| 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 | 54.7 | Low | 69.8 | Low | 224 Ų | 224 | 143.5 Ų | 143.5 | 100% | 1.103 | 68% | 0.677 | S | S | * | * | 0 | -38.4 | 0 | -149.5 | 165.5 | -179 | 0 | 0 | 112.7 | |||||
| 2 | M | 59.7 | Low | 70.1 | Confident | 164 Ų | 164 | 145.7 Ų | 145.7 | 81% | 0.808 | 68% | 0.676 | S | S | * | * | H | α-helix | trans | -62.5 | -39.8 | 179.9 | -71 | -97.7 | -132.6 | 0 | 0 | 115.8 | K4 L5 Q6 | M2-K4 PolarHBondContact O-N 2.71Å; M2-L5 WeakPolarHBondContact O-CB 3.07Å; M2-L5 PolarHBondContact O-N 3.37Å; M2-Q6 PolarHBondContact O-N 3.26Å; M2-Q6 VanDerWaalsContact O-N 3.11Å |
| 3 | Q | 61.5 | Low | 70.3 | Confident | 161 Ų | 161 | 141.7 Ų | 141.7 | 75% | 0.752 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -66.7 | -34 | -178.8 | -85.6 | 176.1 | -29 | 0 | 0 | 114.1 | L5 Q6 M7 | Q3-L5 VanDerWaalsContact C-N 3.33Å; Q3-Q6 PolarHBondContact O-N 3.22Å; Q3-M7 PolarHBondContact O-N 3.27Å; Q3-M7 VanDerWaalsContact O-N 3.15Å |
| 4 | K | 62 | Low | 70.4 | Confident | 162 Ų | 162 | 142 Ų | 142 | 70% | 0.704 | 66% | 0.66 | S | S | * | * | H | α-helix | trans | -66.9 | -39 | 176.6 | -73.1 | -90.6 | 179.2 | 172.7 | 0 | 110.5 | M2 M7 Y8 | M2-K4 PolarHBondContact O-N 2.71Å; K4-M7 PolarHBondContact O-N 3.09Å; K4-Y8 VanDerWaalsContact O-CD2 3.3Å; K4-Y8 WeakPolarHBondContact O-CD2 3.14Å; K4-Y8 PolarHBondContact O-N 3.06Å; K4-Y8 VanDerWaalsContact O-N 3.1Å |
| 5 | L | 70.2 | Confident | 70.2 | Confident | 119 Ų | 119 | 140.8 Ų | 140.8 | 62% | 0.623 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -65.8 | -41.8 | 177.8 | -155.7 | 76.3 | 0 | 0 | 0 | 111.3 | M2 Q3 M7 Y8 V9 | M2-L5 WeakPolarHBondContact O-CB 3.07Å; M2-L5 PolarHBondContact O-N 3.37Å; Q3-L5 VanDerWaalsContact C-N 3.33Å; L5-M7 VanDerWaalsContact C-N 3.34Å; L5-M7 PolarHBondContact O-N 3.34Å; L5-Y8 PolarHBondContact O-N 3.38Å; L5-V9 VanDerWaalsContact O-CG2 3.32Å; L5-V9 WeakPolarHBondContact O-CG2 3.38Å; L5-V9 PolarHBondContact O-N 3.13Å |
| 6 | Q | 70.1 | Confident | 69.9 | Low | 128 Ų | 128 | 139.1 Ų | 139.1 | 60% | 0.598 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -64.6 | -37.5 | 179 | -145.1 | 176 | -8.1 | 0 | 0 | 112.5 | M2 Q3 Y10 | M2-Q6 PolarHBondContact O-N 3.26Å; M2-Q6 VanDerWaalsContact O-N 3.11Å; Q3-Q6 PolarHBondContact O-N 3.22Å; Q6-Y10 PolarHBondContact O-N 3.2Å; Q6-Y10 VanDerWaalsContact O-N 3.07Å |
