; N46-H85 PolarHBondContact OD1-ND1 3.28Å |
| 47 | D | 97.9 | Very high | 96 | Very high | 61 Ų | 61 | 58.6 Ų | 58.6 | 33% | 0.326 | 28% | 0.282 | S | S | . | . | trans | -92.9 | 80.7 | -179.8 | -171 | -10.3 | 0 | 0 | 0 | 111 | A42 D45 Y49 T50 L51 | A42-D47 PolarHBondContact O-N 3.07Å; D45-D47 PolarHBondContact O-N 3.25Å; D47-Y49 PolarHBondContact O-N 2.97Å; D47-Y49 PolarHBondContact OD1-N 2.93Å; D47-Y49 VanDerWaalsContact OD1-N 3.16Å; D47-T50 VanDerWaalsContact CG-CB 3.42Å; D47-T50 PolarHBondContact O-N 3.03Å; D47-T50 PolarHBondContact OD1-N 2.99Å; D47-T50 PolarHBondContact OD1-OG1 3.19Å; D47-T50 WeakPolarHBondContact OD2-CB 3.43Å; D47-T50 PolarHBondContact OD2-OG1 2.79Å; D47-L51 VanDerWaalsContact O-CB 3.28Å; D47-L51 WeakPolarHBondContact O-CB 3.4Å; D47-L51 PolarHBondContact O-N 3.02Å | ||
| 48 | S | 97.9 | Very high | 96.1 | Very high | 36 Ų | 36 | 59.4 Ų | 59.4 | 25% | 0.252 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -62.1 | -27.1 | 177.6 | 62.2 | 0 | 0 | 0 | 0 | 113.8 | N46 D52 | N46-S48 PolarHBondContact O-N 3.45Å; S48-D52 VanDerWaalsContact O-CB 3.29Å; S48-D52 WeakPolarHBondContact O-CB 3.32Å; S48-D52 PolarHBondContact O-N 3.35Å |
| 49 | Y | 98 | Very high | 96.1 | Very high | 154 Ų | 154 | 62.8 Ų | 62.8 | 60% | 0.604 | 29% | 0.292 | S | S | * | . | H | α-helix | trans | -72.6 | -50.9 | 179.8 | 175.2 | -95.3 | 0 | 0 | 0 | 110.5 | D47 L51 D52 Q53 | D47-Y49 PolarHBondContact O-N 2.97Å; D47-Y49 PolarHBondContact OD1-N 2.93Å; D47-Y49 VanDerWaalsContact OD1-N 3.16Å; Y49-L51 VanDerWaalsContact C-N 3.29Å; Y49-L51 PolarHBondContact O-N 3.35Å; Y49-D52 PolarHBondContact O-N 3.47Å; Y49-Q53 HydrophobicContact CD1-CG 4.43Å; Y49-Q53 HydrophobicContact CE1-CG 4.03Å; Y49-Q53 WeakPolarHBondContact O-CG 3.34Å; Y49-Q53 PolarHBondContact O-N 2.91Å |
| 50 | T | 97.9 | Very high | 96.1 | Very high | 55 Ų | 55 | 64.2 Ų | 64.2 | 34% | 0.337 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -61.7 | -42.3 | 176 | -64.3 | 0 | 0 | 0 | 0 | 110.4 | A42 D47 D52 Q53 L54 | A42-T50 HydrophobicContact CB-CG2 4.4Å; D47-T50 VanDerWaalsContact CG-CB 3.42Å; D47-T50 PolarHBondContact O-N 3.03Å; D47-T50 PolarHBondContact OD1-N 2.99Å; D47-T50 PolarHBondContact OD1-OG1 3.19Å; D47-T50 WeakPolarHBondContact OD2-CB 3.43Å; D47-T50 PolarHBondContact OD2-OG1 2.79Å; T50-D52 VanDerWaalsContact C-N 3.33Å; T50-D52 PolarHBondContact O-N 2.84Å; T50-Q53 PolarHBondContact O-N 3.1Å; T50-Q53 VanDerWaalsContact O-N 3.17Å; T50-L54 HydrophobicContact CG2-CD1 4.12Å; T50-L54 HydrophobicContact CG2-CG 4.28Å; T50-L54 VanDerWaalsContact O-CG 3.29Å; T50-L54 WeakPolarHBondContact O-CG 3.36Å; T50-L54 PolarHBondContact O-N 2.94Å |
| 51 | L | 98.1 | Very high | 96.2 | Very high | 0 Ų | 0 | 67 Ų | 67 | 0% | 0 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -56.4 | -45.7 | 176.2 | -176.2 | 61.3 | 0 | 0 | 0 | 112.5 | L39 A42 V43 D47 Y49 L54 L55 C88 V91 L92 | L39-L51 HydrophobicContact CD2-CD1 3.78Å; A42-L51 HydrophobicContact CB-CB 4.08Å; A42-L51 HydrophobicContact CB-CD1 4.28Å; V43-L51 HydrophobicContact CG2-CD1 4.03Å; V43-L51 HydrophobicContact CG2-CD2 3.68Å; D47-L51 VanDerWaalsContact O-CB 3.28Å; D47-L51 WeakPolarHBondContact O-CB 3.4Å; D47-L51 PolarHBondContact O-N 3.02Å; Y49-L51 VanDerWaalsContact C-N 3.29Å; Y49-L51 PolarHBondContact O-N 3.35Å; L51-L54 PolarHBondContact O-N 3.4Å; L51-L55 HydrophobicContact CD1-CD1 4.03Å; L51-L55 HydrophobicContact CD1-CG 4.39Å; L51-L55 HydrophobicContact CG-CD1 3.97Å; L51-L55 WeakPolarHBondContact O-CG 3.38Å; L51-L55 PolarHBondContact O-N 3.45Å; L51-C88 HydrophobicContact CD2-CB 3.73Å; L51-V91 HydrophobicContact CD2-CG1 4.31Å; L51-V91 HydrophobicContact CG-CG1 4.16Å; L51-L92 HydrophobicContact CD1-CD2 4.37Å; L51-L92 HydrophobicContact CD2-CD1 4.15Å; L51-L92 HydrophobicContact CD2-CD2 4.28Å; L51-L92 HydrophobicContact CD2-CG 3.89Å |
| 52 | D | 98.3 | Very high | 96.1 | Very high | 33 Ų | 33 | 70.1 Ų | 70.1 | 18% | 0.176 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -64.4 | -40 | 177.1 | -178.9 | 47.3 | 0 | 0 | 0 | 112.1 | S48 Y49 T50 L55 R56 V91 H95 | S48-D52 VanDerWaalsContact O-CB 3.29Å; S48-D52 WeakPolarHBondContact O-CB 3.32Å; S48-D52 PolarHBondContact O-N 3.35Å; Y49-D52 PolarHBondContact O-N 3.47Å; T50-D52 VanDerWaalsContact C-N 3.33Å; T50-D52 PolarHBondContact O-N 2.84Å; D52-L55 PolarHBondContact O-N 3.34Å; D52-R56 VanDerWaalsContact CG-NH1 3.33Å; D52-R56 WeakPolarHBondContact O-CG 3.4Å; D52-R56 PolarHBondContact O-N 3.38Å; D52-R56 VanDerWaalsContact O-N 3.16Å; D52-R56 IonicContact OD1-CZ 3.77Å; D52-R56 IonicContact OD1-NH1 3.78Å; D52-R56 IonicContact OD1-NH2 3.54Å; D52-R56 IonicContact OD2-CZ 3.05Å; D52-R56 IonicContact OD2-NH1 2.69Å; D52-R56 PolarHBondContact OD2-NH1 2.89Å; D52-R56 IonicContact OD2-NH2 2.68Å; D52-R56 PolarHBondContact OD2-NH2 2.67Å; D52-V91 HydrophobicContact CB-CG1 3.76Å; D52-V91 HydrophobicContact CB-CG2 4.3Å; D52-H95 IonicContact OD1-CD2 3.18Å; D52-H95 IonicContact OD1-CE1 3.75Å; D52-H95 IonicContact OD1-NE2 2.8Å; D52-H95 PolarHBondContact OD1-NE2 2.95Å |
| 53 | Q | 97.8 | Very high | 96 | Very high | 72 Ų | 72 | 70.5 Ų | 70.5 | 34% | 0.336 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -65.3 | -37.6 | 174.5 | -64.8 | -55.7 | -23.6 | 0 | 0 | 113.1 | Y49 T50 R56 Q57 | Y49-Q53 HydrophobicContact CD1-CG 4.43Å; Y49-Q53 HydrophobicContact CE1-CG 4.03Å; Y49-Q53 WeakPolarHBondContact O-CG 3.34Å; Y49-Q53 PolarHBondContact O-N 2.91Å; T50-Q53 PolarHBondContact O-N 3.1Å; T50-Q53 VanDerWaalsContact O-N 3.17Å; Q53-R56 VanDerWaalsContact CD-NH1 3.34Å; Q53-Q57 PolarHBondContact O-NE2 3.43Å |
| 54 | L | 97 | Very high | 95.9 | Very high | 23 Ų | 23 | 70.9 Ų | 70.9 | 12% | 0.12 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -65.1 | -48.6 | 175.2 | -66.6 | 174.3 | 0 | 0 | 0 | 110.3 | A38 L39 A42 T50 L51 R56 Q57 Y60 | A38-L54 HydrophobicContact CB-CD1 4.3Å; L39-L54 HydrophobicContact CD2-CB 3.96Å; L39-L54 HydrophobicContact CD2-CD1 4.33Å; A42-L54 HydrophobicContact CB-CD1 4.22Å; T50-L54 HydrophobicContact CG2-CD1 4.12Å; T50-L54 HydrophobicContact CG2-CG 4.28Å; T50-L54 VanDerWaalsContact O-CG 3.29Å; T50-L54 WeakPolarHBondContact O-CG 3.36Å; T50-L54 PolarHBondContact O-N 2.94Å; L51-L54 PolarHBondContact O-N 3.4Å; L54-R56 VanDerWaalsContact C-N 3.28Å; L54-R56 PolarHBondContact O-N 3.02Å; L54-Q57 WeakPolarHBondContact O-CB 3.18Å; L54-Q57 PolarHBondContact O-N 3.23Å; L54-Y60 HydrophobicContact CB-CD1 4.31Å; L54-Y60 HydrophobicContact CB-CD2 4.25Å; L54-Y60 HydrophobicContact CB-CG 4.09Å; L54-Y60 HydrophobicContact CD2-CD1 4.29Å; L54-Y60 HydrophobicContact CD2-CD2 4.21Å; L54-Y60 HydrophobicContact CD2-CE1 3.85Å; L54-Y60 HydrophobicContact CD2-CE2 3.78Å; L54-Y60 HydrophobicContact CD2-CG 4.47Å; L54-Y60 WeakPolarHBondContact O-CB 3.17Å; L54-Y60 WeakPolarHBondContact O-CD2 3.19Å |
| 55 | L | 97.3 | Very high | 95.9 | Very high | 1 Ų | 1 | 67.8 Ų | 67.8 | 1% | 0.005 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -69.7 | -18.8 | -175.6 | -69.4 | 170.3 | 0 | 0 | 0 | 114.6 | L39 L51 D52 Q57 I64 V91 L92 H95 | L39-L55 HydrophobicContact CD1-CD2 4.29Å; L39-L55 HydrophobicContact CD2-CD2 3.66Å; L39-L55 HydrophobicContact CD2-CG 3.92Å; L51-L55 HydrophobicContact CD1-CD1 4.03Å; L51-L55 HydrophobicContact CD1-CG 4.39Å; L51-L55 HydrophobicContact CG-CD1 3.97Å; L51-L55 WeakPolarHBondContact O-CG 3.38Å; L51-L55 PolarHBondContact O-N 3.45Å; D52-L55 PolarHBondContact O-N 3.34Å; L55-Q57 PolarHBondContact O-N 3.32Å; L55-I64 HydrophobicContact CD1-CD1 4.28Å; L55-I64 HydrophobicContact CD2-CB 4.15Å; L55-I64 HydrophobicContact CD2-CD1 3.97Å; L55-I64 HydrophobicContact CD2-CG1 3.98Å; L55-V91 HydrophobicContact CD1-CG1 4.07Å; L55-L92 HydrophobicContact CD1-CD2 3.85Å; L55-H95 HydrophobicContact CB-CB 4.24Å; L55-H95 HydrophobicContact CD1-CB 4.11Å |
| 56 | R | 96.8 | Very high | 95.5 | Very high | 137 Ų | 137 | 64.7 Ų | 64.7 | 52% | 0.517 | 30% | 0.297 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -64.4 | -22.1 | 168.2 | -78.5 | -172.5 | -177.8 | 88.2 | 14.6 | 113.6 | D52 Q53 L54 | D52-R56 VanDerWaalsContact CG-NH1 3.33Å; D52-R56 WeakPolarHBondContact O-CG 3.4Å; D52-R56 PolarHBondContact O-N 3.38Å; D52-R56 VanDerWaalsContact O-N 3.16Å; D52-R56 IonicContact OD1-CZ 3.77Å; D52-R56 IonicContact OD1-NH1 3.78Å; D52-R56 IonicContact OD1-NH2 3.54Å; D52-R56 IonicContact OD2-CZ 3.05Å; D52-R56 IonicContact OD2-NH1 2.69Å; D52-R56 PolarHBondContact OD2-NH1 2.89Å; D52-R56 IonicContact OD2-NH2 2.68Å; D52-R56 PolarHBondContact OD2-NH2 2.67Å; Q53-R56 VanDerWaalsContact CD-NH1 3.34Å; L54-R56 VanDerWaalsContact C-N 3.28Å; L54-R56 PolarHBondContact O-N 3.02Å |
| 57 | Q | 96.1 | Very high | 95 | Very high | 88 Ų | 88 | 66 Ų | 66 | 41% | 0.411 | 30% | 0.297 | S | S | . | . | S | Bend | trans | -93.5 | 126 | 179.6 | -58.9 | 168.8 | 54.6 | 0 | 0 | 109.7 | Q53 L54 L55 R59 Y60 K61 | Q53-Q57 PolarHBondContact O-NE2 3.43Å; L54-Q57 WeakPolarHBondContact O-CB 3.18Å; L54-Q57 PolarHBondContact O-N 3.23Å; L55-Q57 PolarHBondContact O-N 3.32Å; Q57-R59 HydrophobicContact CB-CG 4.27Å; Q57-R59 PolarHBondContact O-N 2.89Å; Q57-Y60 HydrophobicContact CB-CD2 3.97Å; Q57-Y60 PolarHBondContact O-N 3.43Å; Q57-K61 PolarHBondContact O-N 3.05Å; Q57-K61 VanDerWaalsContact O-N 3.14Å |
| 58 | E | 92.4 | Very high | 94 | Very high | 137 Ų | 137 | 64.3 Ų | 64.3 | 64% | 0.64 | 29% | 0.289 | S | S | * | . | H | α-helix | trans | -54.4 | -30.7 | -177.5 | -71 | -61.9 | 155.5 | 0 | 0 | 113.3 | Y60 K61 R62 | E58-Y60 VanDerWaalsContact C-N 3.29Å; E58-Y60 PolarHBondContact O-N 3.34Å; E58-K61 PolarHBondContact O-N 2.99Å; E58-R62 PolarHBondContact O-N 3.29Å |
| 59 | R | 93.7 | Very high | 92.5 | Very high | 104 Ų | 104 | 65.4 Ų | 65.4 | 39% | 0.392 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -60.8 | -34.5 | 178 | 73 | 179.5 | -75.8 | -157.9 | -0.8 | 113.5 | E35 Q57 R62 F63 | E35-R59 IonicContact OE1-CZ 3.94Å; E35-R59 IonicContact OE1-NE 2.83Å; E35-R59 PolarHBondContact OE1-NE 3.28Å; E35-R59 IonicContact OE1-NH2 3.84Å; E35-R59 PolarHBondContact OE1-NH2 3.15Å; Q57-R59 HydrophobicContact CB-CG 4.27Å; Q57-R59 PolarHBondContact O-N 2.89Å; R59-R62 VanDerWaalsContact O-CG 3.3Å; R59-R62 WeakPolarHBondContact O-CG 3.49Å; R59-R62 PolarHBondContact O-NE 3.16Å; R59-F63 VanDerWaalsContact O-CD2 3.26Å; R59-F63 WeakPolarHBondContact O-CD2 3.5Å; R59-F63 VanDerWaalsContact O-CE2 3.28Å; R59-F63 WeakPolarHBondContact O-CE2 3.19Å |
| 60 | Y | 93.8 | Very high | 90.3 | Very high | 30 Ų | 30 | 71 Ų | 71 | 12% | 0.118 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -90.3 | -36.5 | 177.2 | -65 | -86.3 | 0 | 0 | 0 | 111 | E35 A38 L39 L54 Q57 E58 R62 F63 | E35-Y60 HydrophobicContact CB-CD1 3.55Å; E35-Y60 HydrophobicContact CB-CE1 3.74Å; E35-Y60 HydrophobicContact CB-CG 4.42Å; E35-Y60 HydrophobicContact CG-CD1 3.6Å; E35-Y60 HydrophobicContact CG-CE1 3.46Å; E35-Y60 VanDerWaalsContact CG-CE1 3.46Å; E35-Y60 HydrophobicContact CG-CG 4.24Å; A38-Y60 HydrophobicContact CB-CE1 3.93Å; L39-Y60 HydrophobicContact CD2-CD1 4.42Å; L39-Y60 HydrophobicContact CG-CD1 4.19Å; L54-Y60 HydrophobicContact CB-CD1 4.31Å; L54-Y60 HydrophobicContact CB-CD2 4.25Å; L54-Y60 HydrophobicContact CB-CG 4.09Å; L54-Y60 HydrophobicContact CD2-CD1 4.29Å; L54-Y60 HydrophobicContact CD2-CD2 4.21Å; L54-Y60 HydrophobicContact CD2-CE1 3.85Å; L54-Y60 HydrophobicContact CD2-CE2 3.78Å; L54-Y60 HydrophobicContact CD2-CG 4.47Å; L54-Y60 WeakPolarHBondContact O-CB 3.17Å; L54-Y60 WeakPolarHBondContact O-CD2 3.19Å; Q57-Y60 HydrophobicContact CB-CD2 3.97Å; Q57-Y60 PolarHBondContact O-N 3.43Å; E58-Y60 VanDerWaalsContact C-N 3.29Å; E58-Y60 PolarHBondContact O-N 3.34Å; Y60-R62 VanDerWaalsContact C-N 3.28Å; Y60-R62 PolarHBondContact O-N 2.92Å; Y60-F63 WeakPolarHBondContact O-CA 3.33Å; Y60-F63 PolarHBondContact O-N 3.47Å |
| 61 | K | 93.7 | Very high | 88.8 | Confident | 79 Ų | 79 | 71.6 Ų | 71.6 | 34% | 0.343 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -56.7 | -38.4 | -176.5 | -169.2 | 174.9 | 179.6 | 179.8 | 0 | 113.2 | Q57 E58 F63 I64 | Q57-K61 PolarHBondContact O-N 3.05Å; Q57-K61 VanDerWaalsContact O-N 3.14Å; E58-K61 PolarHBondContact O-N 2.99Å; K61-F63 PolarHBondContact O-N 2.58Å; K61-F63 VanDerWaalsContact O-N 3.09Å; K61-I64 WeakPolarHBondContact O-CB 3.47Å; K61-I64 WeakPolarHBondContact O-CG2 3.09Å; K61-I64 PolarHBondContact O-N 3.44Å; K61-I64 VanDerWaalsContact O-N 3.09Å |
| 62 | R | 92.6 | Very high | 87.2 | Confident | 153 Ų | 153 | 74.6 Ų | 74.6 | 58% | 0.577 | 36% | 0.362 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.7 | -21.6 | 173.8 | 60.6 | -179.1 | 155.1 | 178.8 | -3.8 | 114.3 | E58 R59 Y60 | E58-R62 PolarHBondContact O-N 3.29Å; R59-R62 VanDerWaalsContact O-CG 3.3Å; R59-R62 WeakPolarHBondContact O-CG 3.49Å; R59-R62 PolarHBondContact O-NE 3.16Å; Y60-R62 VanDerWaalsContact C-N 3.28Å; Y60-R62 PolarHBondContact O-N 2.92Å |
| 63 | F | 92.9 | Very high | 86 | Confident | 14 Ų | 14 | 75 Ų | 75 | 6% | 0.061 | 37% | 0.365 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -100.5 | 4.5 | 179.7 | -58.2 | -59.8 | 0 | 0 | 0 | 114.2 | D32 E35 K36 L39 R59 Y60 K61 N65 S66 | D32-F63 HydrophobicContact CB-CE1 4.11Å; D32-F63 HydrophobicContact CB-CZ 3.85Å; D32-F63 WeakPolarHBondContact OD1-CZ 3.35Å; D32-F63 WeakPolarHBondContact OD2-CZ 3.28Å; E35-F63 HydrophobicContact CB-CD2 3.69Å; E35-F63 HydrophobicContact CB-CE2 4.02Å; E35-F63 HydrophobicContact CG-CD2 4.46Å; E35-F63 HydrophobicContact CG-CE2 4.44Å; K36-F63 HydrophobicContact CD-CD1 4.34Å; K36-F63 HydrophobicContact CG-CB 3.92Å; K36-F63 HydrophobicContact CG-CD1 4.09Å; K36-F63 HydrophobicContact CG-CG 3.98Å; L39-F63 HydrophobicContact CD1-CB 4.17Å; R59-F63 VanDerWaalsContact O-CD2 3.26Å; R59-F63 WeakPolarHBondContact O-CD2 3.5Å; R59-F63 VanDerWaalsContact O-CE2 3.28Å; R59-F63 WeakPolarHBondContact O-CE2 3.19Å; Y60-F63 WeakPolarHBondContact O-CA 3.33Å; Y60-F63 PolarHBondContact O-N 3.47Å; K61-F63 PolarHBondContact O-N 2.58Å; K61-F63 VanDerWaalsContact O-N 3.09Å; F63-N65 PolarHBondContact O-N 2.99Å; F63-N65 VanDerWaalsContact O-N 3.1Å; F63-S66 WeakPolarHBondContact CD1-OG 3.43Å; F63-S66 VanDerWaalsContact O-CB 3.32Å; F63-S66 WeakPolarHBondContact O-CB 3.26Å; F63-S66 PolarHBondContact O-N 3.32Å |
| 64 | I | 94.2 | Very high | 85.2 | Confident | 8 Ų | 8 | 71.7 Ų | 71.7 | 4% | 0.041 | 35% | 0.351 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -56.6 | -31.3 | -178.7 | -163.9 | 173.1 | 0 | 0 | 0 | 113.4 | L55 K61 P76 L92 H95 A97 | L55-I64 HydrophobicContact CD1-CD1 4.28Å; L55-I64 HydrophobicContact CD2-CB 4.15Å; L55-I64 HydrophobicContact CD2-CD1 3.97Å; L55-I64 HydrophobicContact CD2-CG1 3.98Å; K61-I64 WeakPolarHBondContact O-CB 3.47Å; K61-I64 WeakPolarHBondContact O-CG2 3.09Å; K61-I64 PolarHBondContact O-N 3.44Å; K61-I64 VanDerWaalsContact O-N 3.09Å; I64-P76 WeakPolarHBondContact O-CD 3.17Å; I64-L92 HydrophobicContact CD1-CD2 4.27Å; I64-L92 WeakPolarHBondContact CD1-O 3.29Å; I64-L92 HydrophobicContact CG1-CD2 3.91Å; I64-H95 HydrophobicContact CD1-CB 3.68Å; I64-A97 HydrophobicContact CD1-CB 3.96Å; I64-A97 HydrophobicContact CG1-CB 4.03Å |
| 65 | N | 93.1 | Very high | 85 | Confident | 68 Ų | 68 | 71 Ų | 71 | 36% | 0.364 | 35% | 0.348 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -105.6 | 5.9 | 178 | -64.8 | -37.8 | 0 | 0 | 0 | 112.9 | F63 A97 D98 | F63-N65 PolarHBondContact O-N 2.99Å; F63-N65 VanDerWaalsContact O-N 3.1Å; N65-A97 WeakPolarHBondContact OD1-CA 3.43Å; N65-D98 PolarHBondContact OD1-N 3.47Å |
| 66 | S | 89.5 | Confident | 84.9 | Confident | 31 Ų | 31 | 71 Ų | 71 | 22% | 0.217 | 35% | 0.348 | C | S | . | . | trans | -73.5 | 137 | 179.7 | -75.5 | 0 | 0 | 0 | 0 | 110.9 | F63 | F63-S66 WeakPolarHBondContact CD1-OG 3.43Å; F63-S66 VanDerWaalsContact O-CB 3.32Å; F63-S66 WeakPolarHBondContact O-CB 3.26Å; F63-S66 PolarHBondContact O-N 3.32Å | ||
| 67 | R | 85.3 | Confident | 84.9 | Confident | 103 Ų | 103 | 64.5 Ų | 64.5 | 39% | 0.389 | 32% | 0.323 | S | S | . | . | trans | -87.5 | 130.3 | 179.4 | -56.8 | -178.2 | 64.4 | 152.6 | 1 | 109 | P73 G74 T75 L102 | R67-P73 HydrophobicContact CB-CB 3.91Å; R67-P73 PolarHBondContact NE-O 3.4Å; R67-P73 PolarHBondContact NH2-O 3.3Å; R67-G74 WeakPolarHBondContact CA-O 3.41Å; R67-T75 HydrophobicContact CG-CG2 4.26Å; R67-L102 PolarHBondContact NH1-O 3.35Å | ||
| 68 | S | 77.6 | Confident | 84.9 | Confident | 24 Ų | 24 | 62.1 Ų | 62.1 | 17% | 0.168 | 31% | 0.311 | C | S | . | . | B | Isolated β-bridge | trans | -149.1 | 167.7 | -175.4 | 46 | 0 | 0 | 0 | 0 | 111.8 | N40 G74 | N40-S68 PolarHBondContact ND2-OG 2.92Å; S68-G74 PolarHBondContact N-O 2.92Å; S68-G74 PolarHBondContact O-N 3.49Å; S68-G74 VanDerWaalsContact O-N 3.16Å |
| 69 | G | 65.5 | Low | 85 | Confident | 59 Ų | 59 | 57.6 Ų | 57.6 | 61% | 0.608 | 29% | 0.291 | S | S | * | . | S | Bend | trans | 109.3 | 150.7 | -178.8 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||
| 70 | W | 52.8 | Low | 85.1 | Confident | 273 Ų | 273 | 52.7 Ų | 52.7 | 100% | 1.034 | 27% | 0.272 | S | S | * | . | S | Bend | trans | -81.3 | 110.4 | 170.2 | -88.2 | 87.6 | 0 | 0 | 0 | 109.3 | ||
| 71 | G | 66.6 | Low | 85.3 | Confident | 67 Ų | 67 | 51.2 Ų | 51.2 | 69% | 0.691 | 27% | 0.267 | S | S | * | . | S | Bend | trans | 130.3 | -123.1 | -178.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | P73 | G71-P73 WeakPolarHBondContact O-CD 3.28Š|
| 72 | V | 64.3 | Low | 85.4 | Confident | 63 Ų | 63 | 48.8 Ų | 48.8 | 38% | 0.382 | 26% | 0.26 | S | S | . | . | S | Bend | trans | -84.8 | 106.9 | 172.7 | 176.6 | 0 | 0 | 0 | 0 | 108.4 | G74 D103 V104 | V72-G74 PolarHBondContact O-N 2.93Å; V72-D103 HydrophobicContact CG1-CB 4.36Å; V72-D103 WeakPolarHBondContact CG1-OD2 3.28Å; V72-V104 HydrophobicContact CG1-CG2 3.77Å; V72-V104 HydrophobicContact CG2-CG2 4.36Å |
| 73 | P | 72.8 | Confident | 85.6 | Confident | 40 Ų | 40 | 46.5 Ų | 46.5 | 26% | 0.26 | 25% | 0.252 | S | S | . | . | trans | -61.8 | 123.3 | -177.3 | -20.3 | 33.3 | 0 | 0 | 0 | 110.2 | R67 G71 V104 | R67-P73 HydrophobicContact CB-CB 3.91Å; R67-P73 PolarHBondContact NE-O 3.4Å; R67-P73 PolarHBondContact NH2-O 3.3Å; G71-P73 WeakPolarHBondContact O-CD 3.28Å; P73-V104 HydrophobicContact CG-CG1 4.41Å | ||
| 74 | G | 81.1 | Confident | 85.8 | Confident | 4 Ų | 4 | 47 Ų | 47 | 4% | 0.041 | 26% | 0.26 | C | S | . | . | B | Isolated β-bridge | trans | -120.4 | 156.2 | -179.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | R67 S68 V72 | R67-G74 WeakPolarHBondContact CA-O 3.41Å; S68-G74 PolarHBondContact N-O 2.92Å; S68-G74 PolarHBondContact O-N 3.49Å; S68-G74 VanDerWaalsContact O-N 3.16Å; V72-G74 PolarHBondContact O-N 2.93Å |
| 75 | T | 92.7 | Very high | 86 | Confident | 7 Ų | 7 | 48.1 Ų | 48.1 | 4% | 0.043 | 27% | 0.265 | C | S | . | . | trans | -80.9 | 156.5 | 167 | 56.5 | 0 | 0 | 0 | 0 | 109.7 | R67 L77 R78 L79 S101 | R67-T75 HydrophobicContact CG-CG2 4.26Å; T75-L77 PolarHBondContact O-N 2.99Å; T75-R78 PolarHBondContact O-N 2.92Å; T75-R78 VanDerWaalsContact O-N 3.08Å; T75-R78 PolarHBondContact OG1-N 3.25Å; T75-L79 PolarHBondContact O-N 2.96Å; T75-S101 PolarHBondContact OG1-OG 3.34Å | ||
| 76 | P | 95.2 | Very high | 86.3 | Confident | 2 Ų | 2 | 47.2 Ų | 47.2 | 1% | 0.013 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -49.3 | -39.1 | 169.9 | -28.5 | 33.3 | 0 | 0 | 0 | 112.9 | L39 V43 I64 L79 A80 L92 | L39-P76 HydrophobicContact CB-CG 4.39Å; V43-P76 HydrophobicContact CG2-CB 4.18Å; I64-P76 WeakPolarHBondContact O-CD 3.17Å; P76-L79 PolarHBondContact O-N 2.97Å; P76-A80 PolarHBondContact O-N 3.45Å; P76-L92 HydrophobicContact CB-CD1 4Å; P76-L92 HydrophobicContact CB-CD2 3.75Å |
| 77 | L | 97.6 | Very high | 86.7 | Confident | 0 Ų | 0 | 48.6 Ų | 48.6 | 0% | 0 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -63.2 | -44.5 | 178.3 | -175.3 | 67.6 | 0 | 0 | 0 | 112.3 | T75 L79 A80 A81 L89 L92 L93 A97 D98 P109 L125 | T75-L77 PolarHBondContact O-N 2.99Å; L77-L79 VanDerWaalsContact C-N 3.34Å; L77-A80 PolarHBondContact O-N 3.29Å; L77-A81 WeakPolarHBondContact O-CB 3.47Å; L77-A81 PolarHBondContact O-N 3.49Å; L77-L89 HydrophobicContact CD1-CD1 4.3Å; L77-L89 HydrophobicContact CD1-CG 3.86Å; L77-L92 HydrophobicContact CB-CD1 4.47Å; L77-L92 HydrophobicContact CD1-CB 3.99Å; L77-L93 HydrophobicContact CD1-CD2 3.92Å; L77-L93 HydrophobicContact CD1-CG 3.85Å; L77-L93 HydrophobicContact CD2-CD2 3.91Å; L77-A97 HydrophobicContact CB-CB 4.13Å; L77-A97 HydrophobicContact CD1-CB 4.43Å; L77-A97 HydrophobicContact CD2-CB 4.04Å; L77-A97 HydrophobicContact CG-CB 4.43Å; L77-D98 WeakPolarHBondContact CD2-O 3.22Å; L77-P109 HydrophobicContact CD2-CB 4.3Å; L77-P109 HydrophobicContact CD2-CG 3.94Å; L77-P109 HydrophobicContact CG-CB 4.21Å; L77-P109 HydrophobicContact CG-CG 4.16Å; L77-L125 HydrophobicContact CD1-CD2 4.46Å; L77-L125 HydrophobicContact CD2-CD2 4.41Å |
| 78 | R | 94.9 | Very high | 87.3 | Confident | 39 Ų | 39 | 43.7 Ų | 43.7 | 15% | 0.147 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -63.3 | -40.7 | 174.5 | 176.8 | -167 | 146.3 | 113.6 | -9.9 | 111.6 | T75 A81 S82 D103 T112 | T75-R78 PolarHBondContact O-N 2.92Å; T75-R78 VanDerWaalsContact O-N 3.08Å; T75-R78 PolarHBondContact OG1-N 3.25Å; R78-A81 PolarHBondContact O-N 3.46Å; R78-S82 WeakPolarHBondContact O-CB 3.24Å; R78-S82 PolarHBondContact O-N 3.32Å; R78-D103 IonicContact CZ-OD2 3.79Å; R78-D103 IonicContact NH1-OD2 3.81Å; R78-D103 PolarHBondContact NH1-OD2 3.19Å; R78-D103 IonicContact NH2-OD2 3.17Å; R78-T112 HydrophobicContact CG-CG2 4.31Å |
| 79 | L | 94.5 | Very high | 88.3 | Confident | 42 Ų | 42 | 42.5 Ų | 42.5 | 22% | 0.22 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -60.8 | -48 | 176.9 | -72.4 | 172.7 | 0 | 0 | 0 | 110.7 | N40 V43 T75 P76 L77 A81 S82 Y83 | N40-L79 HydrophobicContact CB-CD1 3.97Å; N40-L79 WeakPolarHBondContact OD1-CD1 3.19Å; V43-L79 HydrophobicContact CG1-CB 3.87Å; T75-L79 PolarHBondContact O-N 2.96Å; P76-L79 PolarHBondContact O-N 2.97Å; L77-L79 VanDerWaalsContact C-N 3.34Å; L79-A81 VanDerWaalsContact C-N 3.28Å; L79-A81 PolarHBondContact O-N 3.13Å; L79-S82 WeakPolarHBondContact O-CB 3.47Å; L79-S82 PolarHBondContact O-N 3.25Å; L79-S82 VanDerWaalsContact O-N 3.07Å; L79-Y83 HydrophobicContact CD2-CE2 4.31Å; L79-Y83 WeakPolarHBondContact O-CD2 3.38Å; L79-Y83 PolarHBondContact O-N 3.32Å |
| 80 | A | 97.4 | Very high | 89.9 | Confident | 0 Ų | 0 | 44.2 Ų | 44.2 | 0% | 0 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -58.6 | -42 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | V43 P76 L77 S82 Y83 G84 H85 C88 L89 L92 | V43-A80 HydrophobicContact CG1-CB 3.79Å; P76-A80 PolarHBondContact O-N 3.45Å; L77-A80 PolarHBondContact O-N 3.29Å; A80-S82 PolarHBondContact O-N 3.04Å; A80-Y83 PolarHBondContact O-N 3.48Å; A80-G84 PolarHBondContact O-N 3.39Å; A80-H85 HydrophobicContact CB-CB 4.39Å; A80-H85 PolarHBondContact O-N 2.79Å; A80-C88 HydrophobicContact CB-CB 4.21Å; A80-L89 HydrophobicContact CB-CB 3.98Å; A80-L92 HydrophobicContact CB-CD1 4.07Å |