| 7 | M | 75.9 | Confident | 69.6 | Low | 118 Ų | 118 | 138.4 Ų | 138.4 | 58% | 0.581 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -67 | -41.4 | 172.9 | -76.3 | -62.3 | -60 | 0 | 0 | 112.6 | Q3 K4 L5 V9 Y10 I11 | Q3-M7 PolarHBondContact O-N 3.27Å; Q3-M7 VanDerWaalsContact O-N 3.15Å; K4-M7 PolarHBondContact O-N 3.09Å; L5-M7 VanDerWaalsContact C-N 3.34Å; L5-M7 PolarHBondContact O-N 3.34Å; M7-V9 VanDerWaalsContact C-N 3.35Å; M7-Y10 PolarHBondContact O-N 3.34Å; M7-I11 WeakPolarHBondContact O-CD1 3.28Å; M7-I11 VanDerWaalsContact O-CG1 3.26Å; M7-I11 WeakPolarHBondContact O-CG1 3.4Å; M7-I11 PolarHBondContact O-N 3.15Å |
| 8 | Y | 76.9 | Confident | 69.5 | Low | 169 Ų | 169 | 135.3 Ų | 135.3 | 66% | 0.663 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -64 | -39.9 | 175.9 | -93.1 | -75 | 0 | 0 | 0 | 112.1 | K4 L5 I11 Y12 | K4-Y8 VanDerWaalsContact O-CD2 3.3Å; K4-Y8 WeakPolarHBondContact O-CD2 3.14Å; K4-Y8 PolarHBondContact O-N 3.06Å; K4-Y8 VanDerWaalsContact O-N 3.1Å; L5-Y8 PolarHBondContact O-N 3.38Å; Y8-I11 PolarHBondContact O-N 2.97Å; Y8-Y12 WeakPolarHBondContact O-CB 3.49Å; Y8-Y12 PolarHBondContact O-N 3.27Å |
| 9 | V | 79.6 | Confident | 68.8 | Low | 90 Ų | 90 | 131.3 Ų | 131.3 | 55% | 0.545 | 65% | 0.646 | S | S | . | * | H | α-helix | trans | -63.7 | -41.9 | 175.6 | 172.7 | 0 | 0 | 0 | 0 | 111.1 | L5 M7 Y12 L13 | L5-V9 VanDerWaalsContact O-CG2 3.32Å; L5-V9 WeakPolarHBondContact O-CG2 3.38Å; L5-V9 PolarHBondContact O-N 3.13Å; M7-V9 VanDerWaalsContact C-N 3.35Å; V9-Y12 PolarHBondContact O-N 2.93Å; V9-L13 WeakPolarHBondContact O-CB 3.02Å; V9-L13 PolarHBondContact O-N 3.49Å |
| 10 | Y | 79.1 | Confident | 68.1 | Low | 150 Ų | 150 | 127.1 Ų | 127.1 | 59% | 0.588 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -64 | -41.8 | 176.5 | -110.4 | -83 | 0 | 0 | 0 | 112.7 | Q6 M7 Y12 L13 F14 | Q6-Y10 PolarHBondContact O-N 3.2Å; Q6-Y10 VanDerWaalsContact O-N 3.07Å; M7-Y10 PolarHBondContact O-N 3.34Å; Y10-Y12 VanDerWaalsContact C-N 3.34Å; Y10-L13 PolarHBondContact O-N 3.02Å; Y10-F14 WeakPolarHBondContact O-CB 3.09Å; Y10-F14 PolarHBondContact O-N 3.11Å |
| 11 | I | 78.3 | Confident | 67.4 | Low | 93 Ų | 93 | 126.6 Ų | 126.6 | 48% | 0.477 | 64% | 0.644 | S | S | . | * | H | α-helix | trans | -63.8 | -42.4 | 175.8 | -67.1 | 163.2 | 0 | 0 | 0 | 110.1 | M7 Y8 F14 M15 | M7-I11 WeakPolarHBondContact O-CD1 3.28Å; M7-I11 VanDerWaalsContact O-CG1 3.26Å; M7-I11 WeakPolarHBondContact O-CG1 3.4Å; M7-I11 PolarHBondContact O-N 3.15Å; Y8-I11 PolarHBondContact O-N 2.97Å; I11-F14 PolarHBondContact O-N 2.81Å; I11-M15 VanDerWaalsContact O-CG 3.31Å; I11-M15 WeakPolarHBondContact O-CG 3.32Å; I11-M15 PolarHBondContact O-N 2.88Å |