| 81 | A | 97.6 | Very high | 92.1 | Very high | 0 Ų | 0 | 32.4 Ų | 32.4 | 0% | 0 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -64.7 | -35.1 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | L77 R78 L79 L89 P109 A113 H118 L125 | L77-A81 WeakPolarHBondContact O-CB 3.47Å; L77-A81 PolarHBondContact O-N 3.49Å; R78-A81 PolarHBondContact O-N 3.46Å; L79-A81 VanDerWaalsContact C-N 3.28Å; L79-A81 PolarHBondContact O-N 3.13Å; A81-L89 HydrophobicContact CB-CD1 3.89Å; A81-P109 HydrophobicContact CB-CB 4.19Å; A81-A113 HydrophobicContact CB-CB 4.23Å; A81-H118 PolarHBondContact O-CD2 2.99Å; A81-L125 HydrophobicContact CB-CD1 4.37Å |
| 82 | S | 95.5 | Very high | 93.6 | Very high | 28 Ų | 28 | 29.2 Ų | 29.2 | 20% | 0.196 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -70.3 | -38.6 | 178.6 | -163.9 | 0 | 0 | 0 | 0 | 112.7 | R78 L79 A80 H116 H118 | R78-S82 WeakPolarHBondContact O-CB 3.24Å; R78-S82 PolarHBondContact O-N 3.32Å; L79-S82 WeakPolarHBondContact O-CB 3.47Å; L79-S82 PolarHBondContact O-N 3.25Å; L79-S82 VanDerWaalsContact O-N 3.07Å; A80-S82 PolarHBondContact O-N 3.04Å; S82-H116 PolarHBondContact OG-CE1 3.32Å; S82-H118 PolarHBondContact O-NE2 2.94Å |
| 83 | Y | 96 | Very high | 95.2 | Very high | 105 Ų | 105 | 27.6 Ų | 27.6 | 41% | 0.412 | 15% | 0.149 | S | C | . | . | H | α-helix | trans | -90.3 | -8.3 | -179.4 | -66.2 | -64.5 | 0 | 0 | 0 | 113.9 | Y44 L79 A80 H85 | Y44-Y83 AromaticContact CD2-CE2 3.92Å; Y44-Y83 HydrophobicContact CD2-CE2 3.92Å; Y44-Y83 AromaticContact CD2-CZ 3.83Å; Y44-Y83 AromaticContact CE2-CZ 3.95Å; Y44-Y83 WeakPolarHBondContact CE2-OH 3.28Å; L79-Y83 HydrophobicContact CD2-CE2 4.31Å; L79-Y83 WeakPolarHBondContact O-CD2 3.38Å; L79-Y83 PolarHBondContact O-N 3.32Å; A80-Y83 PolarHBondContact O-N 3.48Å; Y83-H85 VanDerWaalsContact C-N 3.34Å; Y83-H85 VanDerWaalsContact CB-CD2 3.41Å; Y83-H85 WeakPolarHBondContact CB-CD2 3.39Å; Y83-H85 WeakPolarHBondContact CB-NE2 3.19Å; Y83-H85 AromaticContact CG-NE2 3.83Å |
| 84 | G | 97.8 | Very high | 96.4 | Very high | 23 Ų | 23 | 29.9 Ų | 29.9 | 24% | 0.237 | 17% | 0.171 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 75.6 | 24 | -177.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | A80 L86 H118 | A80-G84 PolarHBondContact O-N 3.39Å; G84-L86 VanDerWaalsContact C-N 3.3Å; G84-L86 PolarHBondContact O-N 3.03Å; G84-H118 VanDerWaalsContact CA-CG 3.45Å; G84-H118 PolarHBondContact N-CD2 3.38Å; G84-H118 PolarHBondContact N-NE2 3.34Å |
| 85 | H | 98.4 | Very high | 97.2 | Very high | 32 Ų | 32 | 31.5 Ų | 31.5 | 15% | 0.148 | 18% | 0.178 | C | C | . | . | trans | -80.6 | 76.1 | -177.9 | -66.2 | -19.3 | 0 | 0 | 0 | 110.9 | V43 N46 A80 Y83 S87 C88 L89 | V43-H85 PolarHBondContact O-CD2 3.16Å; N46-H85 VanDerWaalsContact OD1-CB 3.22Å; N46-H85 WeakPolarHBondContact OD1-CB 3.32Å; N46-H85 VanDerWaalsContact OD1-CG 3.29Å; N46-H85 PolarHBondContact OD1-ND1 3.28Å; A80-H85 HydrophobicContact CB-CB 4.39Å; A80-H85 PolarHBondContact O-N 2.79Å; Y83-H85 VanDerWaalsContact C-N 3.34Å; Y83-H85 VanDerWaalsContact CB-CD2 3.41Å; Y83-H85 WeakPolarHBondContact CB-CD2 3.39Å; Y83-H85 WeakPolarHBondContact CB-NE2 3.19Å; Y83-H85 AromaticContact CG-NE2 3.83Å; H85-S87 PolarHBondContact O-N 3.41Å; H85-C88 HydrophobicContact CB-CB 4.08Å; H85-C88 PolarHBondContact O-N 2.61Å; H85-L89 WeakPolarHBondContact O-CB 3.38Å; H85-L89 PolarHBondContact O-N 2.85Å | ||
| 86 | L | 98.6 | Very high | 97.4 | Very high | 50 Ų | 50 | 33.4 Ų | 33.4 | 26% | 0.262 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -52.7 | -47.5 | -174.2 | -176.6 | 64.9 | 0 | 0 | 0 | 113.2 | G84 C88 L89 Q90 D120 V124 | G84-L86 VanDerWaalsContact C-N 3.3Å; G84-L86 PolarHBondContact O-N 3.03Å; L86-C88 PolarHBondContact O-N 2.74Å; L86-L89 WeakPolarHBondContact O-CB 3.39Å; L86-L89 PolarHBondContact O-N 3.14Å; L86-Q90 WeakPolarHBondContact O-CG 3.37Å; L86-Q90 PolarHBondContact O-N 3.35Å; L86-D120 HydrophobicContact CD1-CB 4.05Å; L86-D120 HydrophobicContact CD2-CB 3.84Å; L86-D120 HydrophobicContact CG-CB 4.5Å; L86-V124 HydrophobicContact CD1-CB 4.26Å; L86-V124 HydrophobicContact CD1-CG2 3.65Å |
| 87 | S | 98.6 | Very high | 97.5 | Very high | 59 Ų | 59 | 33.7 Ų | 33.7 | 41% | 0.413 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -63.7 | -43.1 | -178.5 | -52.6 | 0 | 0 | 0 | 0 | 111.9 | H85 L89 Q90 V91 | H85-S87 PolarHBondContact O-N 3.41Å; S87-L89 VanDerWaalsContact C-N 3.34Å; S87-Q90 PolarHBondContact O-N 3.45Å; S87-V91 WeakPolarHBondContact O-CG2 3.5Å; S87-V91 PolarHBondContact O-N 3.12Å |
| 88 | C | 98.5 | Very high | 97.5 | Very high | 0 Ų | 0 | 37.6 Ų | 37.6 | 0% | 0 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -63.6 | -41.5 | 174.7 | -66.8 | 0 | 0 | 0 | 0 | 111.4 | L51 A80 H85 L86 V91 L92 | L51-C88 HydrophobicContact CD2-CB 3.73Å; A80-C88 HydrophobicContact CB-CB 4.21Å; H85-C88 HydrophobicContact CB-CB 4.08Å; H85-C88 PolarHBondContact O-N 2.61Å; L86-C88 PolarHBondContact O-N 2.74Å; C88-V91 PolarHBondContact O-N 3.41Å; C88-L92 WeakPolarHBondContact O-CB 3.23Å; C88-L92 WeakPolarHBondContact O-CD1 3.47Å; C88-L92 VanDerWaalsContact O-CG 3.24Å; C88-L92 WeakPolarHBondContact O-CG 3.43Å; C88-L92 PolarHBondContact O-N 3.05Å |
| 89 | L | 98.4 | Very high | 97.6 | Very high | 0 Ų | 0 | 36.9 Ų | 36.9 | 0% | 0 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -61.1 | -45.4 | 177.5 | -175.1 | 138.7 | 0 | 0 | 0 | 111.6 | L77 A80 A81 H85 L86 S87 L92 L93 C121 V124 L125 | L77-L89 HydrophobicContact CD1-CD1 4.3Å; L77-L89 HydrophobicContact CD1-CG 3.86Å; A80-L89 HydrophobicContact CB-CB 3.98Å; A81-L89 HydrophobicContact CB-CD1 3.89Å; H85-L89 WeakPolarHBondContact O-CB 3.38Å; H85-L89 PolarHBondContact O-N 2.85Å; L86-L89 WeakPolarHBondContact O-CB 3.39Å; L86-L89 PolarHBondContact O-N 3.14Å; S87-L89 VanDerWaalsContact C-N 3.34Å; L89-L92 PolarHBondContact O-N 3.18Å; L89-L93 HydrophobicContact CD2-CD1 3.6Å; L89-L93 HydrophobicContact CG-CD1 4.29Å; L89-L93 VanDerWaalsContact O-CG 3.28Å; L89-L93 WeakPolarHBondContact O-CG 3.47Å; L89-L93 PolarHBondContact O-N 2.87Å; L89-C121 HydrophobicContact CD1-CB 4.05Å; L89-V124 HydrophobicContact CD2-CB 3.9Å; L89-V124 HydrophobicContact CD2-CG1 3.48Å; L89-V124 VanDerWaalsContact CD2-CG1 3.48Å; L89-L125 HydrophobicContact CD1-CD1 4.13Å; L89-L125 HydrophobicContact CD1-CD2 4.2Å; L89-L125 HydrophobicContact CD1-CG 4.12Å; L89-L125 HydrophobicContact CD2-CD2 4.33Å; L89-L125 HydrophobicContact CD2-CG 4.21Å; L89-L125 HydrophobicContact CG-CD2 4.49Å |
| 90 | Q | 98.6 | Very high | 97.7 | Very high | 94 Ų | 94 | 36.9 Ų | 36.9 | 44% | 0.439 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -61.6 | -44.3 | 175.2 | -74.5 | 175.9 | -18.8 | 0 | 0 | 112.4 | L86 S87 L93 A94 V124 | L86-Q90 WeakPolarHBondContact O-CG 3.37Å; L86-Q90 PolarHBondContact O-N 3.35Å; S87-Q90 PolarHBondContact O-N 3.45Å; Q90-L93 PolarHBondContact O-N 3.27Å; Q90-A94 WeakPolarHBondContact O-CB 3.35Å; Q90-A94 PolarHBondContact O-N 2.9Å; Q90-V124 HydrophobicContact CG-CG1 3.91Å; Q90-V124 HydrophobicContact CG-CG2 4.31Å |
| 91 | V | 98.5 | Very high | 97.5 | Very high | 25 Ų | 25 | 37.6 Ų | 37.6 | 15% | 0.152 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -60 | -46.6 | 176 | 167.7 | 0 | 0 | 0 | 0 | 110.8 | L51 D52 L55 S87 C88 L93 A94 H95 | L51-V91 HydrophobicContact CD2-CG1 4.31Å; L51-V91 HydrophobicContact CG-CG1 4.16Å; D52-V91 HydrophobicContact CB-CG1 3.76Å; D52-V91 HydrophobicContact CB-CG2 4.3Å; L55-V91 HydrophobicContact CD1-CG1 4.07Å; S87-V91 WeakPolarHBondContact O-CG2 3.5Å; S87-V91 PolarHBondContact O-N 3.12Å; C88-V91 PolarHBondContact O-N 3.41Å; V91-L93 PolarHBondContact O-N 3.34Å; V91-A94 PolarHBondContact O-N 3.12Å; V91-H95 PolarHBondContact O-CD2 3.49Å; V91-H95 VanDerWaalsContact O-CD2 3.25Å; V91-H95 PolarHBondContact O-N 3.49Å; V91-H95 VanDerWaalsContact O-N 3.07Å |
| 92 | L | 98.5 | Very high | 97.3 | Very high | 0 Ų | 0 | 40.6 Ų | 40.6 | 0% | 0 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -60.9 | -45 | 179.6 | -73.6 | 162.7 | 0 | 0 | 0 | 112.1 | V43 L51 L55 I64 P76 L77 A80 C88 L89 H95 G96 A97 | V43-L92 HydrophobicContact CG2-CD1 3.98Å; L51-L92 HydrophobicContact CD1-CD2 4.37Å; L51-L92 HydrophobicContact CD2-CD1 4.15Å; L51-L92 HydrophobicContact CD2-CD2 4.28Å; L51-L92 HydrophobicContact CD2-CG 3.89Å; L55-L92 HydrophobicContact CD1-CD2 3.85Å; I64-L92 HydrophobicContact CD1-CD2 4.27Å; I64-L92 WeakPolarHBondContact CD1-O 3.29Å; I64-L92 HydrophobicContact CG1-CD2 3.91Å; P76-L92 HydrophobicContact CB-CD1 4Å; P76-L92 HydrophobicContact CB-CD2 3.75Å; L77-L92 HydrophobicContact CB-CD1 4.47Å; L77-L92 HydrophobicContact CD1-CB 3.99Å; A80-L92 HydrophobicContact CB-CD1 4.07Å; C88-L92 WeakPolarHBondContact O-CB 3.23Å; C88-L92 WeakPolarHBondContact O-CD1 3.47Å; C88-L92 VanDerWaalsContact O-CG 3.24Å; C88-L92 WeakPolarHBondContact O-CG 3.43Å; C88-L92 PolarHBondContact O-N 3.05Å; L89-L92 PolarHBondContact O-N 3.18Å; L92-H95 PolarHBondContact O-N 3.41Å; L92-G96 PolarHBondContact O-N 3.22Å; L92-A97 HydrophobicContact CB-CB 3.99Å; L92-A97 WeakPolarHBondContact O-CB 3.48Å; L92-A97 PolarHBondContact O-N 3.17Å |
| 93 | L | 98.4 | Very high | 96.9 | Very high | 30 Ų | 30 | 39.7 Ų | 39.7 | 16% | 0.157 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -63.2 | -42.3 | 176.3 | -67.8 | 168.4 | 0 | 0 | 0 | 111.7 | L77 L89 Q90 V91 H95 G96 V99 V124 L125 A128 | L77-L93 HydrophobicContact CD1-CD2 3.92Å; L77-L93 HydrophobicContact CD1-CG 3.85Å; L77-L93 HydrophobicContact CD2-CD2 3.91Å; L89-L93 HydrophobicContact CD2-CD1 3.6Å; L89-L93 HydrophobicContact CG-CD1 4.29Å; L89-L93 VanDerWaalsContact O-CG 3.28Å; L89-L93 WeakPolarHBondContact O-CG 3.47Å; L89-L93 PolarHBondContact O-N 2.87Å; Q90-L93 PolarHBondContact O-N 3.27Å; V91-L93 PolarHBondContact O-N 3.34Å; L93-H95 PolarHBondContact O-N 3.22Å; L93-G96 PolarHBondContact O-N 3.33Å; L93-V99 HydrophobicContact CD2-CB 4.42Å; L93-V99 HydrophobicContact CD2-CG1 4.41Å; L93-V99 HydrophobicContact CD2-CG2 3.66Å; L93-V124 HydrophobicContact CD1-CG1 3.6Å; L93-L125 HydrophobicContact CD1-CD2 4.37Å; L93-L125 HydrophobicContact CD2-CD2 4.48Å; L93-A128 HydrophobicContact CD1-CB 3.94Å; L93-A128 HydrophobicContact CD2-CB 4.09Å |
| 94 | A | 98.2 | Very high | 96.5 | Very high | 87 Ų | 87 | 39.1 Ų | 39.1 | 72% | 0.719 | 24% | 0.243 | S | C | * | . | H | α-helix | trans | -61.9 | -30.2 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | Q90 V91 | Q90-A94 WeakPolarHBondContact O-CB 3.35Å; Q90-A94 PolarHBondContact O-N 2.9Å; V91-A94 PolarHBondContact O-N 3.12Å |
| 95 | H | 97.9 | Very high | 95.9 | Very high | 38 Ų | 38 | 44.2 Ų | 44.2 | 18% | 0.176 | 26% | 0.259 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -89.1 | 4 | 176 | -77.3 | -77.4 | 0 | 0 | 0 | 114.2 | D52 L55 I64 V91 L92 L93 | D52-H95 IonicContact OD1-CD2 3.18Å; D52-H95 IonicContact OD1-CE1 3.75Å; D52-H95 IonicContact OD1-NE2 2.8Å; D52-H95 PolarHBondContact OD1-NE2 2.95Å; L55-H95 HydrophobicContact CB-CB 4.24Å; L55-H95 HydrophobicContact CD1-CB 4.11Å; I64-H95 HydrophobicContact CD1-CB 3.68Å; V91-H95 PolarHBondContact O-CD2 3.49Å; V91-H95 VanDerWaalsContact O-CD2 3.25Å; V91-H95 PolarHBondContact O-N 3.49Å; V91-H95 VanDerWaalsContact O-N 3.07Å; L92-H95 PolarHBondContact O-N 3.41Å; L93-H95 PolarHBondContact O-N 3.22Å |
| 96 | G | 96.4 | Very high | 95.6 | Very high | 48 Ų | 48 | 43.4 Ų | 43.4 | 50% | 0.495 | 26% | 0.258 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 90.9 | 30.4 | 173.6 | 0 | 0 | 0 | 0 | 0 | 115 | L92 L93 | L92-G96 PolarHBondContact O-N 3.22Å; L93-G96 PolarHBondContact O-N 3.33Å |
| 97 | A | 97.6 | Very high | 95.3 | Very high | 7 Ų | 7 | 42.9 Ų | 42.9 | 6% | 0.058 | 25% | 0.254 | C | S | . | . | trans | -61.1 | 140.6 | 169 | 0 | 0 | 0 | 0 | 0 | 111.1 | I64 N65 L77 L92 V99 | I64-A97 HydrophobicContact CD1-CB 3.96Å; I64-A97 HydrophobicContact CG1-CB 4.03Å; N65-A97 WeakPolarHBondContact OD1-CA 3.43Å; L77-A97 HydrophobicContact CB-CB 4.13Å; L77-A97 HydrophobicContact CD1-CB 4.43Å; L77-A97 HydrophobicContact CD2-CB 4.04Å; L77-A97 HydrophobicContact CG-CB 4.43Å; L92-A97 HydrophobicContact CB-CB 3.99Å; L92-A97 WeakPolarHBondContact O-CB 3.48Å; L92-A97 PolarHBondContact O-N 3.17Å; A97-V99 PolarHBondContact O-N 2.99Å | ||
| 98 | D | 97 | Very high | 95.2 | Very high | 83 Ų | 83 | 40.1 Ų | 40.1 | 44% | 0.444 | 24% | 0.235 | S | C | . | . | trans | -72.6 | 108.1 | 178.8 | 178.5 | 15.5 | 0 | 0 | 0 | 110.7 | N65 L77 D100 S101 | N65-D98 PolarHBondContact OD1-N 3.47Å; L77-D98 WeakPolarHBondContact CD2-O 3.22Å; D98-D100 VanDerWaalsContact C-N 3.28Å; D98-D100 PolarHBondContact O-N 3.27Å; D98-D100 PolarHBondContact OD1-N 3.24Å; D98-S101 WeakPolarHBondContact O-CB 3.44Å; D98-S101 PolarHBondContact O-N 2.89Å; D98-S101 PolarHBondContact O-OG 3.08Å | ||
| 99 | V | 97.6 | Very high | 95.1 | Very high | 24 Ų | 24 | 40.1 Ų | 40.1 | 15% | 0.145 | 24% | 0.235 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -59.8 | -36.7 | -172.6 | -169.7 | 0 | 0 | 0 | 0 | 112.4 | L93 A97 P109 L125 A128 A130 | L93-V99 HydrophobicContact CD2-CB 4.42Å; L93-V99 HydrophobicContact CD2-CG1 4.41Å; L93-V99 HydrophobicContact CD2-CG2 3.66Å; A97-V99 PolarHBondContact O-N 2.99Å; V99-P109 VanDerWaalsContact O-CD 3.28Å; V99-P109 WeakPolarHBondContact O-CD 3.5Å; V99-P109 WeakPolarHBondContact O-CG 3.4Å; V99-L125 HydrophobicContact CG1-CD2 4.22Å; V99-A128 HydrophobicContact CG1-CB 4.32Å; V99-A128 HydrophobicContact CG2-CB 4.27Å; V99-A130 HydrophobicContact CG1-CB 3.59Å |
| 100 | D | 96.2 | Very high | 95.1 | Very high | 42 Ų | 42 | 40.1 Ų | 40.1 | 23% | 0.225 | 24% | 0.235 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -108.1 | 23.7 | -176.7 | -82.3 | -38.1 | 0 | 0 | 0 | 112.8 | D98 L102 T108 C131 | D98-D100 VanDerWaalsContact C-N 3.28Å; D98-D100 PolarHBondContact O-N 3.27Å; D98-D100 PolarHBondContact OD1-N 3.24Å; D100-L102 WeakPolarHBondContact O-CD2 3.25Å; D100-L102 PolarHBondContact O-N 3.33Å; D100-T108 HydrophobicContact CB-CG2 4.44Å; D100-C131 PolarHBondContact OD1-N 2.74Å; D100-C131 PolarHBondContact OD2-N 2.99Å; D100-C131 PolarHBondContact OD2-SG 3.33Å |
| 101 | S | 93.9 | Very high | 95 | Very high | 14 Ų | 14 | 36.3 Ų | 36.3 | 10% | 0.098 | 22% | 0.216 | C | C | . | . | trans | -53.4 | 129.5 | 176.1 | 51.5 | 0 | 0 | 0 | 0 | 112.4 | T75 D98 P109 | T75-S101 PolarHBondContact OG1-OG 3.34Å; D98-S101 WeakPolarHBondContact O-CB 3.44Å; D98-S101 PolarHBondContact O-N 2.89Å; D98-S101 PolarHBondContact O-OG 3.08Å; S101-P109 VanDerWaalsContact O-CD 3.29Å; S101-P109 WeakPolarHBondContact O-CD 3.35Å | ||
| 102 | L | 92.3 | Very high | 94.9 | Very high | 64 Ų | 64 | 35.2 Ų | 35.2 | 34% | 0.335 | 21% | 0.21 | S | C | . | . | trans | -93.2 | 138.9 | -173.2 | -61.9 | -175.1 | 0 | 0 | 0 | 111.8 | R67 D100 T108 S135 Y137 | R67-L102 PolarHBondContact NH1-O 3.35Å; D100-L102 WeakPolarHBondContact O-CD2 3.25Å; D100-L102 PolarHBondContact O-N 3.33Å; L102-T108 HydrophobicContact CD2-CG2 3.73Å; L102-S135 WeakPolarHBondContact CD2-OG 3.48Å; L102-Y137 HydrophobicContact CD1-CD2 4.05Å | ||
| 103 | D | 88.3 | Confident | 94.9 | Very high | 9 Ų | 9 | 35.2 Ų | 35.2 | 5% | 0.048 | 21% | 0.21 | C | C | . | . | trans | -82.5 | -172.6 | 168 | 92.8 | -24.2 | 0 | 0 | 0 | 112.8 | V72 R78 K105 A106 Q107 | V72-D103 HydrophobicContact CG1-CB 4.36Å; V72-D103 WeakPolarHBondContact CG1-OD2 3.28Å; R78-D103 IonicContact CZ-OD2 3.79Å; R78-D103 IonicContact NH1-OD2 3.81Å; R78-D103 PolarHBondContact NH1-OD2 3.19Å; R78-D103 IonicContact NH2-OD2 3.17Å; D103-K105 PolarHBondContact O-N 3.19Å; D103-K105 VanDerWaalsContact OD1-CA 3.22Å; D103-K105 WeakPolarHBondContact OD1-CA 3.5Å; D103-K105 WeakPolarHBondContact OD1-CB 3.12Å; D103-K105 PolarHBondContact OD1-N 3.39Å; D103-A106 PolarHBondContact O-N 2.88Å; D103-A106 VanDerWaalsContact O-N 3.08Å; D103-A106 PolarHBondContact OD1-N 3.32Å; D103-Q107 PolarHBondContact N-O 3.32Å; D103-Q107 WeakPolarHBondContact OD1-CB 3.5Å; D103-Q107 PolarHBondContact OD1-N 3.01Å | ||
| 104 | V | 86.9 | Confident | 94.9 | Very high | 92 Ų | 92 | 34 Ų | 34 | 56% | 0.558 | 20% | 0.204 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -70.5 | -16.1 | 179 | -57.8 | 0 | 0 | 0 | 0 | 113.4 | V72 P73 | V72-V104 HydrophobicContact CG1-CG2 3.77Å; V72-V104 HydrophobicContact CG2-CG2 4.36Å; P73-V104 HydrophobicContact CG-CG1 4.41Å |
| 105 | K | 86.1 | Confident | 94.8 | Very high | 131 Ų | 131 | 32 Ų | 32 | 57% | 0.57 | 19% | 0.185 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -100.9 | 13.8 | 172.8 | -61.4 | -179.5 | -179.6 | 178.1 | 0 | 111.3 | D103 Q107 | D103-K105 PolarHBondContact O-N 3.19Å; D103-K105 VanDerWaalsContact OD1-CA 3.22Å; D103-K105 WeakPolarHBondContact OD1-CA 3.5Å; D103-K105 WeakPolarHBondContact OD1-CB 3.12Å; D103-K105 PolarHBondContact OD1-N 3.39Å; K105-Q107 HydrophobicContact CB-CG 4.02Å; K105-Q107 PolarHBondContact O-N 2.95Å |
| 106 | A | 91.1 | Very high | 94.7 | Very high | 14 Ų | 14 | 34.9 Ų | 34.9 | 12% | 0.116 | 20% | 0.198 | C | C | . | . | trans | 56.7 | 27.8 | -173.8 | 0 | 0 | 0 | 0 | 0 | 114.9 | D103 S135 N138 | D103-A106 PolarHBondContact O-N 2.88Å; D103-A106 VanDerWaalsContact O-N 3.08Å; D103-A106 PolarHBondContact OD1-N 3.32Å; A106-S135 WeakPolarHBondContact O-CB 2.92Å; A106-S135 PolarHBondContact O-OG 2.66Å; A106-N138 WeakPolarHBondContact O-CB 3.26Å | ||
| 107 | Q | 92.2 | Very high | 94.7 | Very high | 39 Ų | 39 | 34.8 Ų | 34.8 | 18% | 0.182 | 20% | 0.197 | C | C | . | . | trans | -81.9 | 135.4 | 175.2 | -60.4 | 178.3 | -19.6 | 0 | 0 | 110.3 | D103 K105 F111 | D103-Q107 PolarHBondContact N-O 3.32Å; D103-Q107 WeakPolarHBondContact OD1-CB 3.5Å; D103-Q107 PolarHBondContact OD1-N 3.01Å; K105-Q107 HydrophobicContact CB-CG 4.02Å; K105-Q107 PolarHBondContact O-N 2.95Å; Q107-F111 HydrophobicContact CB-CB 4.43Å; Q107-F111 HydrophobicContact CB-CD1 3.86Å; Q107-F111 HydrophobicContact CB-CG 4.35Å; Q107-F111 HydrophobicContact CG-CD1 3.71Å; Q107-F111 HydrophobicContact CG-CE1 3.96Å; Q107-F111 HydrophobicContact CG-CG 4.4Å; Q107-F111 VanDerWaalsContact NE2-CE1 3.28Å | ||
| 108 | T | 95.7 | Very high | 94.8 | Very high | 2 Ų | 2 | 37 Ų | 37 | 1% | 0.012 | 21% | 0.205 | C | C | . | . | trans | -84.2 | 163.7 | 173.2 | 58.8 | 0 | 0 | 0 | 0 | 111.1 | D100 L102 L110 F111 T112 | D100-T108 HydrophobicContact CB-CG2 4.44Å; L102-T108 HydrophobicContact CD2-CG2 3.73Å; T108-L110 PolarHBondContact O-N 2.98Å; T108-F111 PolarHBondContact O-N 3.49Å; T108-F111 VanDerWaalsContact O-N 3.16Å; T108-F111 PolarHBondContact OG1-N 2.96Å; T108-T112 PolarHBondContact O-N 2.99Å; T108-T112 VanDerWaalsContact O-N 3.1Å; T108-T112 PolarHBondContact O-OG1 3.38Å | ||
| 109 | P | 97.3 | Very high | 94.9 | Very high | 0 Ų | 0 | 34.9 Ų | 34.9 | 0% | 0 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -54.1 | -39.6 | 168.3 | -26.1 | 35.4 | 0 | 0 | 0 | 111.8 | L77 A81 V99 S101 F111 T112 A113 L125 | L77-P109 HydrophobicContact CD2-CB 4.3Å; L77-P109 HydrophobicContact CD2-CG 3.94Å; L77-P109 HydrophobicContact CG-CB 4.21Å; L77-P109 HydrophobicContact CG-CG 4.16Å; A81-P109 HydrophobicContact CB-CB 4.19Å; V99-P109 VanDerWaalsContact O-CD 3.28Å; V99-P109 WeakPolarHBondContact O-CD 3.5Å; V99-P109 WeakPolarHBondContact O-CG 3.4Å; S101-P109 VanDerWaalsContact O-CD 3.29Å; S101-P109 WeakPolarHBondContact O-CD 3.35Å; P109-F111 PolarHBondContact O-N 3.34Å; P109-T112 WeakPolarHBondContact O-CB 3.2Å; P109-T112 PolarHBondContact O-N 2.96Å; P109-T112 VanDerWaalsContact O-N 3.12Å; P109-A113 PolarHBondContact O-N 2.94Å; P109-L125 HydrophobicContact CB-CD1 4.2Å; P109-L125 HydrophobicContact CB-CD2 4.18Å |
| 110 | L | 98.4 | Very high | 94.9 | Very high | 0 Ų | 0 | 38 Ų | 38 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -58 | -49.2 | 175 | -179.5 | 70.2 | 0 | 0 | 0 | 111.6 | T108 T112 A113 V114 V122 L125 L126 A130 C131 P142 L158 | T108-L110 PolarHBondContact O-N 2.98Å; L110-T112 PolarHBondContact O-N 3.49Å; L110-A113 PolarHBondContact O-N 3.34Å; L110-V114 WeakPolarHBondContact O-CG2 3.46Å; L110-V114 PolarHBondContact O-N 2.85Å; L110-V122 HydrophobicContact CD1-CB 4.44Å; L110-V122 HydrophobicContact CD1-CG1 4.01Å; L110-V122 HydrophobicContact CD1-CG2 4.49Å; L110-L125 HydrophobicContact CB-CD1 4.37Å; L110-L125 HydrophobicContact CD1-CB 4.07Å; L110-L126 HydrophobicContact CD1-CD2 4.09Å; L110-L126 HydrophobicContact CD1-CG 3.94Å; L110-L126 HydrophobicContact CD2-CD2 3.84Å; L110-A130 HydrophobicContact CB-CB 4.14Å; L110-A130 HydrophobicContact CD2-CB 4.15Å; L110-C131 WeakPolarHBondContact CD2-O 3.48Å; L110-P142 HydrophobicContact CD2-CG 4.48Å; L110-L158 HydrophobicContact CD1-CD2 4.44Å; L110-L158 HydrophobicContact CD2-CD2 4.1Å; L110-L158 HydrophobicContact CG-CD2 4.49Å |
| 111 | F | 96.9 | Very high | 95 | Very high | 13 Ų | 13 | 36.1 Ų | 36.1 | 6% | 0.057 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -57.9 | -39.2 | 177 | -178.4 | -85.6 | 0 | 0 | 0 | 111.6 | Q107 T108 P109 V114 S115 N138 C140 P142 T145 | Q107-F111 HydrophobicContact CB-CB 4.43Å; Q107-F111 HydrophobicContact CB-CD1 3.86Å; Q107-F111 HydrophobicContact CB-CG 4.35Å; Q107-F111 HydrophobicContact CG-CD1 3.71Å; Q107-F111 HydrophobicContact CG-CE1 3.96Å; Q107-F111 HydrophobicContact CG-CG 4.4Å; Q107-F111 VanDerWaalsContact NE2-CE1 3.28Å; T108-F111 PolarHBondContact O-N 3.49Å; T108-F111 VanDerWaalsContact O-N 3.16Å; T108-F111 PolarHBondContact OG1-N 2.96Å; P109-F111 PolarHBondContact O-N 3.34Å; F111-V114 PolarHBondContact O-N 2.85Å; F111-S115 WeakPolarHBondContact O-CB 3.47Å; F111-S115 PolarHBondContact O-N 3.01Å; F111-S115 PolarHBondContact O-OG 3.34Å; F111-N138 WeakPolarHBondContact CD2-ND2 3.48Å; F111-C140 HydrophobicContact CE2-CB 3.95Å; F111-C140 HydrophobicContact CZ-CB 4.15Å; F111-P142 HydrophobicContact CB-CG 4.43Å; F111-P142 HydrophobicContact CD2-CG 4.19Å; F111-T145 WeakPolarHBondContact CE2-OG1 3.42Å |
| 112 | T | 96.3 | Very high | 95.3 | Very high | 3 Ų | 3 | 35.4 Ų | 35.4 | 2% | 0.018 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -68.6 | -42 | -179.7 | -56.3 | 0 | 0 | 0 | 0 | 111.8 | R78 T108 P109 L110 V114 S115 H116 | R78-T112 HydrophobicContact CG-CG2 4.31Å; T108-T112 PolarHBondContact O-N 2.99Å; T108-T112 VanDerWaalsContact O-N 3.1Å; T108-T112 PolarHBondContact O-OG1 3.38Å; P109-T112 WeakPolarHBondContact O-CB 3.2Å; P109-T112 PolarHBondContact O-N 2.96Å; P109-T112 VanDerWaalsContact O-N 3.12Å; L110-T112 PolarHBondContact O-N 3.49Å; T112-V114 VanDerWaalsContact C-N 3.34Å; T112-S115 PolarHBondContact O-N 2.79Å; T112-S115 PolarHBondContact O-OG 3.11Å; T112-H116 PolarHBondContact O-N 3Å; T112-H116 PolarHBondContact O-ND1 3.39Å |
| 113 | A | 98.3 | Very high | 95.6 | Very high | 0 Ų | 0 | 36.5 Ų | 36.5 | 0% | 0 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -62.3 | -42.6 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | A81 P109 L110 H116 G117 H118 C121 V122 L125 | A81-A113 HydrophobicContact CB-CB 4.23Å; P109-A113 PolarHBondContact O-N 2.94Å; L110-A113 PolarHBondContact O-N 3.34Å; A113-H116 PolarHBondContact O-N 3.05Å; A113-G117 PolarHBondContact O-N 3.35Å; A113-H118 HydrophobicContact CB-CB 4.49Å; A113-H118 PolarHBondContact O-N 3.43Å; A113-C121 HydrophobicContact CB-CB 3.98Å; A113-V122 HydrophobicContact CB-CG2 3.85Å; A113-L125 HydrophobicContact CB-CD1 4.07Å |