| 12 | Y | 72.9 | Confident | 67.2 | Low | 170 Ų | 170 | 122 Ų | 122 | 67% | 0.667 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -66 | -39.9 | 178.5 | -144.9 | -89.5 | 0 | 0 | 0 | 112.2 | Y8 V9 Y10 F14 M15 L16 | Y8-Y12 WeakPolarHBondContact O-CB 3.49Å; Y8-Y12 PolarHBondContact O-N 3.27Å; V9-Y12 PolarHBondContact O-N 2.93Å; Y10-Y12 VanDerWaalsContact C-N 3.34Å; Y12-F14 VanDerWaalsContact C-N 3.34Å; Y12-M15 PolarHBondContact O-N 2.79Å; Y12-L16 HydrophobicContact CD1-CD1 3.78Å; Y12-L16 HydrophobicContact CD1-CG 4.37Å; Y12-L16 HydrophobicContact CE1-CD1 4.17Å; Y12-L16 WeakPolarHBondContact O-CG 3.22Å; Y12-L16 PolarHBondContact O-N 3.31Å |
| 13 | L | 73.3 | Confident | 66.3 | Low | 94 Ų | 94 | 120.9 Ų | 120.9 | 49% | 0.492 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -64.6 | -39.7 | 174.5 | -153.8 | 84.1 | 0 | 0 | 0 | 111.2 | V9 Y10 L16 I17 | V9-L13 WeakPolarHBondContact O-CB 3.02Å; V9-L13 PolarHBondContact O-N 3.49Å; Y10-L13 PolarHBondContact O-N 3.02Å; L13-L16 PolarHBondContact O-N 3.09Å; L13-I17 HydrophobicContact CD2-CD1 4.49Å; L13-I17 HydrophobicContact CG-CD1 4.34Å; L13-I17 WeakPolarHBondContact O-CD1 3.13Å; L13-I17 WeakPolarHBondContact O-CG1 3.38Å; L13-I17 PolarHBondContact O-N 3.13Å |
| 14 | F | 70.9 | Confident | 65.6 | Low | 146 Ų | 146 | 121 Ų | 121 | 64% | 0.64 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -66.4 | -38.2 | 175.8 | -127.4 | -87.5 | 0 | 0 | 0 | 112.2 | Y10 I11 Y12 I17 A18 | Y10-F14 WeakPolarHBondContact O-CB 3.09Å; Y10-F14 PolarHBondContact O-N 3.11Å; I11-F14 PolarHBondContact O-N 2.81Å; Y12-F14 VanDerWaalsContact C-N 3.34Å; F14-I17 PolarHBondContact O-N 2.85Å; F14-A18 WeakPolarHBondContact O-CB 3.38Å; F14-A18 PolarHBondContact O-N 3.1Å |
| 15 | M | 68.4 | Low | 64.5 | Low | 124 Ų | 124 | 119.5 Ų | 119.5 | 61% | 0.611 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -67.1 | -37.3 | 174.4 | -70.3 | -63.6 | -70.6 | 0 | 0 | 111.9 | I11 Y12 I17 A19 | I11-M15 VanDerWaalsContact O-CG 3.31Å; I11-M15 WeakPolarHBondContact O-CG 3.32Å; I11-M15 PolarHBondContact O-N 2.88Å; Y12-M15 PolarHBondContact O-N 2.79Å; M15-I17 VanDerWaalsContact C-N 3.3Å; M15-I17 PolarHBondContact O-N 3.05Å; M15-A19 WeakPolarHBondContact O-CB 3.24Å; M15-A19 PolarHBondContact O-N 2.98Å |
| 16 | L | 65.1 | Low | 63.2 | Low | 114 Ų | 114 | 123.5 Ų | 123.5 | 60% | 0.597 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -68.3 | -25.5 | 174.1 | -80.9 | 160.8 | 0 | 0 | 0 | 113.6 | Y12 L13 | Y12-L16 HydrophobicContact CD1-CD1 3.78Å; Y12-L16 HydrophobicContact CD1-CG 4.37Å; Y12-L16 HydrophobicContact CE1-CD1 4.17Å; Y12-L16 WeakPolarHBondContact O-CG 3.22Å; Y12-L16 PolarHBondContact O-N 3.31Å; L13-L16 PolarHBondContact O-N 3.09Å |