| 114 | V | 98.1 | Very high | 96.1 | Very high | 4 Ų | 4 | 37 Ų | 37 | 2% | 0.024 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -62.9 | -46.5 | 176.7 | 170.5 | 0 | 0 | 0 | 0 | 111.6 | L110 F111 T112 H116 G117 V122 P142 T145 A146 I154 L158 | L110-V114 WeakPolarHBondContact O-CG2 3.46Å; L110-V114 PolarHBondContact O-N 2.85Å; F111-V114 PolarHBondContact O-N 2.85Å; T112-V114 VanDerWaalsContact C-N 3.34Å; V114-H116 PolarHBondContact O-N 3.04Å; V114-G117 PolarHBondContact O-N 3.37Å; V114-G117 VanDerWaalsContact O-N 3.11Å; V114-V122 HydrophobicContact CG2-CG1 4.43Å; V114-V122 HydrophobicContact CG2-CG2 3.59Å; V114-P142 HydrophobicContact CB-CB 4.37Å; V114-P142 HydrophobicContact CG1-CB 4.25Å; V114-P142 WeakPolarHBondContact CG1-O 3.5Å; V114-P142 HydrophobicContact CG2-CB 4.07Å; V114-T145 HydrophobicContact CG1-CG2 4.29Å; V114-A146 HydrophobicContact CG1-CB 4.18Å; V114-I154 HydrophobicContact CB-CG2 4.28Å; V114-I154 HydrophobicContact CG1-CG2 3.97Å; V114-I154 HydrophobicContact CG2-CG2 3.69Å; V114-L158 HydrophobicContact CG2-CD1 4.24Å; V114-L158 HydrophobicContact CG2-CD2 4.38Å |
| 115 | S | 95.9 | Very high | 96.6 | Very high | 45 Ų | 45 | 32.6 Ų | 32.6 | 32% | 0.315 | 17% | 0.172 | S | C | . | . | H | α-helix | trans | -66.2 | -19.8 | -178.4 | 70.3 | 0 | 0 | 0 | 0 | 114.1 | F111 T112 | F111-S115 WeakPolarHBondContact O-CB 3.47Å; F111-S115 PolarHBondContact O-N 3.01Å; F111-S115 PolarHBondContact O-OG 3.34Å; T112-S115 PolarHBondContact O-N 2.79Å; T112-S115 PolarHBondContact O-OG 3.11Å |
| 116 | H | 96.2 | Very high | 97.2 | Very high | 99 Ų | 99 | 26.8 Ų | 26.8 | 46% | 0.458 | 15% | 0.147 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -104 | -0.3 | 176.6 | -65.9 | 86.4 | 0 | 0 | 0 | 113.1 | S82 T112 A113 V114 H118 | S82-H116 PolarHBondContact OG-CE1 3.32Å; T112-H116 PolarHBondContact O-N 3Å; T112-H116 PolarHBondContact O-ND1 3.39Å; A113-H116 PolarHBondContact O-N 3.05Å; V114-H116 PolarHBondContact O-N 3.04Å; H116-H118 VanDerWaalsContact CB-CD2 3.44Å; H116-H118 WeakPolarHBondContact CB-CD2 3.27Å; H116-H118 WeakPolarHBondContact CB-NE2 3.42Å |
| 117 | G | 97.6 | Very high | 97.5 | Very high | 45 Ų | 45 | 33 Ų | 33 | 46% | 0.464 | 17% | 0.173 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 78.2 | 17.3 | 175.9 | 0 | 0 | 0 | 0 | 0 | 115.6 | A113 V114 L119 | A113-G117 PolarHBondContact O-N 3.35Å; V114-G117 PolarHBondContact O-N 3.37Å; V114-G117 VanDerWaalsContact O-N 3.11Å; G117-L119 PolarHBondContact O-N 3.4Å |
| 118 | H | 98.4 | Very high | 97.8 | Very high | 53 Ų | 53 | 33.3 Ų | 33.3 | 25% | 0.245 | 18% | 0.182 | C | C | . | . | trans | -83.6 | 79.6 | -175.1 | -61.5 | -50.9 | 0 | 0 | 0 | 112.1 | A81 S82 G84 A113 H116 D120 C121 V122 | A81-H118 PolarHBondContact O-CD2 2.99Å; S82-H118 PolarHBondContact O-NE2 2.94Å; G84-H118 VanDerWaalsContact CA-CG 3.45Å; G84-H118 PolarHBondContact N-CD2 3.38Å; G84-H118 PolarHBondContact N-NE2 3.34Å; A113-H118 HydrophobicContact CB-CB 4.49Å; A113-H118 PolarHBondContact O-N 3.43Å; H116-H118 VanDerWaalsContact CB-CD2 3.44Å; H116-H118 WeakPolarHBondContact CB-CD2 3.27Å; H116-H118 WeakPolarHBondContact CB-NE2 3.42Å; H118-D120 PolarHBondContact O-N 3.48Å; H118-C121 HydrophobicContact CB-CB 4.01Å; H118-C121 WeakPolarHBondContact O-CB 3.46Å; H118-C121 PolarHBondContact O-N 3.16Å; H118-V122 WeakPolarHBondContact O-CG2 3.41Å; H118-V122 PolarHBondContact O-N 2.9Å | ||
| 119 | L | 98.6 | Very high | 97.9 | Very high | 40 Ų | 40 | 35.8 Ų | 35.8 | 21% | 0.209 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -53.7 | -45.4 | -174.8 | 177 | 62.6 | 0 | 0 | 0 | 114 | G117 C121 V122 R123 A153 I154 E157 | G117-L119 PolarHBondContact O-N 3.4Å; L119-C121 VanDerWaalsContact C-N 3.32Å; L119-C121 PolarHBondContact O-N 3.34Å; L119-V122 WeakPolarHBondContact O-CB 3.21Å; L119-V122 PolarHBondContact O-N 2.86Å; L119-V122 VanDerWaalsContact O-N 3.11Å; L119-R123 PolarHBondContact O-N 3.18Å; L119-A153 HydrophobicContact CD1-CB 4.09Å; L119-A153 HydrophobicContact CD2-CB 3.73Å; L119-I154 HydrophobicContact CB-CG1 4.18Å; L119-I154 HydrophobicContact CD1-CG1 3.8Å; L119-E157 HydrophobicContact CD1-CG 3.8Å |
| 120 | D | 98.6 | Very high | 97.9 | Very high | 88 Ų | 88 | 36 Ų | 36 | 47% | 0.471 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -67.9 | -35.5 | -176.8 | -60.7 | -39.3 | 0 | 0 | 0 | 111.6 | L86 H118 V122 R123 V124 | L86-D120 HydrophobicContact CD1-CB 4.05Å; L86-D120 HydrophobicContact CD2-CB 3.84Å; L86-D120 HydrophobicContact CG-CB 4.5Å; H118-D120 PolarHBondContact O-N 3.48Å; D120-V122 VanDerWaalsContact C-N 3.35Å; D120-R123 PolarHBondContact O-N 3.18Å; D120-R123 IonicContact OD1-NH1 2.67Å; D120-R123 PolarHBondContact OD1-NH1 2.84Å; D120-V124 PolarHBondContact O-N 3.08Å; D120-V124 VanDerWaalsContact O-N 3.12Å |
| 121 | C | 98.7 | Very high | 97.9 | Very high | 3 Ų | 3 | 39 Ų | 39 | 2% | 0.02 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -65.1 | -39.2 | 171.2 | -67.1 | 0 | 0 | 0 | 0 | 111.5 | L89 A113 H118 L119 V124 L125 | L89-C121 HydrophobicContact CD1-CB 4.05Å; A113-C121 HydrophobicContact CB-CB 3.98Å; H118-C121 HydrophobicContact CB-CB 4.01Å; H118-C121 WeakPolarHBondContact O-CB 3.46Å; H118-C121 PolarHBondContact O-N 3.16Å; L119-C121 VanDerWaalsContact C-N 3.32Å; L119-C121 PolarHBondContact O-N 3.34Å; C121-V124 PolarHBondContact O-N 3.4Å; C121-L125 WeakPolarHBondContact O-CB 3.46Å; C121-L125 WeakPolarHBondContact O-CD1 3.44Å; C121-L125 WeakPolarHBondContact O-CG 3.45Å; C121-L125 PolarHBondContact O-N 3.06Å |
| 122 | V | 98.8 | Very high | 97.8 | Very high | 0 Ų | 0 | 39.8 Ų | 39.8 | 0% | 0 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -59 | -47.7 | 175.5 | 169.4 | 0 | 0 | 0 | 0 | 110.7 | L110 A113 V114 H118 L119 D120 L125 L126 I154 E157 | L110-V122 HydrophobicContact CD1-CB 4.44Å; L110-V122 HydrophobicContact CD1-CG1 4.01Å; L110-V122 HydrophobicContact CD1-CG2 4.49Å; A113-V122 HydrophobicContact CB-CG2 3.85Å; V114-V122 HydrophobicContact CG2-CG1 4.43Å; V114-V122 HydrophobicContact CG2-CG2 3.59Å; H118-V122 WeakPolarHBondContact O-CG2 3.41Å; H118-V122 PolarHBondContact O-N 2.9Å; L119-V122 WeakPolarHBondContact O-CB 3.21Å; L119-V122 PolarHBondContact O-N 2.86Å; L119-V122 VanDerWaalsContact O-N 3.11Å; D120-V122 VanDerWaalsContact C-N 3.35Å; V122-L125 PolarHBondContact O-N 3.12Å; V122-L126 HydrophobicContact CG1-CD1 3.72Å; V122-L126 HydrophobicContact CG1-CG 4.4Å; V122-L126 WeakPolarHBondContact O-CB 3.27Å; V122-L126 VanDerWaalsContact O-CG 3.28Å; V122-L126 WeakPolarHBondContact O-CG 3.15Å; V122-L126 PolarHBondContact O-N 3.02Å; V122-I154 HydrophobicContact CG1-CG2 4.34Å; V122-I154 HydrophobicContact CG2-CD1 4.47Å; V122-I154 HydrophobicContact CG2-CG1 4.49Å; V122-I154 HydrophobicContact CG2-CG2 4.28Å; V122-E157 HydrophobicContact CG1-CB 4.28Å |
| 123 | R | 98.7 | Very high | 97.7 | Very high | 87 Ų | 87 | 41.3 Ų | 41.3 | 33% | 0.328 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -57.7 | -53.4 | 177.9 | -73.2 | 176 | 174.3 | 150.3 | -2.5 | 111.9 | L119 D120 L125 L126 E127 E157 | L119-R123 PolarHBondContact O-N 3.18Å; D120-R123 PolarHBondContact O-N 3.18Å; D120-R123 IonicContact OD1-NH1 2.67Å; D120-R123 PolarHBondContact OD1-NH1 2.84Å; R123-L125 VanDerWaalsContact C-N 3.3Å; R123-L125 PolarHBondContact O-N 3.28Å; R123-L126 PolarHBondContact O-N 2.95Å; R123-E127 WeakPolarHBondContact O-CB 3.49Å; R123-E127 WeakPolarHBondContact O-CG 2.97Å; R123-E127 PolarHBondContact O-N 3.35Å; R123-E157 HydrophobicContact CG-CG 3.88Å; R123-E157 IonicContact CZ-OE1 2.84Å; R123-E157 IonicContact NE-OE1 3.73Å; R123-E157 PolarHBondContact NE-OE1 3.47Å; R123-E157 IonicContact NH2-OE1 3.49Å; R123-E157 PolarHBondContact NH2-OE1 3.27Å |
| 124 | V | 98.6 | Very high | 97.4 | Very high | 19 Ų | 19 | 41.9 Ų | 41.9 | 12% | 0.115 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -62.3 | -38.5 | -178.3 | 172.2 | 0 | 0 | 0 | 0 | 111.8 | L86 L89 Q90 L93 D120 C121 E127 A128 | L86-V124 HydrophobicContact CD1-CB 4.26Å; L86-V124 HydrophobicContact CD1-CG2 3.65Å; L89-V124 HydrophobicContact CD2-CB 3.9Å; L89-V124 HydrophobicContact CD2-CG1 3.48Å; L89-V124 VanDerWaalsContact CD2-CG1 3.48Å; Q90-V124 HydrophobicContact CG-CG1 3.91Å; Q90-V124 HydrophobicContact CG-CG2 4.31Å; L93-V124 HydrophobicContact CD1-CG1 3.6Å; D120-V124 PolarHBondContact O-N 3.08Å; D120-V124 VanDerWaalsContact O-N 3.12Å; C121-V124 PolarHBondContact O-N 3.4Å; V124-E127 PolarHBondContact O-N 3.1Å; V124-A128 VanDerWaalsContact O-CB 3.26Å; V124-A128 WeakPolarHBondContact O-CB 3.36Å; V124-A128 PolarHBondContact O-N 2.91Å |
| 125 | L | 98.7 | Very high | 97.2 | Very high | 0 Ų | 0 | 42.5 Ų | 42.5 | 0% | 0 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -65.5 | -42.7 | 176.5 | -73.1 | 168.4 | 0 | 0 | 0 | 111.8 | L77 A81 L89 L93 V99 P109 L110 A113 C121 V122 R123 A128 G129 A130 | L77-L125 HydrophobicContact CD1-CD2 4.46Å; L77-L125 HydrophobicContact CD2-CD2 4.41Å; A81-L125 HydrophobicContact CB-CD1 4.37Å; L89-L125 HydrophobicContact CD1-CD1 4.13Å; L89-L125 HydrophobicContact CD1-CD2 4.2Å; L89-L125 HydrophobicContact CD1-CG 4.12Å; L89-L125 HydrophobicContact CD2-CD2 4.33Å; L89-L125 HydrophobicContact CD2-CG 4.21Å; L89-L125 HydrophobicContact CG-CD2 4.49Å; L93-L125 HydrophobicContact CD1-CD2 4.37Å; L93-L125 HydrophobicContact CD2-CD2 4.48Å; V99-L125 HydrophobicContact CG1-CD2 4.22Å; P109-L125 HydrophobicContact CB-CD1 4.2Å; P109-L125 HydrophobicContact CB-CD2 4.18Å; L110-L125 HydrophobicContact CB-CD1 4.37Å; L110-L125 HydrophobicContact CD1-CB 4.07Å; A113-L125 HydrophobicContact CB-CD1 4.07Å; C121-L125 WeakPolarHBondContact O-CB 3.46Å; C121-L125 WeakPolarHBondContact O-CD1 3.44Å; C121-L125 WeakPolarHBondContact O-CG 3.45Å; C121-L125 PolarHBondContact O-N 3.06Å; V122-L125 PolarHBondContact O-N 3.12Å; R123-L125 VanDerWaalsContact C-N 3.3Å; R123-L125 PolarHBondContact O-N 3.28Å; L125-A128 CarbonylContact O-C 3.43Å; L125-A128 PolarHBondContact O-N 2.67Å; L125-G129 PolarHBondContact O-N 3.22Å; L125-A130 HydrophobicContact CB-CB 4.12Å; L125-A130 WeakPolarHBondContact O-CB 3.21Å; L125-A130 PolarHBondContact O-N 3.07Å |
| 126 | L | 98.6 | Very high | 96.9 | Very high | 9 Ų | 9 | 46.3 Ų | 46.3 | 5% | 0.047 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -65.5 | -42.1 | 176.4 | -69.7 | 169.3 | 0 | 0 | 0 | 111.9 | L110 V122 R123 A128 G129 P132 E157 L158 H161 | L110-L126 HydrophobicContact CD1-CD2 4.09Å; L110-L126 HydrophobicContact CD1-CG 3.94Å; L110-L126 HydrophobicContact CD2-CD2 3.84Å; V122-L126 HydrophobicContact CG1-CD1 3.72Å; V122-L126 HydrophobicContact CG1-CG 4.4Å; V122-L126 WeakPolarHBondContact O-CB 3.27Å; V122-L126 VanDerWaalsContact O-CG 3.28Å; V122-L126 WeakPolarHBondContact O-CG 3.15Å; V122-L126 PolarHBondContact O-N 3.02Å; R123-L126 PolarHBondContact O-N 2.95Å; L126-A128 VanDerWaalsContact C-N 3.27Å; L126-A128 PolarHBondContact O-N 3.19Å; L126-G129 PolarHBondContact O-N 3.28Å; L126-P132 HydrophobicContact CD2-CB 3.97Å; L126-P132 HydrophobicContact CD2-CG 3.96Å; L126-E157 HydrophobicContact CD1-CB 3.93Å; L126-L158 HydrophobicContact CD1-CD2 4.36Å; L126-L158 HydrophobicContact CD2-CD2 4.42Å; L126-H161 HydrophobicContact CD1-CB 4.35Å; L126-H161 HydrophobicContact CD2-CB 4.06Å |
| 127 | E | 98.1 | Very high | 96.5 | Very high | 144 Ų | 144 | 49.7 Ų | 49.7 | 67% | 0.673 | 29% | 0.289 | S | S | * | . | H | α-helix | trans | -62.6 | -33.8 | 174 | -72.7 | 171.7 | -176.8 | 0 | 0 | 112.3 | R123 V124 G129 | R123-E127 WeakPolarHBondContact O-CB 3.49Å; R123-E127 WeakPolarHBondContact O-CG 2.97Å; R123-E127 PolarHBondContact O-N 3.35Å; V124-E127 PolarHBondContact O-N 3.1Å; E127-G129 PolarHBondContact O-N 3.16Å |
| 128 | A | 97.8 | Very high | 96 | Very high | 45 Ų | 45 | 48.1 Ų | 48.1 | 37% | 0.372 | 27% | 0.27 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -76.8 | 2 | 173.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | L93 V99 V124 L125 L126 | L93-A128 HydrophobicContact CD1-CB 3.94Å; L93-A128 HydrophobicContact CD2-CB 4.09Å; V99-A128 HydrophobicContact CG1-CB 4.32Å; V99-A128 HydrophobicContact CG2-CB 4.27Å; V124-A128 VanDerWaalsContact O-CB 3.26Å; V124-A128 WeakPolarHBondContact O-CB 3.36Å; V124-A128 PolarHBondContact O-N 2.91Å; L125-A128 CarbonylContact O-C 3.43Å; L125-A128 PolarHBondContact O-N 2.67Å; L126-A128 VanDerWaalsContact C-N 3.27Å; L126-A128 PolarHBondContact O-N 3.19Å |
| 129 | G | 97.2 | Very high | 95.3 | Very high | 55 Ų | 55 | 50.4 Ų | 50.4 | 57% | 0.567 | 28% | 0.284 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 91 | 17.7 | 175 | 0 | 0 | 0 | 0 | 0 | 115.3 | L125 L126 E127 | L125-G129 PolarHBondContact O-N 3.22Å; L126-G129 PolarHBondContact O-N 3.28Å; E127-G129 PolarHBondContact O-N 3.16Å |
| 130 | A | 97.9 | Very high | 94.7 | Very high | 4 Ų | 4 | 50.6 Ų | 50.6 | 3% | 0.033 | 29% | 0.289 | C | S | . | . | trans | -57.1 | 138.5 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | V99 L110 L125 P132 | V99-A130 HydrophobicContact CG1-CB 3.59Å; L110-A130 HydrophobicContact CB-CB 4.14Å; L110-A130 HydrophobicContact CD2-CB 4.15Å; L125-A130 HydrophobicContact CB-CB 4.12Å; L125-A130 WeakPolarHBondContact O-CB 3.21Å; L125-A130 PolarHBondContact O-N 3.07Å; A130-P132 WeakPolarHBondContact O-CD 3.22Å; A130-P132 VanDerWaalsContact O-N 3.17Å | ||
| 131 | C | 97.3 | Very high | 94.4 | Very high | 63 Ų | 63 | 47 Ų | 47 | 43% | 0.426 | 27% | 0.27 | S | S | . | . | trans | -62.5 | 115.4 | 175.3 | -71.7 | 0 | 0 | 0 | 0 | 111 | D100 L110 G133 G134 | D100-C131 PolarHBondContact OD1-N 2.74Å; D100-C131 PolarHBondContact OD2-N 2.99Å; D100-C131 PolarHBondContact OD2-SG 3.33Å; L110-C131 WeakPolarHBondContact CD2-O 3.48Å; C131-G133 VanDerWaalsContact C-N 3.25Å; C131-G133 PolarHBondContact O-N 3.08Å; C131-G134 WeakPolarHBondContact O-CA 3.4Å; C131-G134 PolarHBondContact O-N 2.76Å | ||
| 132 | P | 96 | Very high | 94.2 | Very high | 30 Ų | 30 | 46.8 Ų | 46.8 | 20% | 0.195 | 27% | 0.269 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -62.5 | -30.2 | -175.2 | -21.5 | 31.1 | 0 | 0 | 0 | 113.8 | L126 A130 G134 H161 A163 | L126-P132 HydrophobicContact CD2-CB 3.97Å; L126-P132 HydrophobicContact CD2-CG 3.96Å; A130-P132 WeakPolarHBondContact O-CD 3.22Å; A130-P132 VanDerWaalsContact O-N 3.17Å; P132-G134 PolarHBondContact O-N 3.22Å; P132-H161 HydrophobicContact CB-CB 4.39Å; P132-H161 HydrophobicContact CG-CB 3.89Å; P132-H161 VanDerWaalsContact CG-O 3.25Å; P132-H161 WeakPolarHBondContact CG-O 3.48Å; P132-A163 HydrophobicContact CB-CB 3.71Å |
| 133 | G | 93 | Very high | 94.1 | Very high | 35 Ų | 35 | 46.8 Ų | 46.8 | 36% | 0.361 | 27% | 0.269 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -75 | -7.3 | 174.5 | 0 | 0 | 0 | 0 | 0 | 114.3 | C131 P142 | C131-G133 VanDerWaalsContact C-N 3.25Å; C131-G133 PolarHBondContact O-N 3.08Å; G133-P142 VanDerWaalsContact C-CD 3.48Å; G133-P142 WeakPolarHBondContact O-CD 3.22Å |
| 134 | G | 93.7 | Very high | 93.8 | Very high | 12 Ų | 12 | 42.9 Ų | 42.9 | 12% | 0.124 | 26% | 0.255 | C | S | . | . | trans | 65.9 | -162.9 | -169.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | C131 P132 | C131-G134 WeakPolarHBondContact O-CA 3.4Å; C131-G134 PolarHBondContact O-N 2.76Å; P132-G134 PolarHBondContact O-N 3.22Å | ||
| 135 | S | 92 | Very high | 93.6 | Very high | 17 Ų | 17 | 42.3 Ų | 42.3 | 12% | 0.119 | 25% | 0.251 | C | S | . | . | trans | -72.1 | 136.3 | -178.4 | -176.5 | 0 | 0 | 0 | 0 | 113.2 | L102 A106 Y137 N138 | L102-S135 WeakPolarHBondContact CD2-OG 3.48Å; A106-S135 WeakPolarHBondContact O-CB 2.92Å; A106-S135 PolarHBondContact O-OG 2.66Å; S135-Y137 PolarHBondContact O-N 3.16Å; S135-Y137 PolarHBondContact OG-N 2.88Å; S135-Y137 VanDerWaalsContact OG-N 3.14Å; S135-N138 PolarHBondContact O-N 3.1Å | ||
| 136 | I | 89.8 | Confident | 93.5 | Very high | 125 Ų | 125 | 42.3 Ų | 42.3 | 64% | 0.641 | 25% | 0.251 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.6 | -16.8 | 170.5 | 63.2 | 169 | 0 | 0 | 0 | 113.2 | K170 | I136-K170 VanDerWaalsContact C-NZ 3.35Å; I136-K170 PolarHBondContact O-NZ 3.22Å |
| 137 | Y | 88.9 | Confident | 93.4 | Very high | 169 Ų | 169 | 41.9 Ų | 41.9 | 66% | 0.663 | 25% | 0.249 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -93 | -13.1 | 178 | -53.2 | -67.9 | 0 | 0 | 0 | 112.8 | L102 S135 | L102-Y137 HydrophobicContact CD1-CD2 4.05Å; S135-Y137 PolarHBondContact O-N 3.16Å; S135-Y137 PolarHBondContact OG-N 2.88Å; S135-Y137 VanDerWaalsContact OG-N 3.14Å |
| 138 | N | 86.4 | Confident | 93.1 | Very high | 12 Ų | 12 | 40 Ų | 40 | 6% | 0.064 | 24% | 0.235 | C | C | . | . | S | Bend | trans | -75.2 | 143.7 | 172.5 | -166.4 | 2.2 | 0 | 0 | 0 | 110.1 | A106 F111 S135 C140 K170 | A106-N138 WeakPolarHBondContact O-CB 3.26Å; F111-N138 WeakPolarHBondContact CD2-ND2 3.48Å; S135-N138 PolarHBondContact O-N 3.1Å; N138-C140 VanDerWaalsContact C-N 3.32Å; N138-C140 PolarHBondContact ND2-O 3.17Å; N138-C140 PolarHBondContact OD1-N 2.6Å; N138-K170 PolarHBondContact O-NZ 3.34Å |
| 139 | N | 83.8 | Confident | 93 | Very high | 102 Ų | 102 | 41.4 Ų | 41.4 | 55% | 0.545 | 24% | 0.237 | S | C | . | . | S | Bend | trans | -79.8 | -16.3 | 178.3 | -68.5 | -27.6 | 0 | 0 | 0 | 113.2 | K170 | N139-K170 HydrophobicContact CB-CB 4.34Å; N139-K170 PolarHBondContact O-N 3.38Å |
| 140 | C | 86.6 | Confident | 93 | Very high | 44 Ų | 44 | 39.8 Ų | 39.8 | 30% | 0.297 | 22% | 0.22 | S | C | . | . | S | Bend | trans | -123.6 | 140.1 | 177.6 | -164.3 | 0 | 0 | 0 | 0 | 110 | F111 N138 | F111-C140 HydrophobicContact CE2-CB 3.95Å; F111-C140 HydrophobicContact CZ-CB 4.15Å; N138-C140 VanDerWaalsContact C-N 3.32Å; N138-C140 PolarHBondContact ND2-O 3.17Å; N138-C140 PolarHBondContact OD1-N 2.6Å |
| 141 | S | 91 | Very high | 92.9 | Very high | 11 Ų | 11 | 40.8 Ų | 40.8 | 8% | 0.077 | 23% | 0.229 | C | C | . | . | trans | -95.4 | 158.3 | 174.1 | 71.3 | 0 | 0 | 0 | 0 | 111 | V143 L144 T145 V167 | S141-V143 VanDerWaalsContact C-N 3.28Å; S141-V143 PolarHBondContact O-N 3.11Å; S141-L144 PolarHBondContact O-N 3.17Å; S141-L144 VanDerWaalsContact OG-CG 3.31Å; S141-L144 WeakPolarHBondContact OG-CG 3.44Å; S141-L144 PolarHBondContact OG-N 3.43Å; S141-T145 PolarHBondContact O-N 3.47Å; S141-T145 PolarHBondContact O-OG1 2.8Å; S141-V167 WeakPolarHBondContact OG-CG1 3.35Å | ||
| 142 | P | 95.4 | Very high | 93 | Very high | 0 Ų | 0 | 40.1 Ų | 40.1 | 0% | 0 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -56.7 | -39.9 | 172.9 | -24.8 | 35.2 | 0 | 0 | 0 | 112.9 | L110 F111 V114 G133 L144 T145 A146 L158 | L110-P142 HydrophobicContact CD2-CG 4.48Å; F111-P142 HydrophobicContact CB-CG 4.43Å; F111-P142 HydrophobicContact CD2-CG 4.19Å; V114-P142 HydrophobicContact CB-CB 4.37Å; V114-P142 HydrophobicContact CG1-CB 4.25Å; V114-P142 WeakPolarHBondContact CG1-O 3.5Å; V114-P142 HydrophobicContact CG2-CB 4.07Å; G133-P142 VanDerWaalsContact C-CD 3.48Å; G133-P142 WeakPolarHBondContact O-CD 3.22Å; P142-L144 PolarHBondContact O-N 3.2Å; P142-T145 PolarHBondContact O-N 3.33Å; P142-A146 WeakPolarHBondContact O-CB 3.33Å; P142-A146 PolarHBondContact O-N 2.98Å; P142-L158 HydrophobicContact CB-CD1 3.81Å; P142-L158 HydrophobicContact CB-CD2 3.97Å |
| 143 | V | 95.7 | Very high | 93.1 | Very high | 0 Ų | 0 | 40.8 Ų | 40.8 | 0% | 0 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -61.2 | -41.4 | 178.1 | 179.3 | 0 | 0 | 0 | 0 | 111.8 | S141 A146 A147 L155 L158 L159 A163 P184 L200 | S141-V143 VanDerWaalsContact C-N 3.28Å; S141-V143 PolarHBondContact O-N 3.11Å; V143-A146 PolarHBondContact O-N 3.28Å; V143-A147 VanDerWaalsContact O-CB 3.27Å; V143-A147 WeakPolarHBondContact O-CB 3.32Å; V143-A147 PolarHBondContact O-N 3.45Å; V143-L155 HydrophobicContact CB-CD1 4.45Å; V143-L155 HydrophobicContact CG1-CD1 3.74Å; V143-L158 HydrophobicContact CG2-CB 4.3Å; V143-L158 HydrophobicContact CG2-CD1 4.29Å; V143-L159 HydrophobicContact CG1-CD2 4.45Å; V143-L159 HydrophobicContact CG2-CD2 4.47Å; V143-A163 HydrophobicContact CG2-CB 3.49Å; V143-A163 VanDerWaalsContact CG2-CB 3.49Å; V143-P184 HydrophobicContact CB-CG 4.47Å; V143-P184 HydrophobicContact CG1-CB 3.87Å; V143-P184 HydrophobicContact CG1-CG 3.57Å; V143-L200 HydrophobicContact CG1-CD2 4.18Å |
| 144 | L | 92.9 | Very high | 93.4 | Very high | 5 Ų | 5 | 39.4 Ų | 39.4 | 3% | 0.026 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -62.4 | -44.8 | 176.7 | -74.3 | 168.1 | 0 | 0 | 0 | 111.4 | S141 P142 R148 V167 A169 S182 P184 L187 | S141-L144 PolarHBondContact O-N 3.17Å; S141-L144 VanDerWaalsContact OG-CG 3.31Å; S141-L144 WeakPolarHBondContact OG-CG 3.44Å; S141-L144 PolarHBondContact OG-N 3.43Å; P142-L144 PolarHBondContact O-N 3.2Å; L144-R148 WeakPolarHBondContact O-CB 3.48Å; L144-R148 PolarHBondContact O-N 2.99Å; L144-V167 HydrophobicContact CD1-CG1 4.2Å; L144-V167 HydrophobicContact CG-CG1 4.47Å; L144-A169 HydrophobicContact CD1-CB 3.9Å; L144-S182 VanDerWaalsContact CD2-O 3.31Å; L144-S182 WeakPolarHBondContact CD2-O 3.37Å; L144-P184 HydrophobicContact CD2-CG 3.87Å; L144-P184 HydrophobicContact CG-CG 4.36Å; L144-L187 HydrophobicContact CB-CD1 4.28Å; L144-L187 HydrophobicContact CD2-CD1 3.68Å |
| 145 | T | 94.5 | Very high | 93.6 | Very high | 6 Ų | 6 | 38.9 Ų | 38.9 | 4% | 0.037 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -63.1 | -49.7 | 177.6 | -53 | 0 | 0 | 0 | 0 | 111.2 | F111 V114 S141 P142 A147 R148 D149 | F111-T145 WeakPolarHBondContact CE2-OG1 3.42Å; V114-T145 HydrophobicContact CG1-CG2 4.29Å; S141-T145 PolarHBondContact O-N 3.47Å; S141-T145 PolarHBondContact O-OG1 2.8Å; P142-T145 PolarHBondContact O-N 3.33Å; T145-A147 VanDerWaalsContact C-N 3.33Å; T145-A147 PolarHBondContact O-N 3.02Å; T145-R148 PolarHBondContact O-N 2.95Å; T145-D149 WeakPolarHBondContact CG2-OD2 3.44Å; T145-D149 WeakPolarHBondContact O-CB 3.49Å; T145-D149 PolarHBondContact O-N 3.5Å |
| 146 | A | 97.1 | Very high | 93.8 | Very high | 1 Ų | 1 | 43.3 Ų | 43.3 | 1% | 0.008 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -62.8 | -37.8 | -179.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | V114 P142 V143 G150 A151 I154 L155 L158 | V114-A146 HydrophobicContact CG1-CB 4.18Å; P142-A146 WeakPolarHBondContact O-CB 3.33Å; P142-A146 PolarHBondContact O-N 2.98Å; V143-A146 PolarHBondContact O-N 3.28Å; A146-G150 PolarHBondContact O-N 2.93Å; A146-G150 VanDerWaalsContact O-N 3.14Å; A146-A151 HydrophobicContact CB-CB 4.34Å; A146-A151 PolarHBondContact O-N 3.42Å; A146-I154 HydrophobicContact CB-CG2 4.06Å; A146-L155 HydrophobicContact CB-CB 4.09Å; A146-L155 HydrophobicContact CB-CD1 4.19Å; A146-L158 HydrophobicContact CB-CD1 4.15Å |
| 147 | A | 95.6 | Very high | 94.2 | Very high | 0 Ų | 0 | 39.3 Ų | 39.3 | 0% | 0 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -69.4 | -40 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | V143 T145 P184 H193 L200 | V143-A147 VanDerWaalsContact O-CB 3.27Å; V143-A147 WeakPolarHBondContact O-CB 3.32Å; V143-A147 PolarHBondContact O-N 3.45Å; T145-A147 VanDerWaalsContact C-N 3.33Å; T145-A147 PolarHBondContact O-N 3.02Å; A147-P184 HydrophobicContact CB-CB 3.82Å; A147-P184 WeakPolarHBondContact CB-O 3.44Å; A147-H193 PolarHBondContact O-CD2 3.39Å; A147-L200 HydrophobicContact CB-CD1 4.1Å |
| 148 | R | 93.3 | Very high | 94.6 | Very high | 103 Ų | 103 | 31.2 Ų | 31.2 | 39% | 0.389 | 18% | 0.175 | S | C | . | . | H | α-helix | trans | -65.4 | -40.6 | 175.8 | -173.2 | -163.3 | 66.3 | -176.1 | -5.1 | 112.4 | L144 T145 G150 L187 Y191 H193 | L144-R148 WeakPolarHBondContact O-CB 3.48Å; L144-R148 PolarHBondContact O-N 2.99Å; T145-R148 PolarHBondContact O-N 2.95Å; R148-G150 VanDerWaalsContact C-N 3.33Å; R148-L187 HydrophobicContact CB-CB 4.33Å; R148-L187 HydrophobicContact CB-CD1 4.26Å; R148-Y191 HydrophobicContact CG-CD2 3.94Å; R148-Y191 HydrophobicContact CG-CE1 4.35Å; R148-Y191 HydrophobicContact CG-CE2 3.61Å; R148-Y191 HydrophobicContact CG-CG 4.45Å; R148-H193 PolarHBondContact O-CD2 3.05Å; R148-H193 PolarHBondContact O-NE2 3.41Å; R148-H193 VanDerWaalsContact O-NE2 3.08Å |
| 149 | D | 94.8 | Very high | 95 | Very high | 75 Ų | 75 | 31 Ų | 31 | 40% | 0.401 | 17% | 0.174 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -89.5 | -1.7 | -174 | -62.2 | -14 | 0 | 0 | 0 | 112.6 | T145 A151 | T145-D149 WeakPolarHBondContact CG2-OD2 3.44Å; T145-D149 WeakPolarHBondContact O-CB 3.49Å; T145-D149 PolarHBondContact O-N 3.5Å; D149-A151 VanDerWaalsContact C-N 3.29Å; D149-A151 PolarHBondContact O-N 3.31Å |
| 150 | G | 96.5 | Very high | 95.5 | Very high | 21 Ų | 21 | 28.3 Ų | 28.3 | 22% | 0.216 | 17% | 0.169 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 71.8 | 21.3 | 179.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | A146 R148 V152 H193 | A146-G150 PolarHBondContact O-N 2.93Å; A146-G150 VanDerWaalsContact O-N 3.14Å; R148-G150 VanDerWaalsContact C-N 3.33Å; G150-V152 VanDerWaalsContact C-N 3.28Å; G150-V152 PolarHBondContact O-N 2.84Å; G150-H193 WeakPolarHBondContact CA-CD2 3.41Å; G150-H193 PolarHBondContact N-CD2 3.43Å; G150-H193 VanDerWaalsContact N-CD2 3.32Å; G150-H193 PolarHBondContact N-NE2 3.32Å |
| 151 | A | 97.5 | Very high | 95.9 | Very high | 26 Ų | 26 | 30 Ų | 30 | 22% | 0.215 | 17% | 0.173 | C | C | . | . | trans | -79.7 | 70.7 | -175.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | A146 D149 A153 I154 L155 | A146-A151 HydrophobicContact CB-CB 4.34Å; A146-A151 PolarHBondContact O-N 3.42Å; D149-A151 VanDerWaalsContact C-N 3.29Å; D149-A151 PolarHBondContact O-N 3.31Å; A151-A153 VanDerWaalsContact C-N 3.35Å; A151-A153 PolarHBondContact O-N 3.43Å; A151-I154 HydrophobicContact CB-CB 4.02Å; A151-I154 HydrophobicContact CB-CD1 4.14Å; A151-I154 HydrophobicContact CB-CG1 4.36Å; A151-I154 PolarHBondContact O-N 3.39Å; A151-I154 VanDerWaalsContact O-N 3.14Å; A151-L155 WeakPolarHBondContact O-CB 3.24Å; A151-L155 PolarHBondContact O-N 3.04Å | ||
| 152 | V | 98.1 | Very high | 95.9 | Very high | 48 Ų | 48 | 32.3 Ų | 32.3 | 29% | 0.291 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -52.6 | -47.6 | -173.3 | -177 | 0 | 0 | 0 | 0 | 112.5 | G150 I154 L155 Q156 D195 L199 | G150-V152 VanDerWaalsContact C-N 3.28Å; G150-V152 PolarHBondContact O-N 2.84Å; V152-I154 PolarHBondContact O-N 2.99Å; V152-L155 PolarHBondContact O-N 3.18Å; V152-Q156 WeakPolarHBondContact O-CB 3.32Å; V152-Q156 PolarHBondContact O-N 3.4Å; V152-D195 HydrophobicContact CG1-CB 4.15Å; V152-D195 HydrophobicContact CG2-CB 3.63Å; V152-L199 HydrophobicContact CG1-CD1 4.31Å |
| 153 | A | 98.4 | Very high | 95.8 | Very high | 44 Ų | 44 | 32.8 Ų | 32.8 | 36% | 0.364 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -64.6 | -41.7 | -178.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | L119 A151 Q156 E157 | L119-A153 HydrophobicContact CD1-CB 4.09Å; L119-A153 HydrophobicContact CD2-CB 3.73Å; A151-A153 VanDerWaalsContact C-N 3.35Å; A151-A153 PolarHBondContact O-N 3.43Å; A153-Q156 WeakPolarHBondContact O-CB 3.5Å; A153-Q156 PolarHBondContact O-N 2.97Å; A153-E157 WeakPolarHBondContact O-CG 3.47Å; A153-E157 PolarHBondContact O-N 3.19Å; A153-E157 VanDerWaalsContact O-N 3.1Å |
| 154 | I | 98.6 | Very high | 95.6 | Very high | 7 Ų | 7 | 39.5 Ų | 39.5 | 4% | 0.036 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -65.7 | -44.3 | 176.4 | -68.7 | 178.7 | 0 | 0 | 0 | 110.3 | V114 L119 V122 A146 A151 V152 Q156 E157 L158 | V114-I154 HydrophobicContact CB-CG2 4.28Å; V114-I154 HydrophobicContact CG1-CG2 3.97Å; V114-I154 HydrophobicContact CG2-CG2 3.69Å; L119-I154 HydrophobicContact CB-CG1 4.18Å; L119-I154 HydrophobicContact CD1-CG1 3.8Å; V122-I154 HydrophobicContact CG1-CG2 4.34Å; V122-I154 HydrophobicContact CG2-CD1 4.47Å; V122-I154 HydrophobicContact CG2-CG1 4.49Å; V122-I154 HydrophobicContact CG2-CG2 4.28Å; A146-I154 HydrophobicContact CB-CG2 4.06Å; A151-I154 HydrophobicContact CB-CB 4.02Å; A151-I154 HydrophobicContact CB-CD1 4.14Å; A151-I154 HydrophobicContact CB-CG1 4.36Å; A151-I154 PolarHBondContact O-N 3.39Å; A151-I154 VanDerWaalsContact O-N 3.14Å; V152-I154 PolarHBondContact O-N 2.99Å; I154-Q156 VanDerWaalsContact C-N 3.27Å; I154-Q156 PolarHBondContact O-N 3.02Å; I154-E157 PolarHBondContact O-N 3.3Å; I154-L158 HydrophobicContact CG2-CD1 3.99Å; I154-L158 HydrophobicContact CG2-CG 4.36Å; I154-L158 WeakPolarHBondContact O-CG 3.25Å; I154-L158 PolarHBondContact O-N 2.99Å |
| 155 | L | 98 | Very high | 95.5 | Very high | 0 Ų | 0 | 39.6 Ų | 39.6 | 0% | 0 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -60.5 | -39.7 | 177.5 | -173 | 62.2 | 0 | 0 | 0 | 111.5 | V143 A146 A151 V152 L158 L159 C196 L199 L200 | V143-L155 HydrophobicContact CB-CD1 4.45Å; V143-L155 HydrophobicContact CG1-CD1 3.74Å; A146-L155 HydrophobicContact CB-CB 4.09Å; A146-L155 HydrophobicContact CB-CD1 4.19Å; A151-L155 WeakPolarHBondContact O-CB 3.24Å; A151-L155 PolarHBondContact O-N 3.04Å; V152-L155 PolarHBondContact O-N 3.18Å; L155-L158 PolarHBondContact O-N 2.97Å; L155-L159 HydrophobicContact CD1-CD1 4.31Å; L155-L159 HydrophobicContact CD1-CG 4.32Å; L155-L159 HydrophobicContact CG-CD1 4.2Å; L155-L159 WeakPolarHBondContact O-CB 3.31Å; L155-L159 WeakPolarHBondContact O-CG 3.25Å; L155-L159 PolarHBondContact O-N 3.06Å; L155-C196 HydrophobicContact CD2-CB 3.69Å; L155-L199 HydrophobicContact CB-CD2 4.27Å; L155-L199 HydrophobicContact CD2-CD2 3.94Å; L155-L199 HydrophobicContact CG-CD2 3.68Å; L155-L200 HydrophobicContact CD1-CD2 4.24Å; L155-L200 HydrophobicContact CD2-CD1 4.29Å; L155-L200 HydrophobicContact CD2-CD2 4.37Å; L155-L200 HydrophobicContact CD2-CG 4.01Å |
| 156 | Q | 97 | Very high | 95.3 | Very high | 110 Ų | 110 | 41.1 Ų | 41.1 | 51% | 0.514 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -60.7 | -45.4 | 174.2 | -173.3 | 174.3 | -12.5 | 0 | 0 | 112.1 | V152 A153 I154 G160 L199 | V152-Q156 WeakPolarHBondContact O-CB 3.32Å; V152-Q156 PolarHBondContact O-N 3.4Å; A153-Q156 WeakPolarHBondContact O-CB 3.5Å; A153-Q156 PolarHBondContact O-N 2.97Å; I154-Q156 VanDerWaalsContact C-N 3.27Å; I154-Q156 PolarHBondContact O-N 3.02Å; Q156-G160 WeakPolarHBondContact O-CA 3.38Å; Q156-G160 PolarHBondContact O-N 3.37Å; Q156-L199 HydrophobicContact CB-CD1 3.73Å; Q156-L199 HydrophobicContact CG-CD1 4.05Å |
| 157 | E | 97.8 | Very high | 94.8 | Very high | 41 Ų | 41 | 42.2 Ų | 42.2 | 19% | 0.192 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -63.1 | -45.1 | 177.3 | -65.6 | -60.3 | 164.6 | 0 | 0 | 111.6 | L119 V122 R123 L126 A153 I154 G160 H161 | L119-E157 HydrophobicContact CD1-CG 3.8Å; V122-E157 HydrophobicContact CG1-CB 4.28Å; R123-E157 HydrophobicContact CG-CG 3.88Å; R123-E157 IonicContact CZ-OE1 2.84Å; R123-E157 IonicContact NE-OE1 3.73Å; R123-E157 PolarHBondContact NE-OE1 3.47Å; R123-E157 IonicContact NH2-OE1 3.49Å; R123-E157 PolarHBondContact NH2-OE1 3.27Å; L126-E157 HydrophobicContact CD1-CB 3.93Å; A153-E157 WeakPolarHBondContact O-CG 3.47Å; A153-E157 PolarHBondContact O-N 3.19Å; A153-E157 VanDerWaalsContact O-N 3.1Å; I154-E157 PolarHBondContact O-N 3.3Å; E157-G160 PolarHBondContact O-N 2.9Å; E157-H161 PolarHBondContact O-N 3.26Å; E157-H161 PolarHBondContact O-ND1 2.81Å; E157-H161 IonicContact OE2-CE1 2.69Å |
| 158 | L | 97.6 | Very high | 94 | Very high | 0 Ų | 0 | 47.5 Ų | 47.5 | 0% | 0 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -60 | -50.7 | 178.9 | -68.7 | 170.8 | 0 | 0 | 0 | 111.6 | L110 V114 L126 P142 V143 A146 I154 L155 G160 H161 G162 A163 | L110-L158 HydrophobicContact CD1-CD2 4.44Å; L110-L158 HydrophobicContact CD2-CD2 4.1Å; L110-L158 HydrophobicContact CG-CD2 4.49Å; V114-L158 HydrophobicContact CG2-CD1 4.24Å; V114-L158 HydrophobicContact CG2-CD2 4.38Å; L126-L158 HydrophobicContact CD1-CD2 4.36Å; L126-L158 HydrophobicContact CD2-CD2 4.42Å; P142-L158 HydrophobicContact CB-CD1 3.81Å; P142-L158 HydrophobicContact CB-CD2 3.97Å; V143-L158 HydrophobicContact CG2-CB 4.3Å; V143-L158 HydrophobicContact CG2-CD1 4.29Å; A146-L158 HydrophobicContact CB-CD1 4.15Å; I154-L158 HydrophobicContact CG2-CD1 3.99Å; I154-L158 HydrophobicContact CG2-CG 4.36Å; I154-L158 WeakPolarHBondContact O-CG 3.25Å; I154-L158 PolarHBondContact O-N 2.99Å; L155-L158 PolarHBondContact O-N 2.97Å; L158-G160 VanDerWaalsContact C-N 3.32Å; L158-H161 PolarHBondContact O-N 3.28Å; L158-G162 PolarHBondContact O-N 3.27Å; L158-A163 HydrophobicContact CB-CB 4.05Å; L158-A163 WeakPolarHBondContact O-CB 3.2Å; L158-A163 PolarHBondContact O-N 3.41Å |
| 159 | L | 95.1 | Very high | 92.9 | Very high | 8 Ų | 8 | 43.2 Ų | 43.2 | 4% | 0.042 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -70.7 | -30.1 | 179.8 | -62.9 | -178.8 | 0 | 0 | 0 | 112.1 | V143 L155 H161 G162 A163 A165 L199 L200 H203 | V143-L159 HydrophobicContact CG1-CD2 4.45Å; V143-L159 HydrophobicContact CG2-CD2 4.47Å; L155-L159 HydrophobicContact CD1-CD1 4.31Å; L155-L159 HydrophobicContact CD1-CG 4.32Å; L155-L159 HydrophobicContact CG-CD1 4.2Å; L155-L159 WeakPolarHBondContact O-CB 3.31Å; L155-L159 WeakPolarHBondContact O-CG 3.25Å; L155-L159 PolarHBondContact O-N 3.06Å; L159-H161 VanDerWaalsContact C-N 3.3Å; L159-G162 PolarHBondContact O-N 3.44Å; L159-A163 HydrophobicContact CD2-CB 4.3Å; L159-A163 VanDerWaalsContact CD2-O 3.25Å; L159-A163 WeakPolarHBondContact CD2-O 3.45Å; L159-A165 HydrophobicContact CD2-CB 4.26Å; L159-L199 HydrophobicContact CD1-CD2 3.31Å; L159-L199 HydrophobicContact CG-CD2 4.31Å; L159-L200 HydrophobicContact CD1-CD2 4.01Å; L159-H203 HydrophobicContact CB-CB 4.23Å; L159-H203 HydrophobicContact CD1-CB 3.64Å; L159-H203 HydrophobicContact CD2-CB 4.46Å; L159-H203 HydrophobicContact CG-CB 4.34Å |
| 160 | G | 93.6 | Very high | 91.7 | Very high | 44 Ų | 44 | 44 Ų | 44 | 45% | 0.454 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -63.8 | -34.2 | 173.1 | 0 | 0 | 0 | 0 | 0 | 113 | Q156 E157 L158 G162 | Q156-G160 WeakPolarHBondContact O-CA 3.38Å; Q156-G160 PolarHBondContact O-N 3.37Å; E157-G160 PolarHBondContact O-N 2.9Å; L158-G160 VanDerWaalsContact C-N 3.32Å; G160-G162 VanDerWaalsContact C-N 3.29Å |
| 161 | H | 94.7 | Very high | 90.1 | Very high | 80 Ų | 80 | 47.7 Ų | 47.7 | 37% | 0.37 | 27% | 0.273 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -88.3 | 9.7 | 174.7 | -70.1 | 80.8 | 0 | 0 | 0 | 113.5 | L126 P132 E157 L158 L159 | L126-H161 HydrophobicContact CD1-CB 4.35Å; L126-H161 HydrophobicContact CD2-CB 4.06Å; P132-H161 HydrophobicContact CB-CB 4.39Å; P132-H161 HydrophobicContact CG-CB 3.89Å; P132-H161 VanDerWaalsContact CG-O 3.25Å; P132-H161 WeakPolarHBondContact CG-O 3.48Å; E157-H161 PolarHBondContact O-N 3.26Å; E157-H161 PolarHBondContact O-ND1 2.81Å; E157-H161 IonicContact OE2-CE1 2.69Å; L158-H161 PolarHBondContact O-N 3.28Å; L159-H161 VanDerWaalsContact C-N 3.3Å |
| 162 | G | 91.9 | Very high | 87.9 | Confident | 59 Ų | 59 | 49.3 Ų | 49.3 | 61% | 0.608 | 28% | 0.281 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 91.6 | 18.4 | 172.5 | 0 | 0 | 0 | 0 | 0 | 115.3 | L158 L159 G160 | L158-G162 PolarHBondContact O-N 3.27Å; L159-G162 PolarHBondContact O-N 3.44Å; G160-G162 VanDerWaalsContact C-N 3.29Å |
| 163 | A | 93.4 | Very high | 85.5 | Confident | 11 Ų | 11 | 53 Ų | 53 | 9% | 0.091 | 30% | 0.304 | C | S | . | . | trans | -61.1 | 141.3 | 168.2 | 0 | 0 | 0 | 0 | 0 | 111 | P132 V143 L158 L159 | P132-A163 HydrophobicContact CB-CB 3.71Å; V143-A163 HydrophobicContact CG2-CB 3.49Å; V143-A163 VanDerWaalsContact CG2-CB 3.49Å; L158-A163 HydrophobicContact CB-CB 4.05Å; L158-A163 WeakPolarHBondContact O-CB 3.2Å; L158-A163 PolarHBondContact O-N 3.41Å; L159-A163 HydrophobicContact CD2-CB 4.3Å; L159-A163 VanDerWaalsContact CD2-O 3.25Å; L159-A163 WeakPolarHBondContact CD2-O 3.45Å | ||
| 164 | E | 91.2 | Very high | 83.2 | Confident | 141 Ų | 141 | 60.9 Ų | 60.9 | 66% | 0.659 | 33% | 0.325 | S | S | * | . | trans | -70.3 | 134.1 | 179.6 | -65.7 | 179.7 | -179.5 | 0 | 0 | 111.3 | V167 | E164-V167 HydrophobicContact CB-CG2 3.76Å; E164-V167 WeakPolarHBondContact O-CG2 3.47Å | ||
| 165 | A | 91.4 | Very high | 80.8 | Confident | 6 Ų | 6 | 63.2 Ų | 63.2 | 5% | 0.05 | 34% | 0.344 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -78.8 | -22.4 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | L159 L200 H203 A205 | L159-A165 HydrophobicContact CD2-CB 4.26Å; A165-L200 HydrophobicContact CB-CD2 4.32Å; A165-H203 HydrophobicContact CB-CB 4.37Å; A165-A205 HydrophobicContact CB-CB 4.06Å |
| 166 | N | 89.2 | Confident | 78.5 | Confident | 39 Ų | 39 | 65 Ų | 65 | 21% | 0.209 | 36% | 0.357 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -102.6 | 36.5 | -175 | -65.6 | -61.7 | 0 | 0 | 0 | 112.8 | K168 G204 A205 D206 | N166-K168 PolarHBondContact O-N 3.01Å; N166-G204 PolarHBondContact ND2-O 3.43Å; N166-A205 VanDerWaalsContact OD1-CA 3.31Å; N166-A205 WeakPolarHBondContact OD1-CA 3.26Å; N166-D206 PolarHBondContact OD1-N 2.88Å |
| 167 | V | 87 | Confident | 76 | Confident | 23 Ų | 23 | 66.8 Ų | 66.8 | 14% | 0.139 | 37% | 0.37 | C | S | . | . | P | Polyproline II helix | trans | -69.4 | 134.5 | -175.5 | 177.5 | 0 | 0 | 0 | 0 | 111.1 | S141 L144 E164 G183 P184 | S141-V167 WeakPolarHBondContact OG-CG1 3.35Å; L144-V167 HydrophobicContact CD1-CG1 4.2Å; L144-V167 HydrophobicContact CG-CG1 4.47Å; E164-V167 HydrophobicContact CB-CG2 3.76Å; E164-V167 WeakPolarHBondContact O-CG2 3.47Å; V167-G183 WeakPolarHBondContact O-CA 3.5Å; V167-P184 HydrophobicContact CB-CG 4.45Å; V167-P184 VanDerWaalsContact O-CD 3.28Å; V167-P184 WeakPolarHBondContact O-CD 3.49Å |
| 168 | K | 78.2 | Confident | 73.5 | Confident | 112 Ų | 112 | 70.6 Ų | 70.6 | 49% | 0.487 | 39% | 0.391 | S | S | . | . | P | Polyproline II helix | trans | -83.1 | 131.2 | 173.8 | -179.9 | 179.9 | 170.4 | -173.4 | 0 | 111.2 | N166 K170 L216 | N166-K168 PolarHBondContact O-N 3.01Å; K168-K170 PolarHBondContact O-N 3.38Å; K168-L216 HydrophobicContact CD-CD1 3.65Å; K168-L216 VanDerWaalsContact NZ-CD1 3.27Å |
| 169 | A | 71.3 | Confident | 71.2 | Confident | 13 Ų | 13 | 73.5 Ų | 73.5 | 11% | 0.107 | 42% | 0.415 | C | S | . | . | P | Polyproline II helix | trans | -67.4 | 127 | 164.9 | 0 | 0 | 0 | 0 | 0 | 109.8 | L144 L171 S182 | L144-A169 HydrophobicContact CD1-CB 3.9Å; A169-L171 HydrophobicContact CB-CD1 4.42Å; A169-L171 HydrophobicContact CB-CG 4.34Å; A169-L171 PolarHBondContact O-N 3.32Å; A169-S182 WeakPolarHBondContact CB-O 3.38Å |
| 170 | K | 70.3 | Confident | 69 | Low | 90 Ų | 90 | 74.7 Ų | 74.7 | 39% | 0.391 | 42% | 0.424 | S | S | . | . | trans | -87.7 | 50.7 | 178.7 | -54.8 | 177.6 | -166.2 | 150.2 | 0 | 110.3 | I136 N138 N139 K168 | I136-K170 VanDerWaalsContact C-NZ 3.35Å; I136-K170 PolarHBondContact O-NZ 3.22Å; N138-K170 PolarHBondContact O-NZ 3.34Å; N139-K170 HydrophobicContact CB-CB 4.34Å; N139-K170 PolarHBondContact O-N 3.38Å; K168-K170 PolarHBondContact O-N 3.38Å | ||
| 171 | L | 61.2 | Low | 67.3 | Low | 99 Ų | 99 | 73.6 Ų | 73.6 | 52% | 0.518 | 41% | 0.409 | S | S | . | . | trans | -76.4 | 136.4 | 174.1 | -70.9 | 171.2 | 0 | 0 | 0 | 109.6 | A169 V173 | A169-L171 HydrophobicContact CB-CD1 4.42Å; A169-L171 HydrophobicContact CB-CG 4.34Å; A169-L171 PolarHBondContact O-N 3.32Å; L171-V173 PolarHBondContact O-N 3.43Å | ||
| 172 | P | 51.9 | Low | 66.1 | Low | 60 Ų | 60 | 71.2 Ų | 71.2 | 39% | 0.39 | 40% | 0.401 | S | S | . | . | trans | -58 | 134.7 | 171.2 | -21.1 | 31.4 | 0 | 0 | 0 | 110.3 | W174 A175 | P172-W174 HydrophobicContact CB-CG 4.45Å; P172-W174 PolarHBondContact O-N 3.27Å; P172-A175 PolarHBondContact O-N 3.26Å | ||
| 173 | V | 48.3 | Very low | 65.8 | Low | 126 Ų | 126 | 68.6 Ų | 68.6 | 76% | 0.764 | 37% | 0.374 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -52.7 | -26.2 | -174.2 | -179.1 | 0 | 0 | 0 | 0 | 113.7 | L171 | L171-V173 PolarHBondContact O-N 3.43Š|
| 174 | W | 50.5 | Low | 65.7 | Low | 210 Ų | 210 | 68.1 Ų | 68.1 | 80% | 0.795 | 37% | 0.37 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.1 | -20 | 178.9 | 65.9 | -94.2 | 0 | 0 | 0 | 114.5 | P172 | P172-W174 HydrophobicContact CB-CG 4.45Å; P172-W174 PolarHBondContact O-N 3.27Å |
| 175 | A | 47.3 | Very low | 65.7 | Low | 55 Ų | 55 | 61.4 Ų | 61.4 | 46% | 0.455 | 34% | 0.339 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -87.1 | -20 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | P172 N177 | P172-A175 PolarHBondContact O-N 3.26Å; A175-N177 VanDerWaalsContact C-N 3.28Å; A175-N177 PolarHBondContact O-N 3.16Å; A175-N177 VanDerWaalsContact O-N 3.1Å |
| 176 | S | 50 | Low | 65.6 | Low | 38 Ų | 38 | 62.5 Ų | 62.5 | 27% | 0.266 | 34% | 0.342 | S | S | . | . | trans | -82 | 74.2 | 168.8 | -65.8 | 0 | 0 | 0 | 0 | 109.5 | I178 | S176-I178 CarbonylContact C-O 3.59Å; S176-I178 PolarHBondContact O-N 3.49Å; S176-I178 VanDerWaalsContact O-N 3.14Å | ||
| 177 | N | 44.9 | Very low | 65.5 | Low | 147 Ų | 147 | 62 Ų | 62 | 79% | 0.786 | 34% | 0.339 | S | S | * | . | S | Bend | trans | -64.3 | 115.5 | 157.7 | -87.4 | -18.9 | 0 | 0 | 0 | 106.6 | A175 | A175-N177 VanDerWaalsContact C-N 3.28Å; A175-N177 PolarHBondContact O-N 3.16Å; A175-N177 VanDerWaalsContact O-N 3.1Å |
| 178 | I | 45.5 | Very low | 65.8 | Low | 121 Ų | 121 | 61 Ų | 61 | 62% | 0.621 | 33% | 0.333 | S | S | * | . | S | Bend | trans | 90 | 126.1 | -163 | -49.4 | 156 | 0 | 0 | 0 | 110.9 | S176 S180 | S176-I178 CarbonylContact C-O 3.59Å; S176-I178 PolarHBondContact O-N 3.49Å; S176-I178 VanDerWaalsContact O-N 3.14Å; I178-S180 WeakPolarHBondContact CB-OG 3.38Å; I178-S180 WeakPolarHBondContact CG2-OG 3.42Å; I178-S180 PolarHBondContact O-N 3.41Å |
| 179 | A | 47.7 | Very low | 66.5 | Low | 62 Ų | 62 | 55.8 Ų | 55.8 | 51% | 0.512 | 31% | 0.311 | S | S | . | . | trans | -62.5 | 54.3 | 161.7 | 0 | 0 | 0 | 0 | 0 | 110.8 | C181 V220 | A179-C181 PolarHBondContact O-N 2.87Å; A179-V220 HydrophobicContact CB-CG1 3.65Å | ||
| 180 | S | 50.2 | Low | 67.3 | Low | 33 Ų | 33 | 57.5 Ų | 57.5 | 23% | 0.231 | 32% | 0.32 | C | S | . | . | trans | -77.1 | 116.2 | -178.5 | -65.8 | 0 | 0 | 0 | 0 | 107.3 | I178 S182 | I178-S180 WeakPolarHBondContact CB-OG 3.38Å; I178-S180 WeakPolarHBondContact CG2-OG 3.42Å; I178-S180 PolarHBondContact O-N 3.41Å; S180-S182 PolarHBondContact O-N 3.37Å | ||
| 181 | C | 56.3 | Low | 68.2 | Low | 21 Ų | 21 | 59.5 Ų | 59.5 | 14% | 0.142 | 33% | 0.326 | C | S | . | . | trans | -40.8 | 115.8 | 154.4 | -59.3 | 0 | 0 | 0 | 0 | 106.7 | A179 Y186 R224 I229 | A179-C181 PolarHBondContact O-N 2.87Å; C181-Y186 HydrophobicContact CB-CD2 4.34Å; C181-Y186 WeakPolarHBondContact O-CB 3.27Å; C181-Y186 WeakPolarHBondContact O-CD1 3.45Å; C181-Y186 WeakPolarHBondContact O-CD2 3.25Å; C181-Y186 WeakPolarHBondContact O-CE1 3.48Å; C181-R224 PolarHBondContact SG-O 3.05Å; C181-I229 HydrophobicContact CB-CD1 4.23Å | ||
| 182 | S | 70.3 | Confident | 69.7 | Low | 30 Ų | 30 | 57.1 Ų | 57.1 | 21% | 0.21 | 33% | 0.325 | C | S | . | . | trans | -117.5 | 16.9 | -169.3 | 45.2 | 0 | 0 | 0 | 0 | 111.8 | L144 A169 S180 | L144-S182 VanDerWaalsContact CD2-O 3.31Å; L144-S182 WeakPolarHBondContact CD2-O 3.37Å; A169-S182 WeakPolarHBondContact CB-O 3.38Å; S180-S182 PolarHBondContact O-N 3.37Å | ||
| 183 | G | 84.9 | Confident | 71.8 | Confident | 4 Ų | 4 | 56.9 Ų | 56.9 | 4% | 0.041 | 32% | 0.319 | C | S | . | . | S | Bend | trans | -77.8 | 177.6 | 179 | 0 | 0 | 0 | 0 | 0 | 113.1 | V167 L185 Y186 L187 N210 | V167-G183 WeakPolarHBondContact O-CA 3.5Å; G183-L185 PolarHBondContact O-N 3.1Å; G183-Y186 PolarHBondContact O-N 3.18Å; G183-L187 PolarHBondContact O-N 3.17Å; G183-L187 VanDerWaalsContact O-N 3.16Å; G183-N210 WeakPolarHBondContact CA-ND2 3.46Å; G183-N210 PolarHBondContact O-ND2 3.16Å |
| 184 | P | 91.3 | Very high | 74 | Confident | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -58.7 | -46 | -175.8 | -25.9 | 35.2 | 0 | 0 | 0 | 114.2 | V143 L144 A147 V167 Y186 L187 A188 L200 N210 | V143-P184 HydrophobicContact CB-CG 4.47Å; V143-P184 HydrophobicContact CG1-CB 3.87Å; V143-P184 HydrophobicContact CG1-CG 3.57Å; L144-P184 HydrophobicContact CD2-CG 3.87Å; L144-P184 HydrophobicContact CG-CG 4.36Å; A147-P184 HydrophobicContact CB-CB 3.82Å; A147-P184 WeakPolarHBondContact CB-O 3.44Å; V167-P184 HydrophobicContact CB-CG 4.45Å; V167-P184 VanDerWaalsContact O-CD 3.28Å; V167-P184 WeakPolarHBondContact O-CD 3.49Å; P184-Y186 VanDerWaalsContact C-N 3.31Å; P184-Y186 PolarHBondContact O-N 3.14Å; P184-L187 PolarHBondContact O-N 3.42Å; P184-A188 PolarHBondContact O-N 2.94Å; P184-L200 VanDerWaalsContact C-CD1 3.48Å; P184-L200 HydrophobicContact CB-CD1 3.66Å; P184-L200 HydrophobicContact CB-CD2 3.67Å; P184-L200 HydrophobicContact CB-CG 4.34Å; P184-N210 VanDerWaalsContact N-ND2 3.19Å |
| 185 | L | 91.8 | Very high | 76.2 | Confident | 0 Ų | 0 | 47.2 Ų | 47.2 | 0% | 0 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -62.8 | -35.7 | -179.4 | -166.9 | 64.3 | 0 | 0 | 0 | 112.7 | G183 A189 F197 L200 L201 A205 D206 N210 L226 | G183-L185 PolarHBondContact O-N 3.1Å; L185-A189 PolarHBondContact O-N 2.85Å; L185-A189 VanDerWaalsContact O-N 3.16Å; L185-F197 HydrophobicContact CD1-CB 4.35Å; L185-F197 HydrophobicContact CD1-CD1 4.03Å; L185-F197 HydrophobicContact CD1-CD2 3.33Å; L185-F197 HydrophobicContact CD1-CE1 4.16Å; L185-F197 HydrophobicContact CD1-CE2 3.45Å; L185-F197 VanDerWaalsContact CD1-CE2 3.45Å; L185-F197 HydrophobicContact CD1-CG 3.64Å; L185-F197 HydrophobicContact CD1-CZ 3.88Å; L185-F197 WeakPolarHBondContact CD1-O 3.38Å; L185-F197 HydrophobicContact CD2-CE2 4.37Å; L185-F197 HydrophobicContact CD2-CZ 4.45Å; L185-F197 HydrophobicContact CG-CD2 3.84Å; L185-F197 HydrophobicContact CG-CE2 3.51Å; L185-F197 HydrophobicContact CG-CZ 4.03Å; L185-F197 VanDerWaalsContact O-CD2 3.27Å; L185-F197 WeakPolarHBondContact O-CD2 3.24Å; L185-F197 WeakPolarHBondContact O-CE2 3.37Å; L185-L200 HydrophobicContact CB-CD1 4.39Å; L185-L200 HydrophobicContact CD1-CB 3.85Å; L185-L200 HydrophobicContact CD1-CD1 4.36Å; L185-L201 HydrophobicContact CD1-CD2 4.21Å; L185-L201 HydrophobicContact CD1-CG 3.85Å; L185-L201 HydrophobicContact CD2-CD2 3.65Å; L185-L201 HydrophobicContact CD2-CG 4.23Å; L185-A205 HydrophobicContact CB-CB 4.34Å; L185-A205 HydrophobicContact CD1-CB 4.49Å; L185-A205 HydrophobicContact CD2-CB 3.95Å; L185-D206 WeakPolarHBondContact CD2-O 3.41Å; L185-N210 WeakPolarHBondContact CA-ND2 3.31Å; L185-N210 HydrophobicContact CB-CB 3.84Å; L185-N210 VanDerWaalsContact CB-ND2 3.33Å; L185-N210 WeakPolarHBondContact CB-ND2 3.48Å; L185-N210 HydrophobicContact CD2-CB 4.38Å; L185-N210 PolarHBondContact N-ND2 2.96Å; L185-L226 HydrophobicContact CB-CD1 4.18Å; L185-L226 HydrophobicContact CD2-CD1 3.33Å; L185-L226 HydrophobicContact CG-CD1 3.72Å |