| 17 | I | 65.4 | Low | 61.6 | Low | 126 Ų | 126 | 119.6 Ų | 119.6 | 65% | 0.646 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -86.6 | -36.8 | 177.2 | -65.2 | 162.7 | 0 | 0 | 0 | 111.1 | L13 F14 M15 | L13-I17 HydrophobicContact CD2-CD1 4.49Å; L13-I17 HydrophobicContact CG-CD1 4.34Å; L13-I17 WeakPolarHBondContact O-CD1 3.13Å; L13-I17 WeakPolarHBondContact O-CG1 3.38Å; L13-I17 PolarHBondContact O-N 3.13Å; F14-I17 PolarHBondContact O-N 2.85Å; M15-I17 VanDerWaalsContact C-N 3.3Å; M15-I17 PolarHBondContact O-N 3.05Å |
| 18 | A | 66.4 | Low | 59.8 | Low | 83 Ų | 83 | 120 Ų | 120 | 69% | 0.686 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -81.6 | -33 | -179.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | F14 | F14-A18 WeakPolarHBondContact O-CB 3.38Å; F14-A18 PolarHBondContact O-N 3.1Å |
| 19 | A | 57.8 | Low | 58.3 | Low | 59 Ų | 59 | 120.8 Ų | 120.8 | 49% | 0.488 | 66% | 0.663 | S | S | . | * | S | Bend | trans | -100.3 | 92.3 | 167.5 | 0 | 0 | 0 | 0 | 0 | 107.8 | M15 | M15-A19 WeakPolarHBondContact O-CB 3.24Å; M15-A19 PolarHBondContact O-N 2.98Å |
| 20 | G | 54.5 | Low | 56.5 | Low | 47 Ų | 47 | 126.4 Ų | 126.4 | 49% | 0.485 | 68% | 0.675 | S | S | . | * | trans | -51 | 160 | 164.3 | 0 | 0 | 0 | 0 | 0 | 110.7 | V22 | G20-V22 PolarHBondContact O-N 3.33Å; G20-V22 VanDerWaalsContact O-N 3.1Å | ||
| 21 | P | 52.9 | Low | 54.9 | Low | 118 Ų | 118 | 126.2 Ų | 126.2 | 77% | 0.766 | 68% | 0.679 | S | S | * | * | trans | -56.9 | 124.3 | -170.7 | 26.3 | -32.8 | 0 | 0 | 0 | 109.5 | D23 | P21-D23 VanDerWaalsContact C-N 3.32Å; P21-D23 PolarHBondContact O-N 3.28Å | ||
| 22 | V | 50.9 | Low | 53 | Low | 126 Ų | 126 | 129.9 Ų | 129.9 | 76% | 0.764 | 69% | 0.694 | S | S | * | * | trans | -71.6 | 97.9 | 163.2 | 176 | 0 | 0 | 0 | 0 | 105.2 | G20 L24 | G20-V22 PolarHBondContact O-N 3.33Å; G20-V22 VanDerWaalsContact O-N 3.1Å; V22-L24 PolarHBondContact O-N 3.09Å | ||
| 23 | D | 40.1 | Very low | 51.7 | Low | 141 Ų | 141 | 129.9 Ų | 129.9 | 75% | 0.754 | 71% | 0.706 | S | S | * | * | trans | -62.8 | 96.6 | 169.5 | -92.4 | -54.4 | 0 | 0 | 0 | 109 | P21 N25 | P21-D23 VanDerWaalsContact C-N 3.32Å; P21-D23 PolarHBondContact O-N 3.28Å; D23-N25 VanDerWaalsContact C-N 3.33Å; D23-N25 PolarHBondContact O-N 3.45Å | ||
| 24 | L | 47.6 | Very low | 50.4 | Low | 165 Ų | 165 | 129.9 Ų | 129.9 | 86% | 0.864 | 71% | 0.71 | S | S | * | * | trans | -84.6 | 83.2 | 156.1 | -77.1 | 168.4 | 0 | 0 | 0 | 107.1 | V22 | V22-L24 PolarHBondContact O-N 3.09Š| ||
| 25 | N | 37.9 | Very low | 49.4 | Very low | 129 Ų | 129 | 131 Ų | 131 | 69% | 0.69 | 72% | 0.717 | S | S | * | * | trans | -127.4 | 87.5 | 167.1 | -163.8 | 33.9 | 0 | 0 | 0 | 110.3 | D23 | D23-N25 VanDerWaalsContact C-N 3.33Å; D23-N25 PolarHBondContact O-N 3.45Å | ||