| 186 | Y | 88.6 | Confident | 78.6 | Confident | 30 Ų | 30 | 44.6 Ų | 44.6 | 12% | 0.118 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -66 | -48.1 | 173.5 | 168.4 | -93.6 | 0 | 0 | 0 | 111.4 | C181 G183 P184 A188 A189 V190 N210 L226 I229 | C181-Y186 HydrophobicContact CB-CD2 4.34Å; C181-Y186 WeakPolarHBondContact O-CB 3.27Å; C181-Y186 WeakPolarHBondContact O-CD1 3.45Å; C181-Y186 WeakPolarHBondContact O-CD2 3.25Å; C181-Y186 WeakPolarHBondContact O-CE1 3.48Å; G183-Y186 PolarHBondContact O-N 3.18Å; P184-Y186 VanDerWaalsContact C-N 3.31Å; P184-Y186 PolarHBondContact O-N 3.14Å; Y186-A188 VanDerWaalsContact C-N 3.31Å; Y186-A188 PolarHBondContact O-N 2.89Å; Y186-A189 PolarHBondContact O-N 3.19Å; Y186-A189 VanDerWaalsContact O-N 3.13Å; Y186-V190 HydrophobicContact CD1-CG2 4.2Å; Y186-V190 HydrophobicContact CD2-CG2 4.01Å; Y186-V190 HydrophobicContact CE1-CB 4.47Å; Y186-V190 HydrophobicContact CE1-CG2 3.78Å; Y186-V190 HydrophobicContact CE2-CG2 3.58Å; Y186-V190 HydrophobicContact CG-CG2 4.32Å; Y186-V190 VanDerWaalsContact CZ-CG2 3.48Å; Y186-V190 WeakPolarHBondContact O-CG2 3.35Å; Y186-V190 PolarHBondContact O-N 2.9Å; Y186-N210 PolarHBondContact N-ND2 3.38Å; Y186-L226 HydrophobicContact CD2-CD2 4.33Å; Y186-I229 HydrophobicContact CD2-CD1 3.6Å; Y186-I229 HydrophobicContact CD2-CG1 4.46Å; Y186-I229 HydrophobicContact CD2-CG2 3.75Å; Y186-I229 HydrophobicContact CE2-CD1 3.73Å; Y186-I229 HydrophobicContact CE2-CG1 4.28Å; Y186-I229 HydrophobicContact CE2-CG2 3.57Å |
| 187 | L | 89 | Confident | 80.8 | Confident | 29 Ų | 29 | 42.8 Ų | 42.8 | 15% | 0.152 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -60 | -44.9 | 179.3 | -65.4 | 170.9 | 0 | 0 | 0 | 110.2 | L144 R148 G183 P184 A189 V190 Y191 | L144-L187 HydrophobicContact CB-CD1 4.28Å; L144-L187 HydrophobicContact CD2-CD1 3.68Å; R148-L187 HydrophobicContact CB-CB 4.33Å; R148-L187 HydrophobicContact CB-CD1 4.26Å; G183-L187 PolarHBondContact O-N 3.17Å; G183-L187 VanDerWaalsContact O-N 3.16Å; P184-L187 PolarHBondContact O-N 3.42Å; L187-A189 VanDerWaalsContact C-N 3.28Å; L187-A189 PolarHBondContact O-N 3.21Å; L187-V190 PolarHBondContact O-N 3.35Å; L187-Y191 HydrophobicContact CB-CD2 4.47Å; L187-Y191 HydrophobicContact CD2-CD2 4.45Å; L187-Y191 HydrophobicContact CD2-CE2 3.97Å; L187-Y191 WeakPolarHBondContact O-CB 3.49Å; L187-Y191 VanDerWaalsContact O-CD2 3.26Å; L187-Y191 WeakPolarHBondContact O-CD2 3.28Å; L187-Y191 PolarHBondContact O-N 2.98Å |
| 188 | A | 93.3 | Very high | 83.2 | Confident | 0 Ų | 0 | 40.3 Ų | 40.3 | 0% | 0 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -57.9 | -39.4 | 176 | 0 | 0 | 0 | 0 | 0 | 112.6 | P184 Y186 G192 H193 C196 F197 L200 | P184-A188 PolarHBondContact O-N 2.94Å; Y186-A188 VanDerWaalsContact C-N 3.31Å; Y186-A188 PolarHBondContact O-N 2.89Å; A188-G192 PolarHBondContact O-N 2.87Å; A188-H193 HydrophobicContact CB-CB 4.48Å; A188-H193 PolarHBondContact O-N 3.19Å; A188-C196 HydrophobicContact CB-CB 3.98Å; A188-F197 HydrophobicContact CB-CB 3.97Å; A188-F197 HydrophobicContact CB-CD2 4.24Å; A188-L200 HydrophobicContact CB-CD1 4.19Å |
| 189 | A | 91.3 | Very high | 85.5 | Confident | 3 Ų | 3 | 35.5 Ų | 35.5 | 3% | 0.025 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -69.1 | -49.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | L185 Y186 L187 Y191 G192 F197 Y239 | L185-A189 PolarHBondContact O-N 2.85Å; L185-A189 VanDerWaalsContact O-N 3.16Å; Y186-A189 PolarHBondContact O-N 3.19Å; Y186-A189 VanDerWaalsContact O-N 3.13Å; L187-A189 VanDerWaalsContact C-N 3.28Å; L187-A189 PolarHBondContact O-N 3.21Å; A189-Y191 VanDerWaalsContact C-N 3.31Å; A189-Y191 PolarHBondContact O-N 3.44Å; A189-G192 PolarHBondContact O-N 2.93Å; A189-G192 VanDerWaalsContact O-N 3.15Å; A189-F197 HydrophobicContact CB-CD2 3.91Å; A189-F197 HydrophobicContact CB-CE2 3.76Å; A189-Y239 HydrophobicContact CB-CD1 4.21Å; A189-Y239 HydrophobicContact CB-CE1 4.26Å |
| 190 | V | 87.8 | Confident | 87.8 | Confident | 50 Ų | 50 | 32.5 Ų | 32.5 | 30% | 0.303 | 17% | 0.174 | S | C | . | . | H | α-helix | trans | -65.6 | -35.1 | -175.9 | 171.1 | 0 | 0 | 0 | 0 | 112.1 | Y186 L187 I229 | Y186-V190 HydrophobicContact CD1-CG2 4.2Å; Y186-V190 HydrophobicContact CD2-CG2 4.01Å; Y186-V190 HydrophobicContact CE1-CB 4.47Å; Y186-V190 HydrophobicContact CE1-CG2 3.78Å; Y186-V190 HydrophobicContact CE2-CG2 3.58Å; Y186-V190 HydrophobicContact CG-CG2 4.32Å; Y186-V190 VanDerWaalsContact CZ-CG2 3.48Å; Y186-V190 WeakPolarHBondContact O-CG2 3.35Å; Y186-V190 PolarHBondContact O-N 2.9Å; L187-V190 PolarHBondContact O-N 3.35Å; V190-I229 HydrophobicContact CG2-CG2 4.24Å |
| 191 | Y | 90 | Very high | 89.9 | Confident | 132 Ų | 132 | 31 Ų | 31 | 52% | 0.518 | 16% | 0.164 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -89.9 | 0.5 | 177.7 | -70.7 | -87.7 | 0 | 0 | 0 | 113.4 | R148 L187 A189 | R148-Y191 HydrophobicContact CG-CD2 3.94Å; R148-Y191 HydrophobicContact CG-CE1 4.35Å; R148-Y191 HydrophobicContact CG-CE2 3.61Å; R148-Y191 HydrophobicContact CG-CG 4.45Å; L187-Y191 HydrophobicContact CB-CD2 4.47Å; L187-Y191 HydrophobicContact CD2-CD2 4.45Å; L187-Y191 HydrophobicContact CD2-CE2 3.97Å; L187-Y191 WeakPolarHBondContact O-CB 3.49Å; L187-Y191 VanDerWaalsContact O-CD2 3.26Å; L187-Y191 WeakPolarHBondContact O-CD2 3.28Å; L187-Y191 PolarHBondContact O-N 2.98Å; A189-Y191 VanDerWaalsContact C-N 3.31Å; A189-Y191 PolarHBondContact O-N 3.44Å |
| 192 | G | 92.9 | Very high | 91.6 | Very high | 49 Ų | 49 | 32.2 Ų | 32.2 | 51% | 0.505 | 17% | 0.168 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 76.5 | 24.7 | 173.4 | 0 | 0 | 0 | 0 | 0 | 115.1 | A188 A189 L194 Y239 | A188-G192 PolarHBondContact O-N 2.87Å; A189-G192 PolarHBondContact O-N 2.93Å; A189-G192 VanDerWaalsContact O-N 3.15Å; G192-L194 PolarHBondContact O-N 3.06Å; G192-Y239 VanDerWaalsContact CA-OH 3.26Å; G192-Y239 WeakPolarHBondContact CA-OH 3.27Å; G192-Y239 PolarHBondContact O-OH 2.86Å; G192-Y239 VanDerWaalsContact O-OH 3.11Å |
| 193 | H | 95.8 | Very high | 92.6 | Very high | 54 Ų | 54 | 32.5 Ų | 32.5 | 25% | 0.25 | 17% | 0.166 | C | C | . | . | trans | -92.6 | 80.5 | 179.4 | -57.7 | -47.7 | 0 | 0 | 0 | 112.6 | A147 R148 G150 A188 D195 C196 F197 Y239 | A147-H193 PolarHBondContact O-CD2 3.39Å; R148-H193 PolarHBondContact O-CD2 3.05Å; R148-H193 PolarHBondContact O-NE2 3.41Å; R148-H193 VanDerWaalsContact O-NE2 3.08Å; G150-H193 WeakPolarHBondContact CA-CD2 3.41Å; G150-H193 PolarHBondContact N-CD2 3.43Å; G150-H193 VanDerWaalsContact N-CD2 3.32Å; G150-H193 PolarHBondContact N-NE2 3.32Å; A188-H193 HydrophobicContact CB-CB 4.48Å; A188-H193 PolarHBondContact O-N 3.19Å; H193-D195 VanDerWaalsContact C-N 3.34Å; H193-D195 PolarHBondContact O-N 2.81Å; H193-C196 HydrophobicContact CB-CB 3.94Å; H193-C196 PolarHBondContact O-N 3.1Å; H193-F197 WeakPolarHBondContact O-CB 3.42Å; H193-F197 PolarHBondContact O-N 3.28Å; H193-Y239 VanDerWaalsContact C-OH 3.3Å; H193-Y239 PolarHBondContact N-OH 3.48Å; H193-Y239 VanDerWaalsContact N-OH 3.12Å | ||
| 194 | L | 95.4 | Very high | 92.8 | Very high | 45 Ų | 45 | 33.4 Ų | 33.4 | 24% | 0.236 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -62.3 | -39 | -173.2 | -177.3 | 65.5 | 0 | 0 | 0 | 112.8 | G192 F197 R198 E238 Y239 L242 | G192-L194 PolarHBondContact O-N 3.06Å; L194-F197 WeakPolarHBondContact O-CB 3.44Å; L194-F197 PolarHBondContact O-N 3.33Å; L194-R198 WeakPolarHBondContact O-CB 3.32Å; L194-R198 PolarHBondContact O-N 3.29Å; L194-E238 HydrophobicContact CD1-CB 4Å; L194-E238 HydrophobicContact CD2-CB 3.93Å; L194-E238 HydrophobicContact CD2-CG 4.34Å; L194-Y239 VanDerWaalsContact CA-OH 3.28Å; L194-Y239 WeakPolarHBondContact CA-OH 3.35Å; L194-Y239 HydrophobicContact CB-CE1 4.49Å; L194-Y239 HydrophobicContact CB-CE2 4.28Å; L194-Y239 HydrophobicContact CD1-CD1 4.08Å; L194-Y239 HydrophobicContact CD1-CD2 3.96Å; L194-Y239 HydrophobicContact CD1-CE1 3.97Å; L194-Y239 HydrophobicContact CD1-CE2 3.84Å; L194-Y239 HydrophobicContact CD1-CG 4.07Å; L194-Y239 PolarHBondContact N-OH 3.21Å; L194-L242 HydrophobicContact CD1-CD1 3.7Å |
| 195 | D | 96.6 | Very high | 92.9 | Very high | 88 Ų | 88 | 33.7 Ų | 33.7 | 47% | 0.471 | 18% | 0.179 | S | C | . | . | H | α-helix | trans | -69.4 | -40.1 | 179.6 | -68.9 | -40.5 | 0 | 0 | 0 | 111.8 | V152 H193 F197 R198 L199 | V152-D195 HydrophobicContact CG1-CB 4.15Å; V152-D195 HydrophobicContact CG2-CB 3.63Å; H193-D195 VanDerWaalsContact C-N 3.34Å; H193-D195 PolarHBondContact O-N 2.81Å; D195-F197 VanDerWaalsContact C-N 3.31Å; D195-F197 PolarHBondContact O-N 3.35Å; D195-R198 PolarHBondContact O-N 3.05Å; D195-R198 IonicContact OD1-NH1 3.65Å; D195-L199 WeakPolarHBondContact O-CB 3.44Å; D195-L199 PolarHBondContact O-N 3.44Å |
| 196 | C | 96.8 | Very high | 92.8 | Very high | 0 Ų | 0 | 35.7 Ų | 35.7 | 0% | 0 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -60.8 | -43.4 | 170.6 | -71.7 | 0 | 0 | 0 | 0 | 110.9 | L155 A188 H193 L199 L200 | L155-C196 HydrophobicContact CD2-CB 3.69Å; A188-C196 HydrophobicContact CB-CB 3.98Å; H193-C196 HydrophobicContact CB-CB 3.94Å; H193-C196 PolarHBondContact O-N 3.1Å; C196-L199 PolarHBondContact O-N 3.3Å; C196-L200 WeakPolarHBondContact O-CB 3.22Å; C196-L200 WeakPolarHBondContact O-CD1 3.42Å; C196-L200 VanDerWaalsContact O-CG 3.26Å; C196-L200 WeakPolarHBondContact O-CG 3.19Å; C196-L200 PolarHBondContact O-N 2.86Å |
| 197 | F | 95.6 | Very high | 92.9 | Very high | 0 Ų | 0 | 35.1 Ų | 35.1 | 0% | 0 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -60.3 | -49 | 178.9 | -170.2 | -89.5 | 0 | 0 | 0 | 111.8 | L185 A188 A189 H193 L194 D195 L199 L200 L201 Y239 L242 L243 | L185-F197 HydrophobicContact CD1-CB 4.35Å; L185-F197 HydrophobicContact CD1-CD1 4.03Å; L185-F197 HydrophobicContact CD1-CD2 3.33Å; L185-F197 HydrophobicContact CD1-CE1 4.16Å; L185-F197 HydrophobicContact CD1-CE2 3.45Å; L185-F197 VanDerWaalsContact CD1-CE2 3.45Å; L185-F197 HydrophobicContact CD1-CG 3.64Å; L185-F197 HydrophobicContact CD1-CZ 3.88Å; L185-F197 WeakPolarHBondContact CD1-O 3.38Å; L185-F197 HydrophobicContact CD2-CE2 4.37Å; L185-F197 HydrophobicContact CD2-CZ 4.45Å; L185-F197 HydrophobicContact CG-CD2 3.84Å; L185-F197 HydrophobicContact CG-CE2 3.51Å; L185-F197 HydrophobicContact CG-CZ 4.03Å; L185-F197 VanDerWaalsContact O-CD2 3.27Å; L185-F197 WeakPolarHBondContact O-CD2 3.24Å; L185-F197 WeakPolarHBondContact O-CE2 3.37Å; A188-F197 HydrophobicContact CB-CB 3.97Å; A188-F197 HydrophobicContact CB-CD2 4.24Å; A189-F197 HydrophobicContact CB-CD2 3.91Å; A189-F197 HydrophobicContact CB-CE2 3.76Å; H193-F197 WeakPolarHBondContact O-CB 3.42Å; H193-F197 PolarHBondContact O-N 3.28Å; L194-F197 WeakPolarHBondContact O-CB 3.44Å; L194-F197 PolarHBondContact O-N 3.33Å; D195-F197 VanDerWaalsContact C-N 3.31Å; D195-F197 PolarHBondContact O-N 3.35Å; F197-L199 VanDerWaalsContact C-N 3.35Å; F197-L199 PolarHBondContact O-N 3.42Å; F197-L200 PolarHBondContact O-N 3.23Å; F197-L201 HydrophobicContact CD1-CD1 3.82Å; F197-L201 HydrophobicContact CE1-CD1 3.56Å; F197-L201 HydrophobicContact CE1-CG 4.43Å; F197-L201 HydrophobicContact CZ-CD1 4.44Å; F197-L201 WeakPolarHBondContact O-CG 3.44Å; F197-L201 PolarHBondContact O-N 2.7Å; F197-L201 VanDerWaalsContact O-N 3.16Å; F197-Y239 HydrophobicContact CB-CD1 4.13Å; F197-Y239 HydrophobicContact CB-CE1 3.74Å; F197-Y239 AromaticContact CD1-CD1 3.7Å; F197-Y239 HydrophobicContact CD1-CD1 3.7Å; F197-Y239 HydrophobicContact CD1-CE1 4.21Å; F197-Y239 AromaticContact CD2-CD1 3.68Å; F197-Y239 HydrophobicContact CD2-CD1 3.68Å; F197-Y239 AromaticContact CD2-CE1 3.85Å; F197-Y239 HydrophobicContact CD2-CE1 3.85Å; F197-Y239 AromaticContact CE1-CD1 3.93Å; F197-Y239 HydrophobicContact CE1-CD1 3.93Å; F197-Y239 AromaticContact CE2-CD1 3.94Å; F197-Y239 HydrophobicContact CE2-CD1 3.94Å; F197-Y239 AromaticContact CG-CD1 3.57Å; F197-Y239 HydrophobicContact CG-CD1 3.57Å; F197-Y239 AromaticContact CG-CE1 3.68Å; F197-Y239 HydrophobicContact CG-CE1 3.68Å; F197-Y239 HydrophobicContact CZ-CD1 4.04Å; F197-L242 HydrophobicContact CD1-CB 4.44Å; F197-L242 HydrophobicContact CD1-CD1 4.01Å; F197-L242 HydrophobicContact CE1-CB 4.17Å; F197-L243 HydrophobicContact CE1-CD2 4.03Å; F197-L243 HydrophobicContact CE1-CG 4Å; F197-L243 HydrophobicContact CZ-CD1 4.05Å; F197-L243 HydrophobicContact CZ-CD2 3.56Å; F197-L243 HydrophobicContact CZ-CG 3.67Å |
| 198 | R | 95.6 | Very high | 92.7 | Very high | 95 Ų | 95 | 35.3 Ų | 35.3 | 36% | 0.358 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -59.7 | -45.4 | 174.8 | -178.5 | -177.5 | -69.7 | 150.8 | -3.9 | 111.4 | L194 D195 L200 L201 L202 L242 | L194-R198 WeakPolarHBondContact O-CB 3.32Å; L194-R198 PolarHBondContact O-N 3.29Å; D195-R198 PolarHBondContact O-N 3.05Å; D195-R198 IonicContact OD1-NH1 3.65Å; R198-L200 PolarHBondContact O-N 3.13Å; R198-L201 PolarHBondContact O-N 3.49Å; R198-L202 HydrophobicContact CG-CD1 4.09Å; R198-L202 HydrophobicContact CG-CG 4.48Å; R198-L202 VanDerWaalsContact O-CG 3.32Å; R198-L202 WeakPolarHBondContact O-CG 3.31Å; R198-L202 PolarHBondContact O-N 3.12Å; R198-L242 HydrophobicContact CB-CD1 4Å; R198-L242 HydrophobicContact CG-CD2 4.29Å |
| 199 | L | 95.3 | Very high | 92 | Very high | 20 Ų | 20 | 38 Ų | 38 | 11% | 0.105 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -65.2 | -39.9 | -177.5 | -171.3 | 139.8 | 0 | 0 | 0 | 111.8 | V152 L155 Q156 L159 D195 C196 F197 L202 H203 | V152-L199 HydrophobicContact CG1-CD1 4.31Å; L155-L199 HydrophobicContact CB-CD2 4.27Å; L155-L199 HydrophobicContact CD2-CD2 3.94Å; L155-L199 HydrophobicContact CG-CD2 3.68Å; Q156-L199 HydrophobicContact CB-CD1 3.73Å; Q156-L199 HydrophobicContact CG-CD1 4.05Å; L159-L199 HydrophobicContact CD1-CD2 3.31Å; L159-L199 HydrophobicContact CG-CD2 4.31Å; D195-L199 WeakPolarHBondContact O-CB 3.44Å; D195-L199 PolarHBondContact O-N 3.44Å; C196-L199 PolarHBondContact O-N 3.3Å; F197-L199 VanDerWaalsContact C-N 3.35Å; F197-L199 PolarHBondContact O-N 3.42Å; L199-L202 WeakPolarHBondContact O-CB 3.21Å; L199-L202 PolarHBondContact O-N 3.06Å; L199-H203 PolarHBondContact O-CD2 2.9Å; L199-H203 VanDerWaalsContact O-CD2 3.31Å; L199-H203 PolarHBondContact O-N 3.43Å |
| 200 | L | 95 | Very high | 91.2 | Very high | 0 Ų | 0 | 38 Ų | 38 | 0% | 0 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -61.4 | -45.3 | 173.6 | -74.3 | 162.9 | 0 | 0 | 0 | 112.3 | V143 A147 L155 L159 A165 P184 L185 A188 C196 F197 R198 L202 H203 G204 A205 | V143-L200 HydrophobicContact CG1-CD2 4.18Å; A147-L200 HydrophobicContact CB-CD1 4.1Å; L155-L200 HydrophobicContact CD1-CD2 4.24Å; L155-L200 HydrophobicContact CD2-CD1 4.29Å; L155-L200 HydrophobicContact CD2-CD2 4.37Å; L155-L200 HydrophobicContact CD2-CG 4.01Å; L159-L200 HydrophobicContact CD1-CD2 4.01Å; A165-L200 HydrophobicContact CB-CD2 4.32Å; P184-L200 VanDerWaalsContact C-CD1 3.48Å; P184-L200 HydrophobicContact CB-CD1 3.66Å; P184-L200 HydrophobicContact CB-CD2 3.67Å; P184-L200 HydrophobicContact CB-CG 4.34Å; L185-L200 HydrophobicContact CB-CD1 4.39Å; L185-L200 HydrophobicContact CD1-CB 3.85Å; L185-L200 HydrophobicContact CD1-CD1 4.36Å; A188-L200 HydrophobicContact CB-CD1 4.19Å; C196-L200 WeakPolarHBondContact O-CB 3.22Å; C196-L200 WeakPolarHBondContact O-CD1 3.42Å; C196-L200 VanDerWaalsContact O-CG 3.26Å; C196-L200 WeakPolarHBondContact O-CG 3.19Å; C196-L200 PolarHBondContact O-N 2.86Å; F197-L200 PolarHBondContact O-N 3.23Å; R198-L200 PolarHBondContact O-N 3.13Å; L200-L202 VanDerWaalsContact C-N 3.3Å; L200-L202 PolarHBondContact O-N 2.91Å; L200-H203 CarbonylContact O-C 3.19Å; L200-H203 PolarHBondContact O-N 3.21Å; L200-H203 VanDerWaalsContact O-N 3.12Å; L200-G204 PolarHBondContact O-N 3.5Å; L200-A205 HydrophobicContact CB-CB 3.94Å; L200-A205 WeakPolarHBondContact O-CB 3.45Å; L200-A205 PolarHBondContact O-N 3.32Å |
| 201 | L | 93.6 | Very high | 90.4 | Very high | 2 Ų | 2 | 36.7 Ų | 36.7 | 1% | 0.01 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -61.2 | -39.6 | 174.1 | -71.5 | 173.1 | 0 | 0 | 0 | 111.9 | L185 F197 R198 H203 G204 P207 L242 F246 | L185-L201 HydrophobicContact CD1-CD2 4.21Å; L185-L201 HydrophobicContact CD1-CG 3.85Å; L185-L201 HydrophobicContact CD2-CD2 3.65Å; L185-L201 HydrophobicContact CD2-CG 4.23Å; F197-L201 HydrophobicContact CD1-CD1 3.82Å; F197-L201 HydrophobicContact CE1-CD1 3.56Å; F197-L201 HydrophobicContact CE1-CG 4.43Å; F197-L201 HydrophobicContact CZ-CD1 4.44Å; F197-L201 WeakPolarHBondContact O-CG 3.44Å; F197-L201 PolarHBondContact O-N 2.7Å; F197-L201 VanDerWaalsContact O-N 3.16Å; R198-L201 PolarHBondContact O-N 3.49Å; L201-H203 PolarHBondContact O-N 3.07Å; L201-G204 PolarHBondContact O-N 3.28Å; L201-G204 VanDerWaalsContact O-N 3.07Å; L201-P207 HydrophobicContact CD2-CB 3.93Å; L201-L242 HydrophobicContact CD1-CB 3.9Å; L201-F246 VanDerWaalsContact C-CE1 3.4Å; L201-F246 HydrophobicContact CB-CD1 3.71Å; L201-F246 HydrophobicContact CB-CD2 3.93Å; L201-F246 HydrophobicContact CB-CE1 3.68Å; L201-F246 HydrophobicContact CB-CE2 3.9Å; L201-F246 HydrophobicContact CB-CG 3.81Å; L201-F246 HydrophobicContact CB-CZ 3.77Å; L201-F246 HydrophobicContact CD1-CB 4.37Å; L201-F246 HydrophobicContact CD1-CD2 3.78Å; L201-F246 HydrophobicContact CD1-CE2 4.22Å; L201-F246 HydrophobicContact CD1-CG 4.07Å; L201-F246 HydrophobicContact CD2-CB 4.04Å; L201-F246 HydrophobicContact CD2-CD1 4.47Å; L201-F246 HydrophobicContact CD2-CG 4.17Å; L201-F246 HydrophobicContact CG-CD2 4.36Å; L201-F246 HydrophobicContact CG-CG 4.25Å; L201-F246 WeakPolarHBondContact O-CE1 3.43Å |
| 202 | L | 92.2 | Very high | 89.4 | Confident | 45 Ų | 45 | 35 Ų | 35 | 24% | 0.236 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -62.7 | -28 | 175.7 | -74.6 | 171.2 | 0 | 0 | 0 | 113 | R198 L199 L200 F246 R289 K315 | R198-L202 HydrophobicContact CG-CD1 4.09Å; R198-L202 HydrophobicContact CG-CG 4.48Å; R198-L202 VanDerWaalsContact O-CG 3.32Å; R198-L202 WeakPolarHBondContact O-CG 3.31Å; R198-L202 PolarHBondContact O-N 3.12Å; L199-L202 WeakPolarHBondContact O-CB 3.21Å; L199-L202 PolarHBondContact O-N 3.06Å; L200-L202 VanDerWaalsContact C-N 3.3Å; L200-L202 PolarHBondContact O-N 2.91Å; L202-F246 HydrophobicContact CD2-CE1 4.33Å; L202-F246 HydrophobicContact CD2-CZ 3.79Å; L202-F246 HydrophobicContact CG-CZ 4.06Å; L202-R289 VanDerWaalsContact C-NH2 3.3Å; L202-R289 VanDerWaalsContact CA-NH2 3.31Å; L202-R289 PolarHBondContact O-NH2 3.41Å; L202-K315 VanDerWaalsContact CD2-O 3.28Å; L202-K315 WeakPolarHBondContact CD2-O 3.44Å |
| 203 | H | 91.8 | Very high | 88.3 | Confident | 36 Ų | 36 | 36.3 Ų | 36.3 | 17% | 0.167 | 19% | 0.192 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -97.5 | 16.7 | 175.8 | -78 | -94.6 | 0 | 0 | 0 | 113.6 | L159 A165 L199 L200 L201 | L159-H203 HydrophobicContact CB-CB 4.23Å; L159-H203 HydrophobicContact CD1-CB 3.64Å; L159-H203 HydrophobicContact CD2-CB 4.46Å; L159-H203 HydrophobicContact CG-CB 4.34Å; A165-H203 HydrophobicContact CB-CB 4.37Å; L199-H203 PolarHBondContact O-CD2 2.9Å; L199-H203 VanDerWaalsContact O-CD2 3.31Å; L199-H203 PolarHBondContact O-N 3.43Å; L200-H203 CarbonylContact O-C 3.19Å; L200-H203 PolarHBondContact O-N 3.21Å; L200-H203 VanDerWaalsContact O-N 3.12Å; L201-H203 PolarHBondContact O-N 3.07Å |
| 204 | G | 90.2 | Very high | 87.2 | Confident | 24 Ų | 24 | 41.5 Ų | 41.5 | 25% | 0.247 | 22% | 0.217 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 85.3 | 23.5 | 170.2 | 0 | 0 | 0 | 0 | 0 | 114.9 | N166 L200 L201 D206 | N166-G204 PolarHBondContact ND2-O 3.43Å; L200-G204 PolarHBondContact O-N 3.5Å; L201-G204 PolarHBondContact O-N 3.28Å; L201-G204 VanDerWaalsContact O-N 3.07Å; G204-D206 PolarHBondContact O-N 2.87Å |
| 205 | A | 92.1 | Very high | 85.8 | Confident | 6 Ų | 6 | 41.3 Ų | 41.3 | 5% | 0.05 | 23% | 0.225 | C | C | . | . | trans | -57.5 | 136.5 | 164.7 | 0 | 0 | 0 | 0 | 0 | 110.3 | A165 N166 L185 L200 P207 | A165-A205 HydrophobicContact CB-CB 4.06Å; N166-A205 VanDerWaalsContact OD1-CA 3.31Å; N166-A205 WeakPolarHBondContact OD1-CA 3.26Å; L185-A205 HydrophobicContact CB-CB 4.34Å; L185-A205 HydrophobicContact CD1-CB 4.49Å; L185-A205 HydrophobicContact CD2-CB 3.95Å; L200-A205 HydrophobicContact CB-CB 3.94Å; L200-A205 WeakPolarHBondContact O-CB 3.45Å; L200-A205 PolarHBondContact O-N 3.32Å; A205-P207 WeakPolarHBondContact O-CD 3.48Å | ||
| 206 | D | 89.8 | Confident | 84.4 | Confident | 41 Ų | 41 | 39.4 Ų | 39.4 | 22% | 0.219 | 22% | 0.215 | C | C | . | . | trans | -68.6 | 117.8 | 176.8 | -175.9 | -34 | 0 | 0 | 0 | 108.9 | N166 L185 G204 D208 Y209 N210 | N166-D206 PolarHBondContact OD1-N 2.88Å; L185-D206 WeakPolarHBondContact CD2-O 3.41Å; G204-D206 PolarHBondContact O-N 2.87Å; D206-D208 PolarHBondContact O-N 2.98Å; D206-D208 WeakPolarHBondContact OD1-CB 3.28Å; D206-D208 PolarHBondContact OD1-N 3.14Å; D206-Y209 PolarHBondContact OD1-N 2.97Å; D206-N210 WeakPolarHBondContact O-CA 3.49Å; D206-N210 PolarHBondContact O-N 3.49Å | ||
| 207 | P | 90.8 | Very high | 83.1 | Confident | 19 Ų | 19 | 41.1 Ų | 41.1 | 12% | 0.123 | 22% | 0.224 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -72.6 | -13.8 | -175.3 | 33.3 | -38.5 | 0 | 0 | 0 | 113.4 | L201 A205 L243 F246 A248 | L201-P207 HydrophobicContact CD2-CB 3.93Å; A205-P207 WeakPolarHBondContact O-CD 3.48Å; P207-L243 HydrophobicContact CB-CD2 3.81Å; P207-L243 WeakPolarHBondContact O-CD2 3.34Å; P207-F246 HydrophobicContact CB-CB 4.4Å; P207-A248 HydrophobicContact CB-CB 4.05Å; P207-A248 HydrophobicContact CG-CB 4.43Å |
| 208 | D | 86 | Confident | 81.9 | Confident | 33 Ų | 33 | 45.3 Ų | 45.3 | 18% | 0.176 | 26% | 0.258 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -88.2 | -58.5 | -179.4 | -73.1 | -34.1 | 0 | 0 | 0 | 111.8 | D206 T225 L226 A248 N249 | D206-D208 PolarHBondContact O-N 2.98Å; D206-D208 WeakPolarHBondContact OD1-CB 3.28Å; D206-D208 PolarHBondContact OD1-N 3.14Å; D208-T225 CarbonylContact O-C 3.45Å; D208-T225 WeakPolarHBondContact O-CA 3.44Å; D208-L226 PolarHBondContact O-N 2.94Å; D208-A248 VanDerWaalsContact OD1-CA 3.31Å; D208-A248 WeakPolarHBondContact OD1-CA 3.48Å; D208-N249 PolarHBondContact OD1-N 3.23Å |
| 209 | Y | 76.8 | Confident | 80.7 | Confident | 57 Ų | 57 | 50.7 Ų | 50.7 | 22% | 0.224 | 28% | 0.279 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -121.2 | -11 | -171.7 | -58.3 | -71.5 | 0 | 0 | 0 | 113.6 | D206 C211 L217 P223 T225 | D206-Y209 PolarHBondContact OD1-N 2.97Å; Y209-C211 PolarHBondContact O-N 2.91Å; Y209-C211 VanDerWaalsContact O-N 3.13Å; Y209-L217 HydrophobicContact CD1-CD2 4.02Å; Y209-L217 HydrophobicContact CD2-CD1 3.95Å; Y209-L217 HydrophobicContact CD2-CD2 4.29Å; Y209-L217 HydrophobicContact CE2-CD1 4.48Å; Y209-L217 HydrophobicContact CG-CD1 4.27Å; Y209-L217 HydrophobicContact CG-CD2 3.82Å; Y209-P223 HydrophobicContact CD1-CB 4.14Å; Y209-P223 HydrophobicContact CE1-CB 3.93Å; Y209-P223 HydrophobicContact CE1-CG 3.97Å; Y209-T225 HydrophobicContact CE1-CG2 3.74Å |
| 210 | N | 74.9 | Confident | 79.4 | Confident | 3 Ų | 3 | 51.2 Ų | 51.2 | 2% | 0.016 | 28% | 0.283 | C | S | . | . | S | Bend | trans | 50.2 | 36.6 | -172.5 | 177.6 | 34.9 | 0 | 0 | 0 | 111.7 | G183 P184 L185 Y186 D206 L226 | G183-N210 WeakPolarHBondContact CA-ND2 3.46Å; G183-N210 PolarHBondContact O-ND2 3.16Å; P184-N210 VanDerWaalsContact N-ND2 3.19Å; L185-N210 WeakPolarHBondContact CA-ND2 3.31Å; L185-N210 HydrophobicContact CB-CB 3.84Å; L185-N210 VanDerWaalsContact CB-ND2 3.33Å; L185-N210 WeakPolarHBondContact CB-ND2 3.48Å; L185-N210 HydrophobicContact CD2-CB 4.38Å; L185-N210 PolarHBondContact N-ND2 2.96Å; Y186-N210 PolarHBondContact N-ND2 3.38Å; D206-N210 WeakPolarHBondContact O-CA 3.49Å; D206-N210 PolarHBondContact O-N 3.49Å; N210-L226 HydrophobicContact CB-CD1 3.9Å |
| 211 | C | 71.1 | Confident | 77.7 | Confident | 21 Ų | 21 | 57.4 Ų | 57.4 | 14% | 0.142 | 32% | 0.323 | C | S | . | . | trans | -159.5 | 118.3 | -178.5 | 177.1 | 0 | 0 | 0 | 0 | 107.9 | Y209 | Y209-C211 PolarHBondContact O-N 2.91Å; Y209-C211 VanDerWaalsContact O-N 3.13Å | ||
| 212 | T | 70.3 | Confident | 76.4 | Confident | 97 Ų | 97 | 67.9 Ų | 67.9 | 60% | 0.595 | 36% | 0.362 | S | S | * | . | trans | -92.1 | -4.6 | 178.3 | 54 | 0 | 0 | 0 | 0 | 113 | Q214 | T212-Q214 PolarHBondContact O-N 3.5Å; T212-Q214 VanDerWaalsContact O-N 3.16Å | ||
| 213 | D | 69.8 | Low | 75.3 | Confident | 77 Ų | 77 | 67.3 Ų | 67.3 | 41% | 0.412 | 36% | 0.361 | S | S | . | . | trans | -76.2 | 100.3 | -180 | -176.7 | -13.1 | 0 | 0 | 0 | 111.2 | G215 L216 L217 | D213-G215 VanDerWaalsContact C-N 3.26Å; D213-G215 PolarHBondContact O-N 2.93Å; D213-G215 WeakPolarHBondContact OD1-CA 3.32Å; D213-G215 PolarHBondContact OD1-N 3.43Å; D213-L216 HydrophobicContact CB-CB 4.12Å; D213-L216 PolarHBondContact O-N 3.25Å; D213-L216 PolarHBondContact OD1-N 3.11Å; D213-L216 VanDerWaalsContact OD1-N 3.1Å; D213-L217 WeakPolarHBondContact O-CG 3.39Å; D213-L217 PolarHBondContact O-N 3.25Å | ||
| 214 | Q | 71 | Confident | 74.5 | Confident | 163 Ų | 163 | 71 Ų | 71 | 76% | 0.762 | 37% | 0.374 | S | S | * | . | H | α-helix | trans | -61.7 | -32 | 177.6 | -63.9 | -178.4 | -2.4 | 0 | 0 | 112.9 | T212 L217 A218 | T212-Q214 PolarHBondContact O-N 3.5Å; T212-Q214 VanDerWaalsContact O-N 3.16Å; Q214-L217 PolarHBondContact O-N 3.2Å; Q214-A218 WeakPolarHBondContact O-CB 3.47Å; Q214-A218 PolarHBondContact O-N 3.49Å |
| 215 | G | 66.9 | Low | 74.2 | Confident | 41 Ų | 41 | 70.1 Ų | 70.1 | 42% | 0.423 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -69.5 | -34.9 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | D213 R219 | D213-G215 VanDerWaalsContact C-N 3.26Å; D213-G215 PolarHBondContact O-N 2.93Å; D213-G215 WeakPolarHBondContact OD1-CA 3.32Å; D213-G215 PolarHBondContact OD1-N 3.43Å; G215-R219 WeakPolarHBondContact O-CD 3.24Å; G215-R219 VanDerWaalsContact O-CG 3.24Å; G215-R219 WeakPolarHBondContact O-CG 3.47Å; G215-R219 PolarHBondContact O-N 3.01Å |
| 216 | L | 67.5 | Low | 73.9 | Confident | 47 Ų | 47 | 69.8 Ų | 69.8 | 25% | 0.246 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -68.3 | -48.2 | 172.1 | -168.2 | 155.7 | 0 | 0 | 0 | 111.4 | K168 D213 A218 R219 V220 | K168-L216 HydrophobicContact CD-CD1 3.65Å; K168-L216 VanDerWaalsContact NZ-CD1 3.27Å; D213-L216 HydrophobicContact CB-CB 4.12Å; D213-L216 PolarHBondContact O-N 3.25Å; D213-L216 PolarHBondContact OD1-N 3.11Å; D213-L216 VanDerWaalsContact OD1-N 3.1Å; L216-A218 VanDerWaalsContact C-N 3.28Å; L216-A218 PolarHBondContact O-N 2.76Å; L216-R219 PolarHBondContact O-N 3.13Å; L216-R219 VanDerWaalsContact O-N 3.08Å; L216-V220 HydrophobicContact CD2-CG2 4.25Å; L216-V220 PolarHBondContact O-N 2.9Å |
| 217 | L | 69.1 | Low | 73.8 | Confident | 37 Ų | 37 | 67.9 Ų | 67.9 | 19% | 0.194 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -60.1 | -39.1 | -179.9 | -67 | 174 | 0 | 0 | 0 | 111.8 | Y209 D213 Q214 R219 V220 P223 | Y209-L217 HydrophobicContact CD1-CD2 4.02Å; Y209-L217 HydrophobicContact CD2-CD1 3.95Å; Y209-L217 HydrophobicContact CD2-CD2 4.29Å; Y209-L217 HydrophobicContact CE2-CD1 4.48Å; Y209-L217 HydrophobicContact CG-CD1 4.27Å; Y209-L217 HydrophobicContact CG-CD2 3.82Å; D213-L217 WeakPolarHBondContact O-CG 3.39Å; D213-L217 PolarHBondContact O-N 3.25Å; Q214-L217 PolarHBondContact O-N 3.2Å; L217-R219 VanDerWaalsContact C-N 3.28Å; L217-R219 PolarHBondContact O-N 3.35Å; L217-V220 PolarHBondContact O-N 2.84Å; L217-P223 HydrophobicContact CD2-CB 4.05Å; L217-P223 HydrophobicContact CD2-CG 4.36Å |
| 218 | A | 70.4 | Confident | 73.5 | Confident | 87 Ų | 87 | 67.8 Ų | 67.8 | 72% | 0.719 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -67 | -26.4 | 177 | 0 | 0 | 0 | 0 | 0 | 113.8 | Q214 L216 V220 | Q214-A218 WeakPolarHBondContact O-CB 3.47Å; Q214-A218 PolarHBondContact O-N 3.49Å; L216-A218 VanDerWaalsContact C-N 3.28Å; L216-A218 PolarHBondContact O-N 2.76Å; A218-V220 VanDerWaalsContact C-N 3.33Å |
| 219 | R | 70.5 | Confident | 73.3 | Confident | 208 Ų | 208 | 66.6 Ų | 66.6 | 79% | 0.785 | 34% | 0.342 | S | S | * | . | H | α-helix | trans | -80 | -17.7 | 177.9 | -72.2 | 172.1 | 67.8 | 172.3 | 3.9 | 112.9 | G215 L216 L217 | G215-R219 WeakPolarHBondContact O-CD 3.24Å; G215-R219 VanDerWaalsContact O-CG 3.24Å; G215-R219 WeakPolarHBondContact O-CG 3.47Å; G215-R219 PolarHBondContact O-N 3.01Å; L216-R219 PolarHBondContact O-N 3.13Å; L216-R219 VanDerWaalsContact O-N 3.08Å; L217-R219 VanDerWaalsContact C-N 3.28Å; L217-R219 PolarHBondContact O-N 3.35Å |
| 220 | V | 67.5 | Low | 73.7 | Confident | 31 Ų | 31 | 63.9 Ų | 63.9 | 19% | 0.188 | 33% | 0.331 | C | S | . | . | S | Bend | trans | -89.9 | 119.3 | 176.5 | -178.2 | 0 | 0 | 0 | 0 | 108 | A179 L216 L217 A218 R222 P223 | A179-V220 HydrophobicContact CB-CG1 3.65Å; L216-V220 HydrophobicContact CD2-CG2 4.25Å; L216-V220 PolarHBondContact O-N 2.9Å; L217-V220 PolarHBondContact O-N 2.84Å; A218-V220 VanDerWaalsContact C-N 3.33Å; V220-R222 PolarHBondContact O-N 3.19Å; V220-R222 VanDerWaalsContact O-N 3.12Å; V220-P223 HydrophobicContact CB-CB 4.32Å; V220-P223 HydrophobicContact CG1-CB 4.13Å |
| 221 | P | 59.2 | Low | 74.1 | Confident | 130 Ų | 130 | 65 Ų | 65 | 84% | 0.844 | 34% | 0.337 | S | S | * | . | S | Bend | trans | -58.9 | -30.1 | -175.9 | -24.2 | 32.5 | 0 | 0 | 0 | 113.8 | ||
| 222 | R | 66.9 | Low | 74.5 | Confident | 223 Ų | 223 | 69.1 Ų | 69.1 | 84% | 0.842 | 35% | 0.354 | S | S | * | . | S | Bend | trans | -152 | 86.4 | 176.6 | -65.6 | -172.7 | -179.6 | 148.1 | -0 | 110.3 | V220 R224 | V220-R222 PolarHBondContact O-N 3.19Å; V220-R222 VanDerWaalsContact O-N 3.12Å; R222-R224 PolarHBondContact O-N 3.28Å |
| 223 | P | 69.2 | Low | 74.9 | Confident | 33 Ų | 33 | 69.5 Ų | 69.5 | 21% | 0.214 | 35% | 0.349 | C | S | . | . | P | Polyproline II helix | trans | -68.3 | 128 | 175.3 | 28.3 | -32.1 | 0 | 0 | 0 | 109.1 | Y209 L217 V220 | Y209-P223 HydrophobicContact CD1-CB 4.14Å; Y209-P223 HydrophobicContact CE1-CB 3.93Å; Y209-P223 HydrophobicContact CE1-CG 3.97Å; L217-P223 HydrophobicContact CD2-CB 4.05Å; L217-P223 HydrophobicContact CD2-CG 4.36Å; V220-P223 HydrophobicContact CB-CB 4.32Å; V220-P223 HydrophobicContact CG1-CB 4.13Å |
| 224 | R | 75.3 | Confident | 75.3 | Confident | 114 Ų | 114 | 71.9 Ų | 71.9 | 43% | 0.43 | 36% | 0.362 | S | S | . | . | P | Polyproline II helix | trans | -75.9 | 133 | 174.5 | -67.1 | -168.7 | 176.7 | -161.8 | -6.1 | 109.7 | C181 R222 E228 I229 H232 | C181-R224 PolarHBondContact SG-O 3.05Å; R222-R224 PolarHBondContact O-N 3.28Å; R224-E228 VanDerWaalsContact CA-OE2 3.22Å; R224-E228 WeakPolarHBondContact CA-OE2 3.46Å; R224-E228 HydrophobicContact CB-CB 4.4Å; R224-E228 WeakPolarHBondContact CB-OE2 3.47Å; R224-E228 WeakPolarHBondContact CG-OE2 3.47Å; R224-I229 HydrophobicContact CB-CD1 4.29Å; R224-I229 HydrophobicContact CB-CG1 4.13Å; R224-H232 PolarHBondContact NH1-CD2 3.38Å; R224-H232 PolarHBondContact NH1-NE2 2.93Å |
| 225 | T | 83.5 | Confident | 75.9 | Confident | 4 Ų | 4 | 65.1 Ų | 65.1 | 3% | 0.025 | 33% | 0.332 | C | S | . | . | P | Polyproline II helix | trans | -72 | 159.4 | 172.1 | 65.3 | 0 | 0 | 0 | 0 | 110.2 | D208 Y209 L227 E228 I229 L252 | D208-T225 CarbonylContact O-C 3.45Å; D208-T225 WeakPolarHBondContact O-CA 3.44Å; Y209-T225 HydrophobicContact CE1-CG2 3.74Å; T225-L227 PolarHBondContact O-N 3.37Å; T225-E228 WeakPolarHBondContact O-CB 3.46Å; T225-E228 PolarHBondContact O-N 3.38Å; T225-E228 VanDerWaalsContact O-N 3.13Å; T225-E228 WeakPolarHBondContact OG1-CG 3.48Å; T225-E228 PolarHBondContact OG1-N 3.39Å; T225-I229 WeakPolarHBondContact O-CG1 3.46Å; T225-I229 PolarHBondContact O-N 3.08Å; T225-L252 HydrophobicContact CG2-CD2 3.6Å; T225-L252 WeakPolarHBondContact OG1-CD2 3.35Å |
| 226 | L | 85.4 | Confident | 76.9 | Confident | 0 Ų | 0 | 69 Ų | 69 | 0% | 0 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -61.5 | -32.6 | 173 | -80 | 170.8 | 0 | 0 | 0 | 112.2 | L185 Y186 D208 N210 I229 C230 L243 | L185-L226 HydrophobicContact CB-CD1 4.18Å; L185-L226 HydrophobicContact CD2-CD1 3.33Å; L185-L226 HydrophobicContact CG-CD1 3.72Å; Y186-L226 HydrophobicContact CD2-CD2 4.33Å; D208-L226 PolarHBondContact O-N 2.94Å; N210-L226 HydrophobicContact CB-CD1 3.9Å; L226-I229 HydrophobicContact CD2-CD1 4.36Å; L226-I229 PolarHBondContact O-N 2.94Å; L226-C230 WeakPolarHBondContact O-CB 3.44Å; L226-C230 PolarHBondContact O-N 3.35Å; L226-C230 PolarHBondContact O-SG 3.43Å; L226-L243 HydrophobicContact CB-CD1 3.94Å; L226-L243 HydrophobicContact CB-CD2 4.32Å; L226-L243 HydrophobicContact CD1-CD2 4.46Å |
| 227 | L | 87.6 | Confident | 78 | Confident | 1 Ų | 1 | 68 Ų | 68 | 1% | 0.005 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -60.4 | -45.7 | 172.1 | -77.2 | 171.7 | 0 | 0 | 0 | 111.6 | T225 I229 C230 L231 I240 L243 A248 N249 I250 L252 L270 | T225-L227 PolarHBondContact O-N 3.37Å; L227-I229 VanDerWaalsContact C-N 3.29Å; L227-I229 PolarHBondContact O-N 3.42Å; L227-C230 PolarHBondContact O-N 3.22Å; L227-L231 VanDerWaalsContact O-CG 3.3Å; L227-L231 WeakPolarHBondContact O-CG 3.27Å; L227-L231 PolarHBondContact O-N 3.44Å; L227-I240 HydrophobicContact CD2-CG2 4.04Å; L227-L243 HydrophobicContact CD2-CB 3.74Å; L227-L243 HydrophobicContact CD2-CD1 3.71Å; L227-L243 HydrophobicContact CD2-CG 4.39Å; L227-L243 HydrophobicContact CG-CB 4.24Å; L227-L243 HydrophobicContact CG-CD1 3.93Å; L227-A248 HydrophobicContact CD1-CB 3.77Å; L227-A248 HydrophobicContact CG-CB 4.16Å; L227-N249 WeakPolarHBondContact CD1-O 3.14Å; L227-I250 HydrophobicContact CD1-CG2 4.45Å; L227-L252 HydrophobicContact CB-CD1 3.77Å; L227-L252 HydrophobicContact CD1-CD1 4.32Å; L227-L270 HydrophobicContact CD1-CD1 4.25Å |
| 228 | E | 83.6 | Confident | 79.2 | Confident | 16 Ų | 16 | 70.5 Ų | 70.5 | 8% | 0.075 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -60.6 | -41.4 | 174.5 | -73.2 | 171.4 | -164.6 | 0 | 0 | 111.6 | R224 T225 L231 H232 L252 S254 L255 | R224-E228 VanDerWaalsContact CA-OE2 3.22Å; R224-E228 WeakPolarHBondContact CA-OE2 3.46Å; R224-E228 HydrophobicContact CB-CB 4.4Å; R224-E228 WeakPolarHBondContact CB-OE2 3.47Å; R224-E228 WeakPolarHBondContact CG-OE2 3.47Å; T225-E228 WeakPolarHBondContact O-CB 3.46Å; T225-E228 PolarHBondContact O-N 3.38Å; T225-E228 VanDerWaalsContact O-N 3.13Å; T225-E228 WeakPolarHBondContact OG1-CG 3.48Å; T225-E228 PolarHBondContact OG1-N 3.39Å; E228-L231 PolarHBondContact O-N 2.98Å; E228-H232 WeakPolarHBondContact O-CB 3.44Å; E228-H232 PolarHBondContact O-CD2 2.97Å; E228-H232 PolarHBondContact O-N 2.95Å; E228-L252 HydrophobicContact CG-CD1 4.18Å; E228-L252 HydrophobicContact CG-CD2 4.46Å; E228-S254 PolarHBondContact OE1-OG 2.9Å; E228-L255 HydrophobicContact CB-CD1 4.49Å; E228-L255 HydrophobicContact CG-CD1 3.59Å; E228-L255 HydrophobicContact CG-CG 4.43Å |
| 229 | I | 81.8 | Confident | 80.3 | Confident | 8 Ų | 8 | 66.7 Ų | 66.7 | 4% | 0.041 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -64.8 | -47.4 | 179.9 | -66.8 | 164.5 | 0 | 0 | 0 | 110.1 | C181 Y186 V190 R224 T225 L226 L227 L231 H232 H233 | C181-I229 HydrophobicContact CB-CD1 4.23Å; Y186-I229 HydrophobicContact CD2-CD1 3.6Å; Y186-I229 HydrophobicContact CD2-CG1 4.46Å; Y186-I229 HydrophobicContact CD2-CG2 3.75Å; Y186-I229 HydrophobicContact CE2-CD1 3.73Å; Y186-I229 HydrophobicContact CE2-CG1 4.28Å; Y186-I229 HydrophobicContact CE2-CG2 3.57Å; V190-I229 HydrophobicContact CG2-CG2 4.24Å; R224-I229 HydrophobicContact CB-CD1 4.29Å; R224-I229 HydrophobicContact CB-CG1 4.13Å; T225-I229 WeakPolarHBondContact O-CG1 3.46Å; T225-I229 PolarHBondContact O-N 3.08Å; L226-I229 HydrophobicContact CD2-CD1 4.36Å; L226-I229 PolarHBondContact O-N 2.94Å; L227-I229 VanDerWaalsContact C-N 3.29Å; L227-I229 PolarHBondContact O-N 3.42Å; I229-L231 VanDerWaalsContact C-N 3.29Å; I229-L231 PolarHBondContact O-N 3.41Å; I229-H232 PolarHBondContact O-N 2.89Å; I229-H233 WeakPolarHBondContact O-CB 3.47Å; I229-H233 PolarHBondContact O-CD2 2.84Å; I229-H233 VanDerWaalsContact O-CD2 3.28Å; I229-H233 PolarHBondContact O-N 3.3Å |
| 230 | C | 86.6 | Confident | 81.3 | Confident | 0 Ų | 0 | 57 Ų | 57 | 0% | 0 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -59 | -40.9 | 177.3 | -71.8 | 0 | 0 | 0 | 0 | 112.1 | L226 L227 N234 C235 I240 | L226-C230 WeakPolarHBondContact O-CB 3.44Å; L226-C230 PolarHBondContact O-N 3.35Å; L226-C230 PolarHBondContact O-SG 3.43Å; L227-C230 PolarHBondContact O-N 3.22Å; C230-N234 PolarHBondContact O-N 3.16Å; C230-C235 HydrophobicContact CB-CB 3.99Å; C230-C235 WeakPolarHBondContact O-CB 3.39Å; C230-C235 PolarHBondContact O-N 3.06Å; C230-I240 HydrophobicContact CB-CG1 4.12Å |
| 231 | L | 83 | Confident | 82.5 | Confident | 26 Ų | 26 | 58.8 Ų | 58.8 | 14% | 0.136 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -67.5 | -44 | 175.4 | -68.9 | 169.6 | 0 | 0 | 0 | 111.9 | L227 E228 I229 H233 N234 I240 L255 I267 L270 | L227-L231 VanDerWaalsContact O-CG 3.3Å; L227-L231 WeakPolarHBondContact O-CG 3.27Å; L227-L231 PolarHBondContact O-N 3.44Å; E228-L231 PolarHBondContact O-N 2.98Å; I229-L231 VanDerWaalsContact C-N 3.29Å; I229-L231 PolarHBondContact O-N 3.41Å; L231-H233 PolarHBondContact O-N 3.13Å; L231-N234 PolarHBondContact O-N 3.45Å; L231-I240 HydrophobicContact CD2-CD1 3.67Å; L231-I240 HydrophobicContact CG-CD1 4.31Å; L231-L255 HydrophobicContact CD1-CD1 3.83Å; L231-L255 HydrophobicContact CD1-CD2 4.36Å; L231-I267 HydrophobicContact CD2-CG1 3.88Å; L231-L270 HydrophobicContact CD1-CD2 4.45Å |
| 232 | H | 79.9 | Confident | 84.2 | Confident | 109 Ų | 109 | 53.2 Ų | 53.2 | 51% | 0.505 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -67.4 | -34.3 | 179.9 | -83.5 | -60.3 | 0 | 0 | 0 | 113.9 | R224 E228 I229 N234 | R224-H232 PolarHBondContact NH1-CD2 3.38Å; R224-H232 PolarHBondContact NH1-NE2 2.93Å; E228-H232 WeakPolarHBondContact O-CB 3.44Å; E228-H232 PolarHBondContact O-CD2 2.97Å; E228-H232 PolarHBondContact O-N 2.95Å; I229-H232 PolarHBondContact O-N 2.89Å; H232-N234 VanDerWaalsContact C-N 3.32Å |
| 233 | H | 78.7 | Confident | 85.5 | Confident | 105 Ų | 105 | 42.6 Ų | 42.6 | 49% | 0.486 | 21% | 0.206 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -92 | 7.1 | 179 | -72.4 | -78.8 | 0 | 0 | 0 | 113.1 | I229 L231 C235 | I229-H233 WeakPolarHBondContact O-CB 3.47Å; I229-H233 PolarHBondContact O-CD2 2.84Å; I229-H233 VanDerWaalsContact O-CD2 3.28Å; I229-H233 PolarHBondContact O-N 3.3Å; L231-H233 PolarHBondContact O-N 3.13Å; H233-C235 PolarHBondContact O-N 3.31Å |
| 234 | N | 76.9 | Confident | 86.6 | Confident | 126 Ų | 126 | 41.9 Ų | 41.9 | 67% | 0.674 | 20% | 0.201 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 53.9 | 38.3 | 178.2 | -144.7 | 91.2 | 0 | 0 | 0 | 112.4 | C230 L231 H232 | C230-N234 PolarHBondContact O-N 3.16Å; L231-N234 PolarHBondContact O-N 3.45Å; H232-N234 VanDerWaalsContact C-N 3.32Å |
| 235 | C | 83.6 | Confident | 87.4 | Confident | 21 Ų | 21 | 38.4 Ų | 38.4 | 14% | 0.142 | 19% | 0.191 | C | C | . | . | trans | -61 | 153 | 177.6 | -65.5 | 0 | 0 | 0 | 0 | 110.5 | C230 H233 Y239 | C230-C235 HydrophobicContact CB-CB 3.99Å; C230-C235 WeakPolarHBondContact O-CB 3.39Å; C230-C235 PolarHBondContact O-N 3.06Å; H233-C235 PolarHBondContact O-N 3.31Å; C235-Y239 HydrophobicContact CB-CD2 3.93Å; C235-Y239 HydrophobicContact CB-CG 4.21Å | ||
| 236 | E | 89.1 | Confident | 87.9 | Confident | 124 Ų | 124 | 39.3 Ų | 39.3 | 58% | 0.579 | 19% | 0.194 | S | C | * | . | trans | -54.6 | 144.9 | 175.9 | -65.1 | -61.1 | 147.8 | 0 | 0 | 111.8 | E238 Y239 | E236-E238 WeakPolarHBondContact CB-OE2 3.44Å; E236-E238 PolarHBondContact O-N 2.9Å; E236-Y239 HydrophobicContact CB-CD2 4.02Å; E236-Y239 HydrophobicContact CB-CE2 4.17Å; E236-Y239 WeakPolarHBondContact O-CD2 3.32Å; E236-Y239 PolarHBondContact O-N 3.47Å | ||
| 237 | P | 90.8 | Very high | 88.1 | Confident | 26 Ų | 26 | 40.6 Ų | 40.6 | 17% | 0.169 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -60 | -22.3 | -175.6 | 24.6 | -33.9 | 0 | 0 | 0 | 113.1 | Y239 I240 Q241 K265 L269 | P237-Y239 VanDerWaalsContact C-N 3.27Å; P237-Y239 PolarHBondContact O-N 3.46Å; P237-I240 PolarHBondContact O-N 3.26Å; P237-I240 VanDerWaalsContact O-N 3.16Å; P237-Q241 PolarHBondContact O-N 2.9Å; P237-K265 HydrophobicContact CB-CB 4.13Å; P237-K265 HydrophobicContact CG-CB 4.31Å; P237-L269 HydrophobicContact CB-CD1 3.93Å |
| 238 | E | 93.1 | Very high | 88.3 | Confident | 89 Ų | 89 | 40.6 Ų | 40.6 | 42% | 0.416 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -59.3 | -33.6 | 174.8 | -70.3 | 73.1 | -165.7 | 0 | 0 | 112.6 | L194 E236 Q241 L242 | L194-E238 HydrophobicContact CD1-CB 4Å; L194-E238 HydrophobicContact CD2-CB 3.93Å; L194-E238 HydrophobicContact CD2-CG 4.34Å; E236-E238 WeakPolarHBondContact CB-OE2 3.44Å; E236-E238 PolarHBondContact O-N 2.9Å; E238-Q241 PolarHBondContact O-N 3.29Å; E238-L242 WeakPolarHBondContact O-CB 3.4Å; E238-L242 VanDerWaalsContact O-CG 3.28Å; E238-L242 WeakPolarHBondContact O-CG 3.39Å; E238-L242 PolarHBondContact O-N 2.94Å |
| 239 | Y | 93.1 | Very high | 88.5 | Confident | 7 Ų | 7 | 43 Ų | 43 | 3% | 0.027 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -64.6 | -45.4 | 174.9 | -72.3 | -90.8 | 0 | 0 | 0 | 111 | A189 G192 H193 L194 F197 C235 E236 P237 L242 L243 | A189-Y239 HydrophobicContact CB-CD1 4.21Å; A189-Y239 HydrophobicContact CB-CE1 4.26Å; G192-Y239 VanDerWaalsContact CA-OH 3.26Å; G192-Y239 WeakPolarHBondContact CA-OH 3.27Å; G192-Y239 PolarHBondContact O-OH 2.86Å; G192-Y239 VanDerWaalsContact O-OH 3.11Å; H193-Y239 VanDerWaalsContact C-OH 3.3Å; H193-Y239 PolarHBondContact N-OH 3.48Å; H193-Y239 VanDerWaalsContact N-OH 3.12Å; L194-Y239 VanDerWaalsContact CA-OH 3.28Å; L194-Y239 WeakPolarHBondContact CA-OH 3.35Å; L194-Y239 HydrophobicContact CB-CE1 4.49Å; L194-Y239 HydrophobicContact CB-CE2 4.28Å; L194-Y239 HydrophobicContact CD1-CD1 4.08Å; L194-Y239 HydrophobicContact CD1-CD2 3.96Å; L194-Y239 HydrophobicContact CD1-CE1 3.97Å; L194-Y239 HydrophobicContact CD1-CE2 3.84Å; L194-Y239 HydrophobicContact CD1-CG 4.07Å; L194-Y239 PolarHBondContact N-OH 3.21Å; F197-Y239 HydrophobicContact CB-CD1 4.13Å; F197-Y239 HydrophobicContact CB-CE1 3.74Å; F197-Y239 AromaticContact CD1-CD1 3.7Å; F197-Y239 HydrophobicContact CD1-CD1 3.7Å; F197-Y239 HydrophobicContact CD1-CE1 4.21Å; F197-Y239 AromaticContact CD2-CD1 3.68Å; F197-Y239 HydrophobicContact CD2-CD1 3.68Å; F197-Y239 AromaticContact CD2-CE1 3.85Å; F197-Y239 HydrophobicContact CD2-CE1 3.85Å; F197-Y239 AromaticContact CE1-CD1 3.93Å; F197-Y239 HydrophobicContact CE1-CD1 3.93Å; F197-Y239 AromaticContact CE2-CD1 3.94Å; F197-Y239 HydrophobicContact CE2-CD1 3.94Å; F197-Y239 AromaticContact CG-CD1 3.57Å; F197-Y239 HydrophobicContact CG-CD1 3.57Å; F197-Y239 AromaticContact CG-CE1 3.68Å; F197-Y239 HydrophobicContact CG-CE1 3.68Å; F197-Y239 HydrophobicContact CZ-CD1 4.04Å; C235-Y239 HydrophobicContact CB-CD2 3.93Å; C235-Y239 HydrophobicContact CB-CG 4.21Å; E236-Y239 HydrophobicContact CB-CD2 4.02Å; E236-Y239 HydrophobicContact CB-CE2 4.17Å; E236-Y239 WeakPolarHBondContact O-CD2 3.32Å; E236-Y239 PolarHBondContact O-N 3.47Å; P237-Y239 VanDerWaalsContact C-N 3.27Å; P237-Y239 PolarHBondContact O-N 3.46Å; Y239-L242 PolarHBondContact O-N 2.74Å; Y239-L243 VanDerWaalsContact O-CG 3.3Å; Y239-L243 WeakPolarHBondContact O-CG 3.19Å; Y239-L243 PolarHBondContact O-N 3.07Å |
| 240 | I | 91.8 | Very high | 88.7 | Confident | 3 Ų | 3 | 43.4 Ų | 43.4 | 2% | 0.015 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -65.3 | -43.9 | 179.2 | -64.6 | 165.7 | 0 | 0 | 0 | 109.6 | L227 C230 L231 P237 L242 L243 I244 L269 | L227-I240 HydrophobicContact CD2-CG2 4.04Å; C230-I240 HydrophobicContact CB-CG1 4.12Å; L231-I240 HydrophobicContact CD2-CD1 3.67Å; L231-I240 HydrophobicContact CG-CD1 4.31Å; P237-I240 PolarHBondContact O-N 3.26Å; P237-I240 VanDerWaalsContact O-N 3.16Å; I240-L242 PolarHBondContact O-N 2.89Å; I240-L243 PolarHBondContact O-N 3.16Å; I240-I244 HydrophobicContact CG2-CD1 3.82Å; I240-I244 HydrophobicContact CG2-CG1 4.48Å; I240-I244 VanDerWaalsContact O-CG1 3.27Å; I240-I244 WeakPolarHBondContact O-CG1 3.48Å; I240-I244 PolarHBondContact O-N 3.38Å; I240-L269 HydrophobicContact CG2-CB 4.43Å |
| 241 | Q | 93.3 | Very high | 88.4 | Confident | 70 Ų | 70 | 50.4 Ų | 50.4 | 33% | 0.327 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -59.2 | -46.3 | 175.7 | -175.3 | 56.3 | 43.8 | 0 | 0 | 111.5 | P237 E238 I244 D245 L269 | P237-Q241 PolarHBondContact O-N 2.9Å; E238-Q241 PolarHBondContact O-N 3.29Å; Q241-I244 PolarHBondContact O-N 3.41Å; Q241-D245 PolarHBondContact NE2-OD2 3.14Å; Q241-D245 VanDerWaalsContact O-CB 3.3Å; Q241-D245 WeakPolarHBondContact O-CB 3.48Å; Q241-D245 PolarHBondContact O-N 3.27Å; Q241-L269 HydrophobicContact CB-CD1 4.22Å |
| 242 | L | 94.7 | Very high | 88 | Confident | 13 Ų | 13 | 49.6 Ų | 49.6 | 7% | 0.068 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -60.6 | -47 | 176 | -77.1 | 172.2 | 0 | 0 | 0 | 111.6 | L194 F197 R198 L201 E238 Y239 I240 I244 D245 F246 | L194-L242 HydrophobicContact CD1-CD1 3.7Å; F197-L242 HydrophobicContact CD1-CB 4.44Å; F197-L242 HydrophobicContact CD1-CD1 4.01Å; F197-L242 HydrophobicContact CE1-CB 4.17Å; R198-L242 HydrophobicContact CB-CD1 4Å; R198-L242 HydrophobicContact CG-CD2 4.29Å; L201-L242 HydrophobicContact CD1-CB 3.9Å; E238-L242 WeakPolarHBondContact O-CB 3.4Å; E238-L242 VanDerWaalsContact O-CG 3.28Å; E238-L242 WeakPolarHBondContact O-CG 3.39Å; E238-L242 PolarHBondContact O-N 2.94Å; Y239-L242 PolarHBondContact O-N 2.74Å; I240-L242 PolarHBondContact O-N 2.89Å; L242-I244 VanDerWaalsContact C-N 3.33Å; L242-I244 PolarHBondContact O-N 2.89Å; L242-D245 PolarHBondContact O-N 2.95Å; L242-D245 VanDerWaalsContact O-N 3.15Å; L242-F246 HydrophobicContact CD2-CD2 4.48Å; L242-F246 HydrophobicContact CD2-CE2 4.09Å; L242-F246 WeakPolarHBondContact O-CB 3.33Å; L242-F246 VanDerWaalsContact O-CD2 3.27Å; L242-F246 WeakPolarHBondContact O-CD2 3.33Å; L242-F246 PolarHBondContact O-N 3.34Å |
| 243 | L | 93.6 | Very high | 87.2 | Confident | 0 Ų | 0 | 50.8 Ų | 50.8 | 0% | 0 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -57.6 | -46.3 | 177.1 | -73.8 | 177.3 | 0 | 0 | 0 | 111.7 | F197 P207 L226 L227 Y239 I240 D245 F246 G247 A248 | F197-L243 HydrophobicContact CE1-CD2 4.03Å; F197-L243 HydrophobicContact CE1-CG 4Å; F197-L243 HydrophobicContact CZ-CD1 4.05Å; F197-L243 HydrophobicContact CZ-CD2 3.56Å; F197-L243 HydrophobicContact CZ-CG 3.67Å; P207-L243 HydrophobicContact CB-CD2 3.81Å; P207-L243 WeakPolarHBondContact O-CD2 3.34Å; L226-L243 HydrophobicContact CB-CD1 3.94Å; L226-L243 HydrophobicContact CB-CD2 4.32Å; L226-L243 HydrophobicContact CD1-CD2 4.46Å; L227-L243 HydrophobicContact CD2-CB 3.74Å; L227-L243 HydrophobicContact CD2-CD1 3.71Å; L227-L243 HydrophobicContact CD2-CG 4.39Å; L227-L243 HydrophobicContact CG-CB 4.24Å; L227-L243 HydrophobicContact CG-CD1 3.93Å; Y239-L243 VanDerWaalsContact O-CG 3.3Å; Y239-L243 WeakPolarHBondContact O-CG 3.19Å; Y239-L243 PolarHBondContact O-N 3.07Å; I240-L243 PolarHBondContact O-N 3.16Å; L243-D245 PolarHBondContact O-N 3.38Å; L243-F246 PolarHBondContact O-N 3.32Å; L243-G247 PolarHBondContact O-N 3.32Å; L243-G247 VanDerWaalsContact O-N 3.16Å; L243-A248 HydrophobicContact CB-CB 3.9Å; L243-A248 WeakPolarHBondContact O-CB 3.31Å; L243-A248 PolarHBondContact O-N 3.22Å |