| 26 | E | 43.6 | Very low | 48.6 | Very low | 204 Ų | 204 | 135 Ų | 135 | 95% | 0.953 | 73% | 0.731 | S | S | * | * | trans | -82.8 | 101.3 | 162.8 | -168.2 | 174.4 | 151.2 | 0 | 0 | 107.3 | ||||
| 27 | G | 37 | Very low | 48 | Very low | 45 Ų | 45 | 137.9 Ų | 137.9 | 46% | 0.464 | 74% | 0.741 | S | S | . | * | trans | 158.3 | 115.6 | 173.6 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 28 | S | 36.3 | Very low | 47.7 | Very low | 126 Ų | 126 | 134.8 Ų | 134.8 | 88% | 0.881 | 74% | 0.74 | S | S | * | * | trans | 83.3 | 118.9 | 160.3 | 70.3 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 29 | E | 45.5 | Very low | 47.6 | Very low | 187 Ų | 187 | 138.4 Ų | 138.4 | 87% | 0.874 | 75% | 0.747 | S | S | * | * | trans | -41.5 | 149.3 | 163.6 | -55.4 | 170.1 | 130.1 | 0 | 0 | 114.8 | ||||
| 30 | R | 42.2 | Very low | 48.7 | Very low | 208 Ų | 208 | 138.4 Ų | 138.4 | 79% | 0.785 | 74% | 0.743 | S | S | * | * | 124.4 | 122.3 | 122.5 | -163 | 164.4 | -177.3 | 114.9 | 6.6 | 114.7 | |||||
| 31 | E | 46 | Very low | 49.9 | Very low | 145 Ų | 145 | 142.2 Ų | 142.2 | 68% | 0.678 | 75% | 0.752 | S | S | * | * | trans | 72 | 85.7 | 158.8 | -75.3 | 168.6 | -151.8 | 0 | 0 | 117.8 | ||||
| 32 | E | 38.3 | Very low | 51.3 | Low | 171 Ų | 171 | 139.3 Ų | 139.3 | 80% | 0.799 | 74% | 0.738 | S | S | * | * | trans | -145.3 | 88.5 | 130.3 | -156.3 | 172 | -172.8 | 0 | 0 | 109.5 | V34 | E32-V34 HydrophobicContact CG-CB 4.06Å; E32-V34 HydrophobicContact CG-CG2 3.53Å; E32-V34 PolarHBondContact O-N 3.01Å | ||
| 33 | N | 44.7 | Very low | 53 | Low | 169 Ų | 169 | 136.3 Ų | 136.3 | 90% | 0.904 | 72% | 0.722 | S | S | * | * | trans | -72.1 | 78.8 | 161.3 | -87.7 | -69.4 | 0 | 0 | 0 | 107.6 | ||||
| 34 | V | 45.8 | Very low | 55.2 | Low | 95 Ų | 95 | 131.8 Ų | 131.8 | 58% | 0.576 | 70% | 0.704 | S | S | * | * | trans | -114 | 101.8 | 167 | 169.6 | 0 | 0 | 0 | 0 | 107.5 | E32 K36 | E32-V34 HydrophobicContact CG-CB 4.06Å; E32-V34 HydrophobicContact CG-CG2 3.53Å; E32-V34 PolarHBondContact O-N 3.01Å; V34-K36 PolarHBondContact O-N 3.02Å | ||
| 35 | E | 51.5 | Low | 56.9 | Low | 169 Ų | 169 | 132.1 Ų | 132.1 | 79% | 0.79 | 69% | 0.694 | S | S | * | * | trans | 28.2 | 80.5 | 153.4 | -66 | 179.5 | 168.4 | 0 | 0 | 116.4 | E37 | E35-E37 VanDerWaalsContact C-N 3.3Š| ||
| 36 | K | 50.1 | Low | 59.3 | Low | 209 Ų | 209 | 134.3 Ų | 134.3 | 91% | 0.909 | 69% | 0.693 | S | S | * | * | trans | -97.1 | 66.9 | 142 | -76.7 | -176.6 | -180 | 171.7 | 0 | 108.8 | V34 G38 | V34-K36 PolarHBondContact O-N 3.02Å; K36-G38 PolarHBondContact O-N 3.13Å | ||