| 244 | I | 92.3 | Very high | 86.4 | Confident | 18 Ų | 18 | 49.4 Ų | 49.4 | 9% | 0.092 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -59.1 | -49.8 | 174.6 | -67.5 | 165.2 | 0 | 0 | 0 | 109.8 | I240 Q241 L242 F246 G247 I250 L269 A273 R278 | I240-I244 HydrophobicContact CG2-CD1 3.82Å; I240-I244 HydrophobicContact CG2-CG1 4.48Å; I240-I244 VanDerWaalsContact O-CG1 3.27Å; I240-I244 WeakPolarHBondContact O-CG1 3.48Å; I240-I244 PolarHBondContact O-N 3.38Å; Q241-I244 PolarHBondContact O-N 3.41Å; L242-I244 VanDerWaalsContact C-N 3.33Å; L242-I244 PolarHBondContact O-N 2.89Å; I244-F246 VanDerWaalsContact C-N 3.26Å; I244-F246 PolarHBondContact O-N 2.7Å; I244-G247 PolarHBondContact O-N 3.05Å; I244-G247 VanDerWaalsContact O-N 3.07Å; I244-I250 HydrophobicContact CG1-CG2 4.01Å; I244-L269 HydrophobicContact CD1-CB 4.36Å; I244-A273 HydrophobicContact CD1-CB 3.99Å; I244-A273 HydrophobicContact CG1-CB 4.43Å; I244-A273 HydrophobicContact CG2-CB 4Å; I244-R278 PolarHBondContact O-NH1 3.08Å; I244-R278 PolarHBondContact O-NH2 3.08Å |
| 245 | D | 92.8 | Very high | 85.9 | Confident | 41 Ų | 41 | 45.5 Ų | 45.5 | 22% | 0.219 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -60.6 | -33.5 | -177.6 | -93 | -45.3 | 0 | 0 | 0 | 113.9 | Q241 L242 L243 R285 | Q241-D245 PolarHBondContact NE2-OD2 3.14Å; Q241-D245 VanDerWaalsContact O-CB 3.3Å; Q241-D245 WeakPolarHBondContact O-CB 3.48Å; Q241-D245 PolarHBondContact O-N 3.27Å; L242-D245 PolarHBondContact O-N 2.95Å; L242-D245 VanDerWaalsContact O-N 3.15Å; L243-D245 PolarHBondContact O-N 3.38Å; D245-R285 PolarHBondContact O-NH2 3.13Å; D245-R285 IonicContact OD1-CZ 3.46Å; D245-R285 IonicContact OD1-NH1 3.47Å; D245-R285 IonicContact OD1-NH2 2.8Å; D245-R285 PolarHBondContact OD1-NH2 3.3Å |
| 246 | F | 93.5 | Very high | 84.7 | Confident | 23 Ų | 23 | 49.5 Ų | 49.5 | 10% | 0.101 | 27% | 0.273 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -90.5 | 3.3 | 178.3 | -81.9 | -93.6 | 0 | 0 | 0 | 114.4 | L201 L202 P207 L242 L243 I244 L286 H316 | L201-F246 VanDerWaalsContact C-CE1 3.4Å; L201-F246 HydrophobicContact CB-CD1 3.71Å; L201-F246 HydrophobicContact CB-CD2 3.93Å; L201-F246 HydrophobicContact CB-CE1 3.68Å; L201-F246 HydrophobicContact CB-CE2 3.9Å; L201-F246 HydrophobicContact CB-CG 3.81Å; L201-F246 HydrophobicContact CB-CZ 3.77Å; L201-F246 HydrophobicContact CD1-CB 4.37Å; L201-F246 HydrophobicContact CD1-CD2 3.78Å; L201-F246 HydrophobicContact CD1-CE2 4.22Å; L201-F246 HydrophobicContact CD1-CG 4.07Å; L201-F246 HydrophobicContact CD2-CB 4.04Å; L201-F246 HydrophobicContact CD2-CD1 4.47Å; L201-F246 HydrophobicContact CD2-CG 4.17Å; L201-F246 HydrophobicContact CG-CD2 4.36Å; L201-F246 HydrophobicContact CG-CG 4.25Å; L201-F246 WeakPolarHBondContact O-CE1 3.43Å; L202-F246 HydrophobicContact CD2-CE1 4.33Å; L202-F246 HydrophobicContact CD2-CZ 3.79Å; L202-F246 HydrophobicContact CG-CZ 4.06Å; P207-F246 HydrophobicContact CB-CB 4.4Å; L242-F246 HydrophobicContact CD2-CD2 4.48Å; L242-F246 HydrophobicContact CD2-CE2 4.09Å; L242-F246 WeakPolarHBondContact O-CB 3.33Å; L242-F246 VanDerWaalsContact O-CD2 3.27Å; L242-F246 WeakPolarHBondContact O-CD2 3.33Å; L242-F246 PolarHBondContact O-N 3.34Å; L243-F246 PolarHBondContact O-N 3.32Å; I244-F246 VanDerWaalsContact C-N 3.26Å; I244-F246 PolarHBondContact O-N 2.7Å; F246-L286 WeakPolarHBondContact O-CD2 3.27Å; F246-H316 AromaticContact CD2-CE1 3.68Å; F246-H316 AromaticContact CE1-NE2 3.74Å; F246-H316 AromaticContact CE2-CD2 3.84Å; F246-H316 AromaticContact CE2-CE1 3.44Å; F246-H316 VanDerWaalsContact CE2-CE1 3.44Å; F246-H316 WeakPolarHBondContact CE2-CE1 3.4Å; F246-H316 AromaticContact CE2-CG 3.8Å; F246-H316 AromaticContact CE2-ND1 3.56Å; F246-H316 AromaticContact CE2-NE2 3.66Å; F246-H316 AromaticContact CZ-CD2 3.46Å; F246-H316 VanDerWaalsContact CZ-CD2 3.46Å; F246-H316 WeakPolarHBondContact CZ-CD2 3.49Å; F246-H316 AromaticContact CZ-CE1 3.77Å; F246-H316 AromaticContact CZ-CG 3.82Å; F246-H316 AromaticContact CZ-NE2 3.48Å; F246-H316 WeakPolarHBondContact CZ-NE2 3.47Å |
| 247 | G | 91.3 | Very high | 83.4 | Confident | 26 Ų | 26 | 45.5 Ų | 45.5 | 27% | 0.268 | 26% | 0.255 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 100.9 | 13.9 | 167.9 | 0 | 0 | 0 | 0 | 0 | 115.6 | L243 I244 R278 | L243-G247 PolarHBondContact O-N 3.32Å; L243-G247 VanDerWaalsContact O-N 3.16Å; I244-G247 PolarHBondContact O-N 3.05Å; I244-G247 VanDerWaalsContact O-N 3.07Å; G247-R278 VanDerWaalsContact CA-NH2 3.31Å |
| 248 | A | 91.4 | Very high | 81.7 | Confident | 2 Ų | 2 | 50.6 Ų | 50.6 | 2% | 0.017 | 28% | 0.281 | C | S | . | . | trans | -52.4 | 143.8 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | P207 D208 L227 L243 I250 | P207-A248 HydrophobicContact CB-CB 4.05Å; P207-A248 HydrophobicContact CG-CB 4.43Å; D208-A248 VanDerWaalsContact OD1-CA 3.31Å; D208-A248 WeakPolarHBondContact OD1-CA 3.48Å; L227-A248 HydrophobicContact CD1-CB 3.77Å; L227-A248 HydrophobicContact CG-CB 4.16Å; L243-A248 HydrophobicContact CB-CB 3.9Å; L243-A248 WeakPolarHBondContact O-CB 3.31Å; L243-A248 PolarHBondContact O-N 3.22Å; A248-I250 PolarHBondContact O-N 3.23Å; A248-I250 VanDerWaalsContact O-N 3.08Å | ||
| 249 | N | 87.4 | Confident | 79.7 | Confident | 67 Ų | 67 | 53.3 Ų | 53.3 | 36% | 0.358 | 30% | 0.297 | S | S | . | . | trans | -67.3 | 103.2 | 171.1 | 179.8 | 18.3 | 0 | 0 | 0 | 110.2 | D208 L227 Y251 | D208-N249 PolarHBondContact OD1-N 3.23Å; L227-N249 WeakPolarHBondContact CD1-O 3.14Å; N249-Y251 VanDerWaalsContact C-N 3.26Å; N249-Y251 PolarHBondContact ND2-O 3.23Å; N249-Y251 PolarHBondContact O-N 2.89Å; N249-Y251 PolarHBondContact OD1-N 3.38Å | ||
| 250 | I | 85.4 | Confident | 77.6 | Confident | 15 Ų | 15 | 59.4 Ų | 59.4 | 8% | 0.077 | 34% | 0.335 | C | S | . | . | trans | -75.3 | -12.5 | 178.8 | 60.3 | 174.7 | 0 | 0 | 0 | 113.6 | L227 I244 A248 L252 L270 A273 R274 | L227-I250 HydrophobicContact CD1-CG2 4.45Å; I244-I250 HydrophobicContact CG1-CG2 4.01Å; A248-I250 PolarHBondContact O-N 3.23Å; A248-I250 VanDerWaalsContact O-N 3.08Å; I250-L252 PolarHBondContact O-N 3.21Å; I250-L270 HydrophobicContact CB-CD1 3.83Å; I250-L270 HydrophobicContact CG2-CD1 3.92Å; I250-A273 HydrophobicContact CD1-CB 4.17Å; I250-A273 VanDerWaalsContact CD1-O 3.28Å; I250-A273 WeakPolarHBondContact CD1-O 3.3Å; I250-A273 HydrophobicContact CG2-CB 4.43Å; I250-R274 HydrophobicContact CB-CG 4.47Å; I250-R274 HydrophobicContact CD1-CG 3.94Å; I250-R274 HydrophobicContact CG1-CG 4.27Å; I250-R274 VanDerWaalsContact O-CZ 3.24Å; I250-R274 PolarHBondContact O-NE 3.11Å; I250-R274 PolarHBondContact O-NH2 3.16Å | ||
| 251 | Y | 81.3 | Confident | 75.8 | Confident | 148 Ų | 148 | 62.5 Ų | 62.5 | 58% | 0.58 | 36% | 0.358 | S | S | * | . | trans | -90.1 | 99.1 | 178.6 | -62.6 | -76.6 | 0 | 0 | 0 | 109.5 | N249 P253 R274 | N249-Y251 VanDerWaalsContact C-N 3.26Å; N249-Y251 PolarHBondContact ND2-O 3.23Å; N249-Y251 PolarHBondContact O-N 2.89Å; N249-Y251 PolarHBondContact OD1-N 3.38Å; Y251-P253 WeakPolarHBondContact O-CD 3.34Å; Y251-R274 HydrophobicContact CE1-CG 4.43Å | ||
| 252 | L | 74.6 | Confident | 73.8 | Confident | 8 Ų | 8 | 68.4 Ų | 68.4 | 4% | 0.042 | 39% | 0.385 | C | S | . | . | trans | -109.7 | 102.6 | -175.9 | -58.1 | 171.4 | 0 | 0 | 0 | 108 | T225 L227 E228 I250 S254 L255 L270 | T225-L252 HydrophobicContact CG2-CD2 3.6Å; T225-L252 WeakPolarHBondContact OG1-CD2 3.35Å; L227-L252 HydrophobicContact CB-CD1 3.77Å; L227-L252 HydrophobicContact CD1-CD1 4.32Å; E228-L252 HydrophobicContact CG-CD1 4.18Å; E228-L252 HydrophobicContact CG-CD2 4.46Å; I250-L252 PolarHBondContact O-N 3.21Å; L252-S254 PolarHBondContact O-N 3.16Å; L252-L255 HydrophobicContact CB-CB 4.25Å; L252-L255 HydrophobicContact CB-CD1 3.88Å; L252-L255 HydrophobicContact CD1-CD1 3.44Å; L252-L255 VanDerWaalsContact CD1-CD1 3.44Å; L252-L255 HydrophobicContact CG-CD1 4.28Å; L252-L255 PolarHBondContact O-N 3.38Å; L252-L270 HydrophobicContact CD1-CD2 4.41Å | ||
| 253 | P | 63.2 | Low | 71.9 | Confident | 134 Ų | 134 | 75 Ų | 75 | 87% | 0.87 | 42% | 0.421 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.9 | -22.6 | -174.5 | -18.1 | 30.7 | 0 | 0 | 0 | 113.8 | Y251 | Y251-P253 WeakPolarHBondContact O-CD 3.34Š|
| 254 | S | 62.3 | Low | 71.1 | Confident | 77 Ų | 77 | 77.2 Ų | 77.2 | 54% | 0.538 | 43% | 0.433 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -78.9 | -19.1 | -177.5 | 47.2 | 0 | 0 | 0 | 0 | 113.9 | E228 L252 | E228-S254 PolarHBondContact OE1-OG 2.9Å; L252-S254 PolarHBondContact O-N 3.16Å |
| 255 | L | 64.9 | Low | 70.6 | Confident | 44 Ų | 44 | 83.7 Ų | 83.7 | 23% | 0.23 | 46% | 0.46 | C | S | . | . | trans | -99.3 | 101.4 | -176.2 | -92.3 | 152.5 | 0 | 0 | 0 | 110.3 | E228 L231 L252 L257 | E228-L255 HydrophobicContact CB-CD1 4.49Å; E228-L255 HydrophobicContact CG-CD1 3.59Å; E228-L255 HydrophobicContact CG-CG 4.43Å; L231-L255 HydrophobicContact CD1-CD1 3.83Å; L231-L255 HydrophobicContact CD1-CD2 4.36Å; L252-L255 HydrophobicContact CB-CB 4.25Å; L252-L255 HydrophobicContact CB-CD1 3.88Å; L252-L255 HydrophobicContact CD1-CD1 3.44Å; L252-L255 VanDerWaalsContact CD1-CD1 3.44Å; L252-L255 HydrophobicContact CG-CD1 4.28Å; L252-L255 PolarHBondContact O-N 3.38Å; L255-L257 PolarHBondContact O-N 3.43Å; L255-L257 VanDerWaalsContact O-N 3.15Å | ||
| 256 | S | 59.7 | Low | 70.1 | Confident | 104 Ų | 104 | 81.8 Ų | 81.8 | 73% | 0.727 | 45% | 0.45 | S | S | * | . | trans | -69.9 | 102.7 | 161.4 | -61.3 | 0 | 0 | 0 | 0 | 108.1 | D258 | S256-D258 PolarHBondContact O-N 3.01Š| ||
| 257 | L | 61.8 | Low | 69.7 | Low | 40 Ų | 40 | 82.8 Ų | 82.8 | 21% | 0.209 | 46% | 0.456 | C | S | . | . | trans | -76 | 59.2 | 172.6 | -63.3 | 178.6 | 0 | 0 | 0 | 109.9 | L255 L259 I267 L271 | L255-L257 PolarHBondContact O-N 3.43Å; L255-L257 VanDerWaalsContact O-N 3.15Å; L257-L259 PolarHBondContact O-N 2.76Å; L257-I267 HydrophobicContact CD2-CG2 4.09Å; L257-L271 HydrophobicContact CD1-CD2 3.52Å; L257-L271 HydrophobicContact CD1-CG 4.2Å | ||
| 258 | D | 54.1 | Low | 69.4 | Low | 133 Ų | 133 | 84.1 Ų | 84.1 | 71% | 0.711 | 46% | 0.464 | S | S | * | . | trans | -73.6 | 110.8 | 170.2 | -84.7 | -20 | 0 | 0 | 0 | 108 | S256 T260 | S256-D258 PolarHBondContact O-N 3.01Å; D258-T260 PolarHBondContact O-N 3.39Å; D258-T260 PolarHBondContact O-OG1 3.12Å | ||
| 259 | L | 52.4 | Low | 69.2 | Low | 146 Ų | 146 | 86 Ų | 86 | 76% | 0.764 | 47% | 0.474 | S | S | * | . | trans | -58 | 47.6 | -171.7 | -71 | 148.2 | 0 | 0 | 0 | 115.8 | L257 L271 | L257-L259 PolarHBondContact O-N 2.76Å; L259-L271 HydrophobicContact CD2-CD1 4.35Å | ||
| 260 | T | 47.8 | Very low | 69.2 | Low | 135 Ų | 135 | 82.8 Ų | 82.8 | 83% | 0.828 | 46% | 0.457 | S | S | * | . | trans | -93.5 | -14.7 | -173.4 | 52.6 | 0 | 0 | 0 | 0 | 114.6 | D258 | D258-T260 PolarHBondContact O-N 3.39Å; D258-T260 PolarHBondContact O-OG1 3.12Å | ||
| 261 | S | 54.2 | Low | 69.2 | Low | 69 Ų | 69 | 85.2 Ų | 85.2 | 48% | 0.483 | 47% | 0.47 | S | S | . | . | trans | -120.8 | 95.5 | 170.8 | 58.3 | 0 | 0 | 0 | 0 | 110.3 | D263 | S261-D263 PolarHBondContact O-N 3.26Š| ||
| 262 | Q | 51.5 | Low | 69.5 | Low | 193 Ų | 193 | 84 Ų | 84 | 90% | 0.902 | 47% | 0.469 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.2 | -3 | 174.7 | -75.8 | -163.1 | -27.7 | 0 | 0 | 114 | ||
| 263 | D | 54.9 | Low | 70.1 | Confident | 153 Ų | 153 | 84.6 Ų | 84.6 | 82% | 0.818 | 48% | 0.475 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -105.9 | -0.2 | -171.2 | -65.9 | -33.3 | 0 | 0 | 0 | 115.3 | S261 K265 | S261-D263 PolarHBondContact O-N 3.26Å; D263-K265 PolarHBondContact O-N 3.14Å |
| 264 | D | 76.1 | Confident | 71.2 | Confident | 46 Ų | 46 | 81.4 Ų | 81.4 | 25% | 0.246 | 45% | 0.446 | C | S | . | . | trans | -88.2 | 96.8 | 177.7 | -165.8 | -14.1 | 0 | 0 | 0 | 111.3 | G266 I267 A268 | D264-G266 PolarHBondContact O-N 3.1Å; D264-G266 VanDerWaalsContact O-N 3.14Å; D264-G266 PolarHBondContact OD1-N 3.38Å; D264-I267 HydrophobicContact CB-CB 4.26Å; D264-I267 HydrophobicContact CB-CD1 3.9Å; D264-I267 HydrophobicContact CB-CG1 4.01Å; D264-I267 PolarHBondContact O-N 3.01Å; D264-I267 VanDerWaalsContact O-N 3.09Å; D264-A268 PolarHBondContact O-N 3.49Å; D264-A268 VanDerWaalsContact O-N 3.14Å | ||
| 265 | K | 82.5 | Confident | 72.3 | Confident | 154 Ų | 154 | 81.6 Ų | 81.6 | 67% | 0.67 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -51.8 | -32.7 | 175.7 | -68 | 177.8 | -177.8 | 172.8 | 0 | 112.3 | P237 D263 A268 L269 | P237-K265 HydrophobicContact CB-CB 4.13Å; P237-K265 HydrophobicContact CG-CB 4.31Å; D263-K265 PolarHBondContact O-N 3.14Å; K265-A268 PolarHBondContact O-N 3.15Å; K265-L269 WeakPolarHBondContact O-CG 3.21Å; K265-L269 PolarHBondContact O-N 2.83Å; K265-L269 VanDerWaalsContact O-N 3.09Å |
| 266 | G | 82.8 | Confident | 73.3 | Confident | 1 Ų | 1 | 83.2 Ų | 83.2 | 1% | 0.01 | 46% | 0.464 | C | S | . | . | H | α-helix | trans | -65.6 | -43.9 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113 | D264 A268 L269 L270 | D264-G266 PolarHBondContact O-N 3.1Å; D264-G266 VanDerWaalsContact O-N 3.14Å; D264-G266 PolarHBondContact OD1-N 3.38Å; G266-A268 VanDerWaalsContact C-N 3.34Å; G266-L269 PolarHBondContact O-N 2.9Å; G266-L270 PolarHBondContact O-N 3.34Å; G266-L270 VanDerWaalsContact O-N 3.16Å |
| 267 | I | 83.3 | Confident | 74.5 | Confident | 43 Ų | 43 | 84 Ų | 84 | 22% | 0.221 | 47% | 0.467 | C | S | . | . | H | α-helix | trans | -65.4 | -40.3 | 175.8 | -63.6 | 177.4 | 0 | 0 | 0 | 110.6 | L231 L257 D264 L269 L270 L271 | L231-I267 HydrophobicContact CD2-CG1 3.88Å; L257-I267 HydrophobicContact CD2-CG2 4.09Å; D264-I267 HydrophobicContact CB-CB 4.26Å; D264-I267 HydrophobicContact CB-CD1 3.9Å; D264-I267 HydrophobicContact CB-CG1 4.01Å; D264-I267 PolarHBondContact O-N 3.01Å; D264-I267 VanDerWaalsContact O-N 3.09Å; I267-L269 VanDerWaalsContact C-N 3.35Å; I267-L269 PolarHBondContact O-N 3.47Å; I267-L270 PolarHBondContact O-N 3.33Å; I267-L271 HydrophobicContact CG2-CD1 4.08Å; I267-L271 HydrophobicContact CG2-CG 4.35Å; I267-L271 WeakPolarHBondContact O-CG 2.92Å; I267-L271 PolarHBondContact O-N 3.28Å |
| 268 | A | 85.8 | Confident | 75.8 | Confident | 54 Ų | 54 | 85.5 Ų | 85.5 | 45% | 0.446 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -59.6 | -43.9 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112 | D264 K265 G266 L270 L271 Q272 | D264-A268 PolarHBondContact O-N 3.49Å; D264-A268 VanDerWaalsContact O-N 3.14Å; K265-A268 PolarHBondContact O-N 3.15Å; G266-A268 VanDerWaalsContact C-N 3.34Å; A268-L270 VanDerWaalsContact C-N 3.35Å; A268-L270 PolarHBondContact O-N 3.35Å; A268-L271 PolarHBondContact O-N 2.92Å; A268-Q272 WeakPolarHBondContact O-CB 3.34Å; A268-Q272 PolarHBondContact O-N 3.34Å |
| 269 | L | 87.9 | Confident | 77.6 | Confident | 41 Ų | 41 | 82.5 Ų | 82.5 | 22% | 0.215 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -60.7 | -42.1 | 174.8 | -71.3 | 174 | 0 | 0 | 0 | 112.2 | P237 I240 Q241 I244 K265 G266 I267 Q272 A273 | P237-L269 HydrophobicContact CB-CD1 3.93Å; I240-L269 HydrophobicContact CG2-CB 4.43Å; Q241-L269 HydrophobicContact CB-CD1 4.22Å; I244-L269 HydrophobicContact CD1-CB 4.36Å; K265-L269 WeakPolarHBondContact O-CG 3.21Å; K265-L269 PolarHBondContact O-N 2.83Å; K265-L269 VanDerWaalsContact O-N 3.09Å; G266-L269 PolarHBondContact O-N 2.9Å; I267-L269 VanDerWaalsContact C-N 3.35Å; I267-L269 PolarHBondContact O-N 3.47Å; L269-Q272 PolarHBondContact O-N 2.9Å; L269-A273 WeakPolarHBondContact O-CB 3.43Å; L269-A273 PolarHBondContact O-N 2.78Å |
| 270 | L | 86.4 | Confident | 79.6 | Confident | 1 Ų | 1 | 82.3 Ų | 82.3 | 1% | 0.005 | 46% | 0.458 | C | S | . | . | H | α-helix | trans | -65.3 | -43.8 | 178.3 | -170.1 | 72.9 | 0 | 0 | 0 | 111.9 | L227 L231 I250 L252 G266 I267 A268 Q272 A273 R274 | L227-L270 HydrophobicContact CD1-CD1 4.25Å; L231-L270 HydrophobicContact CD1-CD2 4.45Å; I250-L270 HydrophobicContact CB-CD1 3.83Å; I250-L270 HydrophobicContact CG2-CD1 3.92Å; L252-L270 HydrophobicContact CD1-CD2 4.41Å; G266-L270 PolarHBondContact O-N 3.34Å; G266-L270 VanDerWaalsContact O-N 3.16Å; I267-L270 PolarHBondContact O-N 3.33Å; A268-L270 VanDerWaalsContact C-N 3.35Å; A268-L270 PolarHBondContact O-N 3.35Å; L270-Q272 VanDerWaalsContact C-N 3.35Å; L270-A273 PolarHBondContact O-N 3.39Å; L270-R274 WeakPolarHBondContact O-CG 3.28Å; L270-R274 PolarHBondContact O-N 2.92Å |
| 271 | L | 85.3 | Confident | 81.8 | Confident | 66 Ų | 66 | 80.2 Ų | 80.2 | 35% | 0.346 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -62.2 | -43.1 | 176.1 | -75.1 | 174.4 | 0 | 0 | 0 | 111.4 | L257 L259 I267 A268 R274 A275 | L257-L271 HydrophobicContact CD1-CD2 3.52Å; L257-L271 HydrophobicContact CD1-CG 4.2Å; L259-L271 HydrophobicContact CD2-CD1 4.35Å; I267-L271 HydrophobicContact CG2-CD1 4.08Å; I267-L271 HydrophobicContact CG2-CG 4.35Å; I267-L271 WeakPolarHBondContact O-CG 2.92Å; I267-L271 PolarHBondContact O-N 3.28Å; A268-L271 PolarHBondContact O-N 2.92Å; L271-R274 PolarHBondContact O-N 3.29Å; L271-A275 WeakPolarHBondContact O-CB 3.39Å; L271-A275 PolarHBondContact O-N 3.12Å |
| 272 | Q | 87.4 | Confident | 83.7 | Confident | 121 Ų | 121 | 77.5 Ų | 77.5 | 57% | 0.565 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -61.5 | -44.7 | 175.8 | -176.2 | 178.8 | 0.6 | 0 | 0 | 111.8 | A268 L269 L270 R274 A275 T276 | A268-Q272 WeakPolarHBondContact O-CB 3.34Å; A268-Q272 PolarHBondContact O-N 3.34Å; L269-Q272 PolarHBondContact O-N 2.9Å; L270-Q272 VanDerWaalsContact C-N 3.35Å; Q272-R274 VanDerWaalsContact C-N 3.27Å; Q272-R274 PolarHBondContact O-N 2.92Å; Q272-A275 PolarHBondContact O-N 3.37Å; Q272-T276 PolarHBondContact O-N 2.79Å; Q272-T276 PolarHBondContact O-OG1 3.2Å |
| 273 | A | 87.3 | Confident | 85.6 | Confident | 21 Ų | 21 | 72.9 Ų | 72.9 | 17% | 0.174 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -65.2 | -29 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113 | I244 I250 L269 L270 T276 | I244-A273 HydrophobicContact CD1-CB 3.99Å; I244-A273 HydrophobicContact CG1-CB 4.43Å; I244-A273 HydrophobicContact CG2-CB 4Å; I250-A273 HydrophobicContact CD1-CB 4.17Å; I250-A273 VanDerWaalsContact CD1-O 3.28Å; I250-A273 WeakPolarHBondContact CD1-O 3.3Å; I250-A273 HydrophobicContact CG2-CB 4.43Å; L269-A273 WeakPolarHBondContact O-CB 3.43Å; L269-A273 PolarHBondContact O-N 2.78Å; L270-A273 PolarHBondContact O-N 3.39Å; A273-T276 VanDerWaalsContact O-O 3.06Å |
| 274 | R | 86.6 | Confident | 87.5 | Confident | 67 Ų | 67 | 67.5 Ų | 67.5 | 25% | 0.253 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -75.4 | -33.7 | 173.4 | -73.3 | 176.4 | 179.3 | -169.6 | 4.5 | 112.8 | I250 Y251 L270 L271 Q272 | I250-R274 HydrophobicContact CB-CG 4.47Å; I250-R274 HydrophobicContact CD1-CG 3.94Å; I250-R274 HydrophobicContact CG1-CG 4.27Å; I250-R274 VanDerWaalsContact O-CZ 3.24Å; I250-R274 PolarHBondContact O-NE 3.11Å; I250-R274 PolarHBondContact O-NH2 3.16Å; Y251-R274 HydrophobicContact CE1-CG 4.43Å; L270-R274 WeakPolarHBondContact O-CG 3.28Å; L270-R274 PolarHBondContact O-N 2.92Å; L271-R274 PolarHBondContact O-N 3.29Å; Q272-R274 VanDerWaalsContact C-N 3.27Å; Q272-R274 PolarHBondContact O-N 2.92Å |
| 275 | A | 86.5 | Confident | 88.4 | Confident | 81 Ų | 81 | 66 Ų | 66 | 67% | 0.669 | 37% | 0.368 | S | S | * | . | H | α-helix | trans | -78.2 | -26 | -179.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | L271 Q272 | L271-A275 WeakPolarHBondContact O-CB 3.39Å; L271-A275 PolarHBondContact O-N 3.12Å; Q272-A275 PolarHBondContact O-N 3.37Å |
| 276 | T | 85.6 | Confident | 89 | Confident | 78 Ų | 78 | 60.5 Ų | 60.5 | 48% | 0.479 | 35% | 0.346 | S | S | . | . | S | Bend | trans | -116.1 | 120 | -175.2 | 55.6 | 0 | 0 | 0 | 0 | 111.3 | Q272 A273 | Q272-T276 PolarHBondContact O-N 2.79Å; Q272-T276 PolarHBondContact O-OG1 3.2Å; A273-T276 VanDerWaalsContact O-O 3.06Å |
| 277 | P | 84.3 | Confident | 89.5 | Confident | 121 Ų | 121 | 65.3 Ų | 65.3 | 79% | 0.786 | 38% | 0.375 | S | S | * | . | P | Polyproline II helix | trans | -64.8 | 145.1 | 176 | 27.3 | -33.3 | 0 | 0 | 0 | 110.4 | S279 | P277-S279 PolarHBondContact O-N 3.4Š|
| 278 | R | 88.3 | Confident | 90 | Very high | 72 Ų | 72 | 66.2 Ų | 66.2 | 27% | 0.272 | 38% | 0.38 | S | S | . | . | P | Polyproline II helix | trans | -57 | 133.7 | 176.4 | -68.3 | 178 | -177.6 | -97.5 | -1.7 | 110.3 | I244 G247 Q283 | I244-R278 PolarHBondContact O-NH1 3.08Å; I244-R278 PolarHBondContact O-NH2 3.08Å; G247-R278 VanDerWaalsContact CA-NH2 3.31Å; R278-Q283 HydrophobicContact CB-CG 3.88Å; R278-Q283 PolarHBondContact O-NE2 3.15Å |
| 279 | S | 92.6 | Very high | 90.3 | Very high | 69 Ų | 69 | 64.5 Ų | 64.5 | 48% | 0.483 | 36% | 0.362 | S | S | . | . | P | Polyproline II helix | trans | -60.4 | 153.4 | 173.8 | 71 | 0 | 0 | 0 | 0 | 111.4 | P277 L281 S282 Q283 | P277-S279 PolarHBondContact O-N 3.4Å; S279-L281 PolarHBondContact O-N 2.82Å; S279-S282 WeakPolarHBondContact O-CB 3.38Å; S279-S282 PolarHBondContact O-N 3.33Å; S279-S282 WeakPolarHBondContact OG-CB 3.28Å; S279-S282 PolarHBondContact OG-N 3.13Å; S279-S282 VanDerWaalsContact OG-N 3.16Å; S279-Q283 WeakPolarHBondContact O-CG 3.27Å; S279-Q283 PolarHBondContact O-N 3.34Å |
| 280 | L | 94.7 | Very high | 90.4 | Very high | 143 Ų | 143 | 71 Ų | 71 | 75% | 0.749 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -55.3 | -38 | 175.9 | -177 | 64.5 | 0 | 0 | 0 | 111.7 | Q283 A284 | L280-Q283 PolarHBondContact O-N 3.3Å; L280-A284 WeakPolarHBondContact O-CB 3.4Å; L280-A284 PolarHBondContact O-N 3.39Å |
| 281 | L | 94.2 | Very high | 90.6 | Very high | 90 Ų | 90 | 73.4 Ų | 73.4 | 47% | 0.471 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -64.6 | -42.1 | 177.6 | -172.9 | 66 | 0 | 0 | 0 | 112.1 | S279 A284 R285 L310 Y313 | S279-L281 PolarHBondContact O-N 2.82Å; L281-A284 PolarHBondContact O-N 3.23Å; L281-R285 PolarHBondContact O-N 2.93Å; L281-L310 HydrophobicContact CD1-CD2 4.41Å; L281-Y313 HydrophobicContact CD1-CD1 4.39Å; L281-Y313 HydrophobicContact CD1-CE1 4.06Å; L281-Y313 HydrophobicContact CD2-CD1 4.47Å; L281-Y313 HydrophobicContact CD2-CE1 4.01Å; L281-Y313 HydrophobicContact CD2-CE2 4.29Å; L281-Y313 HydrophobicContact CG-CD1 4.24Å; L281-Y313 HydrophobicContact CG-CE1 3.54Å |
| 282 | S | 92.8 | Very high | 90.9 | Very high | 13 Ų | 13 | 71.6 Ų | 71.6 | 9% | 0.091 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -64.5 | -43.7 | 175.2 | 179.2 | 0 | 0 | 0 | 0 | 111.5 | S279 R285 L286 Y313 | S279-S282 WeakPolarHBondContact O-CB 3.38Å; S279-S282 PolarHBondContact O-N 3.33Å; S279-S282 WeakPolarHBondContact OG-CB 3.28Å; S279-S282 PolarHBondContact OG-N 3.13Å; S279-S282 VanDerWaalsContact OG-N 3.16Å; S282-R285 WeakPolarHBondContact O-CB 3.26Å; S282-R285 PolarHBondContact O-N 3.04Å; S282-L286 WeakPolarHBondContact O-CG 3.3Å; S282-L286 PolarHBondContact O-N 3.42Å; S282-L286 VanDerWaalsContact O-N 3.13Å; S282-Y313 WeakPolarHBondContact CA-OH 3.49Å; S282-Y313 PolarHBondContact N-OH 3.29Å |
| 283 | Q | 93.1 | Very high | 90.7 | Very high | 95 Ų | 95 | 67.7 Ų | 67.7 | 44% | 0.444 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -62.2 | -44 | 175.8 | -65.6 | -177.6 | 24.7 | 0 | 0 | 111.6 | R278 S279 L280 R285 L286 V287 | R278-Q283 HydrophobicContact CB-CG 3.88Å; R278-Q283 PolarHBondContact O-NE2 3.15Å; S279-Q283 WeakPolarHBondContact O-CG 3.27Å; S279-Q283 PolarHBondContact O-N 3.34Å; L280-Q283 PolarHBondContact O-N 3.3Å; Q283-R285 VanDerWaalsContact C-N 3.35Å; Q283-R285 PolarHBondContact O-N 3.19Å; Q283-L286 PolarHBondContact O-N 2.99Å; Q283-V287 WeakPolarHBondContact O-CG2 3.17Å; Q283-V287 PolarHBondContact O-N 2.71Å |
| 284 | A | 95 | Very high | 90.5 | Very high | 40 Ų | 40 | 73.5 Ų | 73.5 | 33% | 0.331 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -59.4 | -43.8 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | L280 L281 L286 V287 I288 | L280-A284 WeakPolarHBondContact O-CB 3.4Å; L280-A284 PolarHBondContact O-N 3.39Å; L281-A284 PolarHBondContact O-N 3.23Å; A284-L286 PolarHBondContact O-N 3.28Å; A284-V287 PolarHBondContact O-N 2.79Å; A284-I288 WeakPolarHBondContact O-CB 3.47Å; A284-I288 WeakPolarHBondContact O-CD1 3.45Å; A284-I288 VanDerWaalsContact O-CG1 3.26Å; A284-I288 WeakPolarHBondContact O-CG1 3.41Å; A284-I288 PolarHBondContact O-N 3.21Å |
| 285 | R | 95.1 | Very high | 90.4 | Very high | 14 Ų | 14 | 73.5 Ų | 73.5 | 5% | 0.053 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -55.7 | -48.3 | 174.6 | 174.6 | 178.1 | 71.2 | -178 | 4.8 | 111.9 | D245 L281 S282 Q283 V287 I288 R289 Y313 L314 H316 | D245-R285 PolarHBondContact O-NH2 3.13Å; D245-R285 IonicContact OD1-CZ 3.46Å; D245-R285 IonicContact OD1-NH1 3.47Å; D245-R285 IonicContact OD1-NH2 2.8Å; D245-R285 PolarHBondContact OD1-NH2 3.3Å; L281-R285 PolarHBondContact O-N 2.93Å; S282-R285 WeakPolarHBondContact O-CB 3.26Å; S282-R285 PolarHBondContact O-N 3.04Å; Q283-R285 VanDerWaalsContact C-N 3.35Å; Q283-R285 PolarHBondContact O-N 3.19Å; R285-V287 PolarHBondContact O-N 3.49Å; R285-I288 PolarHBondContact O-N 3Å; R285-R289 HydrophobicContact CG-CG 4.42Å; R285-R289 WeakPolarHBondContact O-CB 3.5Å; R285-R289 VanDerWaalsContact O-CG 3.24Å; R285-R289 WeakPolarHBondContact O-CG 3.26Å; R285-R289 PolarHBondContact O-N 2.99Å; R285-Y313 HydrophobicContact CB-CD1 4.37Å; R285-Y313 HydrophobicContact CB-CE1 3.69Å; R285-Y313 WeakPolarHBondContact CD-O 3.36Å; R285-Y313 HydrophobicContact CG-CE1 4.21Å; R285-L314 HydrophobicContact CB-CD2 3.95Å; R285-L314 HydrophobicContact CG-CD2 3.94Å; R285-H316 PolarHBondContact NH1-CE1 3.03Å |
| 286 | L | 93.3 | Very high | 90.1 | Very high | 40 Ų | 40 | 72.5 Ų | 72.5 | 21% | 0.209 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -61.6 | -45 | 179.6 | -65.7 | 179 | 0 | 0 | 0 | 112.2 | F246 S282 Q283 A284 R290 | F246-L286 WeakPolarHBondContact O-CD2 3.27Å; S282-L286 WeakPolarHBondContact O-CG 3.3Å; S282-L286 PolarHBondContact O-N 3.42Å; S282-L286 VanDerWaalsContact O-N 3.13Å; Q283-L286 PolarHBondContact O-N 2.99Å; A284-L286 PolarHBondContact O-N 3.28Å; L286-R290 VanDerWaalsContact O-CB 3.24Å; L286-R290 WeakPolarHBondContact O-CB 3.44Å; L286-R290 PolarHBondContact O-N 2.9Å |
| 287 | V | 94.2 | Very high | 89.9 | Confident | 101 Ų | 101 | 74.3 Ų | 74.3 | 61% | 0.612 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -63.3 | -48 | -179.6 | 173 | 0 | 0 | 0 | 0 | 111 | Q283 A284 R285 R290 A291 | Q283-V287 WeakPolarHBondContact O-CG2 3.17Å; Q283-V287 PolarHBondContact O-N 2.71Å; A284-V287 PolarHBondContact O-N 2.79Å; R285-V287 PolarHBondContact O-N 3.49Å; V287-R290 PolarHBondContact O-N 3.04Å; V287-A291 PolarHBondContact O-N 3.04Å |
| 288 | I | 93.9 | Very high | 89.6 | Confident | 63 Ų | 63 | 70.1 Ų | 70.1 | 32% | 0.323 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -61.2 | -49.2 | 179.4 | -67.1 | 164.1 | 0 | 0 | 0 | 110.3 | A284 R285 R290 A291 L292 L304 L314 | A284-I288 WeakPolarHBondContact O-CB 3.47Å; A284-I288 WeakPolarHBondContact O-CD1 3.45Å; A284-I288 VanDerWaalsContact O-CG1 3.26Å; A284-I288 WeakPolarHBondContact O-CG1 3.41Å; A284-I288 PolarHBondContact O-N 3.21Å; R285-I288 PolarHBondContact O-N 3Å; I288-R290 PolarHBondContact O-N 3.38Å; I288-A291 PolarHBondContact O-N 3.24Å; I288-L292 HydrophobicContact CG2-CD1 4.02Å; I288-L292 WeakPolarHBondContact O-CG 3.2Å; I288-L292 PolarHBondContact O-N 3.02Å; I288-L292 VanDerWaalsContact O-N 3.08Å; I288-L304 HydrophobicContact CG2-CD1 4.14Å; I288-L314 HydrophobicContact CB-CD2 4.24Å; I288-L314 HydrophobicContact CD1-CD1 4.49Å; I288-L314 HydrophobicContact CD1-CD2 4.09Å; I288-L314 HydrophobicContact CG2-CD1 3.97Å; I288-L314 HydrophobicContact CG2-CD2 4.23Å |
| 289 | R | 92.5 | Very high | 89.3 | Confident | 17 Ų | 17 | 71.6 Ų | 71.6 | 6% | 0.064 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -61.7 | -43.9 | 179.7 | -71.1 | -175.3 | 65.6 | 65.8 | 19.5 | 111.9 | L202 R285 A291 L292 C293 I301 L314 | L202-R289 VanDerWaalsContact C-NH2 3.3Å; L202-R289 VanDerWaalsContact CA-NH2 3.31Å; L202-R289 PolarHBondContact O-NH2 3.41Å; R285-R289 HydrophobicContact CG-CG 4.42Å; R285-R289 WeakPolarHBondContact O-CB 3.5Å; R285-R289 VanDerWaalsContact O-CG 3.24Å; R285-R289 WeakPolarHBondContact O-CG 3.26Å; R285-R289 PolarHBondContact O-N 2.99Å; R289-A291 VanDerWaalsContact C-N 3.32Å; R289-A291 PolarHBondContact O-N 3.34Å; R289-L292 PolarHBondContact O-N 2.88Å; R289-C293 PolarHBondContact O-N 3.06Å; R289-C293 PolarHBondContact O-SG 2.93Å; R289-I301 HydrophobicContact CG-CD1 4.28Å; R289-I301 VanDerWaalsContact NH1-CD1 3.26Å; R289-L314 WeakPolarHBondContact CD-O 3.3Å; R289-L314 PolarHBondContact NH1-O 2.73Å |
| 290 | R | 89.8 | Confident | 89 | Confident | 178 Ų | 178 | 68.9 Ų | 68.9 | 67% | 0.672 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -59.3 | -43.7 | 177.4 | -175.6 | 177.3 | -176.9 | 164.7 | 4.9 | 111.7 | L286 V287 I288 C293 Q294 | L286-R290 VanDerWaalsContact O-CB 3.24Å; L286-R290 WeakPolarHBondContact O-CB 3.44Å; L286-R290 PolarHBondContact O-N 2.9Å; V287-R290 PolarHBondContact O-N 3.04Å; I288-R290 PolarHBondContact O-N 3.38Å; R290-C293 PolarHBondContact O-N 3.41Å; R290-Q294 WeakPolarHBondContact O-CB 3.47Å; R290-Q294 VanDerWaalsContact O-CG 3.27Å; R290-Q294 WeakPolarHBondContact O-CG 3.44Å; R290-Q294 PolarHBondContact O-N 3.37Å |
| 291 | A | 91 | Very high | 88.9 | Confident | 52 Ų | 52 | 62.4 Ų | 62.4 | 43% | 0.43 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -61.8 | -43.4 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | V287 I288 R289 Q294 A295 | V287-A291 PolarHBondContact O-N 3.04Å; I288-A291 PolarHBondContact O-N 3.24Å; R289-A291 VanDerWaalsContact C-N 3.32Å; R289-A291 PolarHBondContact O-N 3.34Å; A291-Q294 PolarHBondContact O-N 3.16Å; A291-A295 PolarHBondContact O-N 3.35Å |
| 292 | L | 90 | Very high | 88.6 | Confident | 27 Ų | 27 | 62 Ų | 62 | 14% | 0.141 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -68.1 | -38.8 | 178.9 | -66.7 | 173 | 0 | 0 | 0 | 112.8 | I288 R289 A295 G296 Q297 A300 I301 L304 | I288-L292 HydrophobicContact CG2-CD1 4.02Å; I288-L292 WeakPolarHBondContact O-CG 3.2Å; I288-L292 PolarHBondContact O-N 3.02Å; I288-L292 VanDerWaalsContact O-N 3.08Å; R289-L292 PolarHBondContact O-N 2.88Å; L292-A295 PolarHBondContact O-N 2.81Å; L292-G296 PolarHBondContact O-N 3.39Å; L292-Q297 CarbonylContact O-C 3.52Å; L292-Q297 PolarHBondContact O-N 3.43Å; L292-A300 HydrophobicContact CD2-CB 4.3Å; L292-I301 HydrophobicContact CD1-CB 4.35Å; L292-I301 HydrophobicContact CD1-CD1 4.17Å; L292-I301 HydrophobicContact CD1-CG1 3.25Å; L292-L304 HydrophobicContact CD1-CD1 4.37Å |
| 293 | C | 84.2 | Confident | 88.6 | Confident | 40 Ų | 40 | 69 Ų | 69 | 27% | 0.27 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -65.9 | -40.8 | 173.7 | -66.9 | 0 | 0 | 0 | 0 | 111.9 | R289 R290 A295 G296 | R289-C293 PolarHBondContact O-N 3.06Å; R289-C293 PolarHBondContact O-SG 2.93Å; R290-C293 PolarHBondContact O-N 3.41Å; C293-A295 VanDerWaalsContact C-N 3.25Å; C293-A295 PolarHBondContact O-N 2.94Å; C293-G296 PolarHBondContact O-N 3.2Å |
| 294 | Q | 83.3 | Confident | 88.6 | Confident | 142 Ų | 142 | 67.1 Ų | 67.1 | 66% | 0.664 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -64 | -31.2 | 175.8 | -76 | 174.9 | -14.2 | 0 | 0 | 112.7 | R290 A291 G296 | R290-Q294 WeakPolarHBondContact O-CB 3.47Å; R290-Q294 VanDerWaalsContact O-CG 3.27Å; R290-Q294 WeakPolarHBondContact O-CG 3.44Å; R290-Q294 PolarHBondContact O-N 3.37Å; A291-Q294 PolarHBondContact O-N 3.16Å; Q294-G296 PolarHBondContact O-N 3.41Å |
| 295 | A | 84.8 | Confident | 88.6 | Confident | 67 Ų | 67 | 73.4 Ų | 73.4 | 55% | 0.554 | 40% | 0.399 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.1 | -1.9 | 173.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | A291 L292 C293 Q297 | A291-A295 PolarHBondContact O-N 3.35Å; L292-A295 PolarHBondContact O-N 2.81Å; C293-A295 VanDerWaalsContact C-N 3.25Å; C293-A295 PolarHBondContact O-N 2.94Å; A295-Q297 PolarHBondContact O-N 3.43Å |
| 296 | G | 79.4 | Confident | 88.6 | Confident | 60 Ų | 60 | 75.6 Ų | 75.6 | 62% | 0.619 | 41% | 0.411 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 68.9 | 16.6 | -176.3 | 0 | 0 | 0 | 0 | 0 | 114 | L292 C293 Q294 P298 | L292-G296 PolarHBondContact O-N 3.39Å; C293-G296 PolarHBondContact O-N 3.2Å; Q294-G296 PolarHBondContact O-N 3.41Å; G296-P298 VanDerWaalsContact C-CD 3.42Å; G296-P298 WeakPolarHBondContact O-CD 3.33Å |
| 297 | Q | 81.4 | Confident | 88.7 | Confident | 117 Ų | 117 | 77.4 Ų | 77.4 | 55% | 0.547 | 43% | 0.425 | S | S | . | . | trans | -127.6 | 60.4 | -175.5 | -64.8 | -172.2 | -11.5 | 0 | 0 | 112.1 | L292 A295 Q299 A300 | L292-Q297 CarbonylContact O-C 3.52Å; L292-Q297 PolarHBondContact O-N 3.43Å; A295-Q297 PolarHBondContact O-N 3.43Å; Q297-Q299 PolarHBondContact O-N 3.31Å; Q297-A300 HydrophobicContact CB-CB 3.91Å; Q297-A300 WeakPolarHBondContact O-CB 3.41Å; Q297-A300 PolarHBondContact O-N 3.05Å | ||
| 298 | P | 79.1 | Confident | 88.7 | Confident | 32 Ų | 32 | 76.9 Ų | 76.9 | 21% | 0.208 | 42% | 0.424 | C | S | . | . | G | 310 helix | trans | -61.2 | -27.6 | 177.7 | 26.4 | -34.2 | 0 | 0 | 0 | 112.5 | G296 A300 | G296-P298 VanDerWaalsContact C-CD 3.42Å; G296-P298 WeakPolarHBondContact O-CD 3.33Å; P298-A300 VanDerWaalsContact C-N 3.28Å; P298-A300 PolarHBondContact O-N 3.13Å |
| 299 | Q | 80.8 | Confident | 88.7 | Confident | 104 Ų | 104 | 80.5 Ų | 80.5 | 49% | 0.486 | 44% | 0.441 | S | S | . | . | G | 310 helix | trans | -71.1 | -18.8 | 177.5 | -63.8 | -73 | -3.7 | 0 | 0 | 113.5 | Q297 I301 N302 | Q297-Q299 PolarHBondContact O-N 3.31Å; Q299-I301 PolarHBondContact O-N 2.87Å; Q299-I301 VanDerWaalsContact O-N 3.12Å; Q299-N302 PolarHBondContact O-N 3.28Å; Q299-N302 PolarHBondContact O-ND2 3.2Å |
| 300 | A | 87.6 | Confident | 88.8 | Confident | 12 Ų | 12 | 83 Ų | 83 | 10% | 0.099 | 46% | 0.456 | C | S | . | . | G | 310 helix | trans | -69.5 | -6.6 | -178.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | L292 Q297 P298 N302 Q303 | L292-A300 HydrophobicContact CD2-CB 4.3Å; Q297-A300 HydrophobicContact CB-CB 3.91Å; Q297-A300 WeakPolarHBondContact O-CB 3.41Å; Q297-A300 PolarHBondContact O-N 3.05Å; P298-A300 VanDerWaalsContact C-N 3.28Å; P298-A300 PolarHBondContact O-N 3.13Å; A300-N302 PolarHBondContact O-N 2.88Å; A300-N302 VanDerWaalsContact O-N 3.1Å; A300-Q303 WeakPolarHBondContact O-CB 3.35Å; A300-Q303 PolarHBondContact O-N 2.53Å |
| 301 | I | 90.8 | Very high | 88.9 | Confident | 6 Ų | 6 | 75.8 Ų | 75.8 | 3% | 0.031 | 43% | 0.43 | C | S | . | . | G | 310 helix | trans | -49.2 | -36.3 | 168.6 | -75.6 | 179.4 | 0 | 0 | 0 | 111.7 | R289 L292 Q299 Q303 L304 I311 L314 K315 | R289-I301 HydrophobicContact CG-CD1 4.28Å; R289-I301 VanDerWaalsContact NH1-CD1 3.26Å; L292-I301 HydrophobicContact CD1-CB 4.35Å; L292-I301 HydrophobicContact CD1-CD1 4.17Å; L292-I301 HydrophobicContact CD1-CG1 3.25Å; Q299-I301 PolarHBondContact O-N 2.87Å; Q299-I301 VanDerWaalsContact O-N 3.12Å; I301-Q303 PolarHBondContact O-N 3.29Å; I301-L304 PolarHBondContact O-N 2.94Å; I301-I311 HydrophobicContact CG2-CG2 3.96Å; I301-L314 HydrophobicContact CD1-CB 4.35Å; I301-L314 HydrophobicContact CG2-CB 4.15Å; I301-K315 HydrophobicContact CG2-CG 3.85Å |
| 302 | N | 89.6 | Confident | 89 | Confident | 83 Ų | 83 | 74.8 Ų | 74.8 | 44% | 0.444 | 42% | 0.42 | S | S | . | . | G | 310 helix | trans | -66.6 | -18.8 | 179.4 | -67.9 | -52.3 | 0 | 0 | 0 | 114.4 | Q299 A300 K315 | Q299-N302 PolarHBondContact O-N 3.28Å; Q299-N302 PolarHBondContact O-ND2 3.2Å; A300-N302 PolarHBondContact O-N 2.88Å; A300-N302 VanDerWaalsContact O-N 3.1Å; N302-K315 WeakPolarHBondContact OD1-CE 3.39Å; N302-K315 PolarHBondContact OD1-NZ 3.22Å |
| 303 | Q | 92.1 | Very high | 89.2 | Confident | 160 Ų | 160 | 75.8 Ų | 75.8 | 75% | 0.748 | 42% | 0.422 | S | S | * | . | G | 310 helix | trans | -102.8 | -0.7 | -172.6 | -58.2 | 174.7 | 2.7 | 0 | 0 | 112 | A300 I301 | A300-Q303 WeakPolarHBondContact O-CB 3.35Å; A300-Q303 PolarHBondContact O-N 2.53Å; I301-Q303 PolarHBondContact O-N 3.29Å |
| 304 | L | 92.6 | Very high | 89.6 | Confident | 54 Ų | 54 | 74.2 Ų | 74.2 | 28% | 0.283 | 41% | 0.411 | S | S | . | . | S | Bend | trans | -68.1 | 132.3 | 177.1 | -63.4 | 177.3 | 0 | 0 | 0 | 110.1 | I288 L292 I301 I306 L314 | I288-L304 HydrophobicContact CG2-CD1 4.14Å; L292-L304 HydrophobicContact CD1-CD1 4.37Å; I301-L304 PolarHBondContact O-N 2.94Å; L304-I306 HydrophobicContact CB-CD1 3.97Å; L304-I306 HydrophobicContact CB-CG1 3.87Å; L304-I306 HydrophobicContact CD1-CD1 4Å; L304-I306 PolarHBondContact O-N 3.37Å; L304-L314 HydrophobicContact CD1-CD1 3.71Å |
| 305 | D | 95.4 | Very high | 90 | Very high | 172 Ų | 172 | 69.8 Ų | 69.8 | 92% | 0.92 | 39% | 0.39 | S | S | * | . | S | Bend | trans | -77.6 | 69.9 | 175.6 | -169.4 | 19.5 | 0 | 0 | 0 | 110.9 | ||
| 306 | I | 94.9 | Very high | 90.2 | Very high | 61 Ų | 61 | 68.3 Ų | 68.3 | 31% | 0.313 | 37% | 0.371 | S | S | . | . | S | Bend | trans | -140.4 | 158.6 | -179.1 | 63.2 | 178.3 | 0 | 0 | 0 | 110.5 | L304 L310 I311 L314 | L304-I306 HydrophobicContact CB-CD1 3.97Å; L304-I306 HydrophobicContact CB-CG1 3.87Å; L304-I306 HydrophobicContact CD1-CD1 4Å; L304-I306 PolarHBondContact O-N 3.37Å; I306-L310 HydrophobicContact CD1-CB 3.94Å; I306-L310 HydrophobicContact CG1-CB 4.37Å; I306-I311 HydrophobicContact CD1-CG1 4.01Å; I306-I311 HydrophobicContact CG1-CD1 4.33Å; I306-I311 HydrophobicContact CG1-CG1 3.65Å; I306-L314 HydrophobicContact CD1-CD1 3.68Å |
| 307 | P | 96.1 | Very high | 90.4 | Very high | 78 Ų | 78 | 70.6 Ų | 70.6 | 51% | 0.506 | 37% | 0.366 | S | S | . | . | trans | -53.1 | 143.7 | 176.9 | -28.8 | 34.6 | 0 | 0 | 0 | 113.7 | M309 L310 I311 | P307-M309 PolarHBondContact O-N 3.09Å; P307-M309 VanDerWaalsContact O-N 3.14Å; P307-L310 HydrophobicContact CG-CD1 4.49Å; P307-L310 WeakPolarHBondContact O-CB 3.33Å; P307-L310 PolarHBondContact O-N 2.93Å; P307-I311 PolarHBondContact O-N 3.46Å | ||
| 308 | P | 93.8 | Very high | 89.2 | Confident | 90 Ų | 90 | 76 Ų | 76 | 58% | 0.584 | 40% | 0.397 | S | S | * | . | H | α-helix | trans | -60.6 | -30.9 | -175 | 23.7 | -34.3 | 0 | 0 | 0 | 113 | L310 I311 S312 | P308-L310 VanDerWaalsContact C-N 3.3Å; P308-L310 PolarHBondContact O-N 3.2Å; P308-I311 WeakPolarHBondContact O-CB 3.22Å; P308-I311 PolarHBondContact O-N 3.16Å; P308-I311 VanDerWaalsContact O-N 3.17Å; P308-S312 PolarHBondContact O-N 3.45Å; P308-S312 PolarHBondContact O-OG 3.39Å |
| 309 | M | 93.4 | Very high | 89.7 | Confident | 139 Ų | 139 | 78.2 Ų | 78.2 | 69% | 0.685 | 41% | 0.406 | S | S | * | . | H | α-helix | trans | -62.6 | -35.9 | 174.1 | -64.1 | -68 | 89.7 | 0 | 0 | 112.7 | P307 Y313 | P307-M309 PolarHBondContact O-N 3.09Å; P307-M309 VanDerWaalsContact O-N 3.14Å; M309-Y313 WeakPolarHBondContact O-CB 3.12Å; M309-Y313 PolarHBondContact O-N 3.23Å |
| 310 | L | 94.1 | Very high | 90.2 | Very high | 70 Ų | 70 | 76.8 Ų | 76.8 | 37% | 0.366 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -73 | -35.1 | 174.3 | -63.6 | -175.3 | 0 | 0 | 0 | 111.1 | L281 I306 P307 P308 Y313 L314 | L281-L310 HydrophobicContact CD1-CD2 4.41Å; I306-L310 HydrophobicContact CD1-CB 3.94Å; I306-L310 HydrophobicContact CG1-CB 4.37Å; P307-L310 HydrophobicContact CG-CD1 4.49Å; P307-L310 WeakPolarHBondContact O-CB 3.33Å; P307-L310 PolarHBondContact O-N 2.93Å; P308-L310 VanDerWaalsContact C-N 3.3Å; P308-L310 PolarHBondContact O-N 3.2Å; L310-Y313 PolarHBondContact O-N 3.15Å; L310-L314 WeakPolarHBondContact O-CB 3.32Å; L310-L314 VanDerWaalsContact O-CG 3.25Å; L310-L314 WeakPolarHBondContact O-CG 3.36Å; L310-L314 PolarHBondContact O-N 3.42Å |
| 311 | I | 93.6 | Very high | 90.4 | Very high | 25 Ų | 25 | 80.4 Ų | 80.4 | 13% | 0.128 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -60.1 | -49.4 | 172.3 | -59.8 | -178.7 | 0 | 0 | 0 | 110.3 | I301 I306 P307 P308 Y313 L314 K315 | I301-I311 HydrophobicContact CG2-CG2 3.96Å; I306-I311 HydrophobicContact CD1-CG1 4.01Å; I306-I311 HydrophobicContact CG1-CD1 4.33Å; I306-I311 HydrophobicContact CG1-CG1 3.65Å; P307-I311 PolarHBondContact O-N 3.46Å; P308-I311 WeakPolarHBondContact O-CB 3.22Å; P308-I311 PolarHBondContact O-N 3.16Å; P308-I311 VanDerWaalsContact O-N 3.17Å; I311-Y313 VanDerWaalsContact C-N 3.33Å; I311-Y313 PolarHBondContact O-N 3.25Å; I311-L314 PolarHBondContact O-N 3.14Å; I311-K315 HydrophobicContact CG2-CD 4.31Å; I311-K315 WeakPolarHBondContact O-CG 3.34Å; I311-K315 PolarHBondContact O-N 3.09Å |
| 312 | S | 93.1 | Very high | 90.3 | Very high | 32 Ų | 32 | 84.8 Ų | 84.8 | 22% | 0.224 | 44% | 0.442 | C | S | . | . | H | α-helix | trans | -59 | -44.6 | 176.7 | -59.1 | 0 | 0 | 0 | 0 | 111.4 | P308 L314 K315 H316 Q317 | P308-S312 PolarHBondContact O-N 3.45Å; P308-S312 PolarHBondContact O-OG 3.39Å; S312-L314 PolarHBondContact O-N 3.14Å; S312-K315 CarbonylContact O-C 3.59Å; S312-K315 WeakPolarHBondContact O-CA 3.39Å; S312-K315 WeakPolarHBondContact O-CB 3.38Å; S312-K315 PolarHBondContact O-N 2.96Å; S312-H316 PolarHBondContact O-N 3.48Å; S312-Q317 CarbonylContact C-O 3.48Å; S312-Q317 VanDerWaalsContact CB-O 3.27Å; S312-Q317 WeakPolarHBondContact CB-O 3.28Å; S312-Q317 PolarHBondContact O-N 3.33Å; S312-Q317 VanDerWaalsContact O-O 3.05Å |
| 313 | Y | 93.7 | Very high | 90.4 | Very high | 47 Ų | 47 | 84.9 Ų | 84.9 | 18% | 0.184 | 44% | 0.442 | C | S | . | . | H | α-helix | trans | -58.8 | -43.9 | 175 | 179.3 | -104.2 | 0 | 0 | 0 | 113.1 | L281 S282 R285 M309 L310 I311 K315 H316 | L281-Y313 HydrophobicContact CD1-CD1 4.39Å; L281-Y313 HydrophobicContact CD1-CE1 4.06Å; L281-Y313 HydrophobicContact CD2-CD1 4.47Å; L281-Y313 HydrophobicContact CD2-CE1 4.01Å; L281-Y313 HydrophobicContact CD2-CE2 4.29Å; L281-Y313 HydrophobicContact CG-CD1 4.24Å; L281-Y313 HydrophobicContact CG-CE1 3.54Å; S282-Y313 WeakPolarHBondContact CA-OH 3.49Å; S282-Y313 PolarHBondContact N-OH 3.29Å; R285-Y313 HydrophobicContact CB-CD1 4.37Å; R285-Y313 HydrophobicContact CB-CE1 3.69Å; R285-Y313 WeakPolarHBondContact CD-O 3.36Å; R285-Y313 HydrophobicContact CG-CE1 4.21Å; M309-Y313 WeakPolarHBondContact O-CB 3.12Å; M309-Y313 PolarHBondContact O-N 3.23Å; L310-Y313 PolarHBondContact O-N 3.15Å; I311-Y313 VanDerWaalsContact C-N 3.33Å; I311-Y313 PolarHBondContact O-N 3.25Å; Y313-K315 PolarHBondContact O-N 2.89Å; Y313-H316 PolarHBondContact O-N 3.37Å; Y313-H316 VanDerWaalsContact O-N 3.13Å |
| 314 | L | 92.8 | Very high | 90.3 | Very high | 7 Ų | 7 | 79.9 Ų | 79.9 | 4% | 0.037 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -64.5 | -26.4 | 175.9 | -70.4 | 178.6 | 0 | 0 | 0 | 112.7 | R285 I288 R289 I301 L304 I306 L310 I311 S312 | R285-L314 HydrophobicContact CB-CD2 3.95Å; R285-L314 HydrophobicContact CG-CD2 3.94Å; I288-L314 HydrophobicContact CB-CD2 4.24Å; I288-L314 HydrophobicContact CD1-CD1 4.49Å; I288-L314 HydrophobicContact CD1-CD2 4.09Å; I288-L314 HydrophobicContact CG2-CD1 3.97Å; I288-L314 HydrophobicContact CG2-CD2 4.23Å; R289-L314 WeakPolarHBondContact CD-O 3.3Å; R289-L314 PolarHBondContact NH1-O 2.73Å; I301-L314 HydrophobicContact CD1-CB 4.35Å; I301-L314 HydrophobicContact CG2-CB 4.15Å; L304-L314 HydrophobicContact CD1-CD1 3.71Å; I306-L314 HydrophobicContact CD1-CD1 3.68Å; L310-L314 WeakPolarHBondContact O-CB 3.32Å; L310-L314 VanDerWaalsContact O-CG 3.25Å; L310-L314 WeakPolarHBondContact O-CG 3.36Å; L310-L314 PolarHBondContact O-N 3.42Å; I311-L314 PolarHBondContact O-N 3.14Å; S312-L314 PolarHBondContact O-N 3.14Å |
| 315 | K | 90.4 | Very high | 90.1 | Very high | 50 Ų | 50 | 81.7 Ų | 81.7 | 22% | 0.217 | 43% | 0.431 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -87.8 | 0.8 | 175.5 | -67.3 | 175.7 | -179.5 | 174.2 | 0 | 114.1 | L202 I301 N302 I311 S312 Y313 Q317 | L202-K315 VanDerWaalsContact CD2-O 3.28Å; L202-K315 WeakPolarHBondContact CD2-O 3.44Å; I301-K315 HydrophobicContact CG2-CG 3.85Å; N302-K315 WeakPolarHBondContact OD1-CE 3.39Å; N302-K315 PolarHBondContact OD1-NZ 3.22Å; I311-K315 HydrophobicContact CG2-CD 4.31Å; I311-K315 WeakPolarHBondContact O-CG 3.34Å; I311-K315 PolarHBondContact O-N 3.09Å; S312-K315 CarbonylContact O-C 3.59Å; S312-K315 WeakPolarHBondContact O-CA 3.39Å; S312-K315 WeakPolarHBondContact O-CB 3.38Å; S312-K315 PolarHBondContact O-N 2.96Å; Y313-K315 PolarHBondContact O-N 2.89Å; K315-Q317 HydrophobicContact CB-CB 4.35Å; K315-Q317 HydrophobicContact CB-CG 3.9Å; K315-Q317 VanDerWaalsContact CD-OE1 3.28Å; K315-Q317 PolarHBondContact O-N 3.03Å |
| 316 | H | 89.2 | Confident | 89.7 | Confident | 36 Ų | 36 | 74.8 Ų | 74.8 | 17% | 0.167 | 39% | 0.394 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 56.1 | 33.7 | -170.4 | -61.2 | -113.1 | 0 | 0 | 0 | 112.4 | F246 R285 S312 Y313 | F246-H316 AromaticContact CD2-CE1 3.68Å; F246-H316 AromaticContact CE1-NE2 3.74Å; F246-H316 AromaticContact CE2-CD2 3.84Å; F246-H316 AromaticContact CE2-CE1 3.44Å; F246-H316 VanDerWaalsContact CE2-CE1 3.44Å; F246-H316 WeakPolarHBondContact CE2-CE1 3.4Å; F246-H316 AromaticContact CE2-CG 3.8Å; F246-H316 AromaticContact CE2-ND1 3.56Å; F246-H316 AromaticContact CE2-NE2 3.66Å; F246-H316 AromaticContact CZ-CD2 3.46Å; F246-H316 VanDerWaalsContact CZ-CD2 3.46Å; F246-H316 WeakPolarHBondContact CZ-CD2 3.49Å; F246-H316 AromaticContact CZ-CE1 3.77Å; F246-H316 AromaticContact CZ-CG 3.82Å; F246-H316 AromaticContact CZ-NE2 3.48Å; F246-H316 WeakPolarHBondContact CZ-NE2 3.47Å; R285-H316 PolarHBondContact NH1-CE1 3.03Å; S312-H316 PolarHBondContact O-N 3.48Å; Y313-H316 PolarHBondContact O-N 3.37Å; Y313-H316 VanDerWaalsContact O-N 3.13Å |
| 317 | Q | 84.9 | Confident | 89.3 | Confident | 107 Ų | 107 | 75.9 Ų | 75.9 | 50% | 0.5 | 40% | 0.4 | S | S | . | . | trans | -104 | 110.4 | 171.4 | -65.9 | 174.6 | -18.5 | 0 | 0 | 106.5 | S312 K315 | S312-Q317 CarbonylContact C-O 3.48Å; S312-Q317 VanDerWaalsContact CB-O 3.27Å; S312-Q317 WeakPolarHBondContact CB-O 3.28Å; S312-Q317 PolarHBondContact O-N 3.33Å; S312-Q317 VanDerWaalsContact O-O 3.05Å; K315-Q317 HydrophobicContact CB-CB 4.35Å; K315-Q317 HydrophobicContact CB-CG 3.9Å; K315-Q317 VanDerWaalsContact CD-OE1 3.28Å; K315-Q317 PolarHBondContact O-N 3.03Å | ||
| 318 | L | 56.1 | Low | 88.6 | Confident | 230 Ų | 230 | 75.7 Ų | 75.7 | 100% | 1.204 | 39% | 0.391 | S | S | * | . | trans | -101.2 | 0 | 172.6 | -75.3 | 169.2 | 0 | 0 | 0 | 109.3 |
Retrieved 318 of 318 residues in 335.8 ms
(Link to these results)