| 37 | E | 53.8 | Low | 61.3 | Low | 174 Ų | 174 | 131.2 Ų | 131.2 | 81% | 0.813 | 68% | 0.678 | S | S | * | * | trans | -66.9 | 68.9 | 148.2 | -69.6 | -163.1 | 165.4 | 0 | 0 | 107.7 | E35 L39 | E35-E37 VanDerWaalsContact C-N 3.3Å; E37-L39 PolarHBondContact O-N 3.29Å | ||
| 38 | G | 58.6 | Low | 63.7 | Low | 61 Ų | 61 | 134.1 Ų | 134.1 | 63% | 0.629 | 68% | 0.683 | S | S | * | * | trans | -61.5 | 112.2 | 168 | 0 | 0 | 0 | 0 | 0 | 106.9 | K36 C40 | K36-G38 PolarHBondContact O-N 3.13Å; G38-C40 PolarHBondContact O-N 3.13Å | ||
| 39 | L | 64.4 | Low | 66.2 | Low | 159 Ų | 159 | 129.7 Ų | 129.7 | 83% | 0.832 | 65% | 0.651 | S | S | * | * | trans | -49.9 | 88 | 167.1 | -69.4 | 157.4 | 0 | 0 | 0 | 108.7 | E37 N41 | E37-L39 PolarHBondContact O-N 3.29Å; L39-N41 VanDerWaalsContact C-N 3.26Å; L39-N41 PolarHBondContact O-N 3.08Å | ||
| 40 | C | 81.8 | Confident | 68.5 | Low | 58 Ų | 58 | 129.4 Ų | 129.4 | 39% | 0.392 | 64% | 0.642 | S | S | . | * | trans | -73.1 | 88.6 | 177.5 | 174.8 | 0 | 0 | 0 | 0 | 107.1 | G38 A42 C43 A44 | G38-C40 PolarHBondContact O-N 3.13Å; C40-A42 PolarHBondContact O-N 3.39Å; C40-A42 VanDerWaalsContact O-N 3.16Å; C40-C43 HydrophobicContact CB-CB 3.58Å; C40-C43 WeakPolarHBondContact CB-SG 3.33Å; C40-C43 WeakPolarHBondContact O-CA 3.38Å; C40-C43 WeakPolarHBondContact O-CB 3.16Å; C40-C43 PolarHBondContact O-N 2.77Å; C40-C43 WeakPolarHBondContact SG-CB 3.3Å; C40-C43 PolarHBondContact SG-N 3.45Å; C40-C43 CovalentContact SG-SG 2.05Å; C40-C43 PolarHBondContact SG-SG 3.38Å; C40-A44 PolarHBondContact O-N 3.32Å | ||
| 41 | N | 79.6 | Confident | 71 | Confident | 127 Ų | 127 | 125.7 Ų | 125.7 | 68% | 0.679 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -55.8 | -32.6 | 179.1 | -68.5 | -27 | 0 | 0 | 0 | 111.7 | L39 W45 | L39-N41 VanDerWaalsContact C-N 3.26Å; L39-N41 PolarHBondContact O-N 3.08Å; N41-W45 WeakPolarHBondContact O-CB 3.41Å; N41-W45 PolarHBondContact O-N 3.44Å |
| 42 | A | 82.3 | Confident | 73.1 | Confident | 57 Ų | 57 | 122.2 Ų | 122.2 | 47% | 0.471 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -67.8 | -35.8 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | C40 R46 | C40-A42 PolarHBondContact O-N 3.39Å; C40-A42 VanDerWaalsContact O-N 3.16Å; A42-R46 WeakPolarHBondContact O-CB 3.19Å; A42-R46 WeakPolarHBondContact O-CG 3.46Å; A42-R46 PolarHBondContact O-N 3.39Å |
| 43 | C | 86.6 | Confident | 75.8 | Confident | 63 Ų | 63 | 122.2 Ų | 122.2 | 43% | 0.426 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -72.7 | -45.8 | 177.4 | -52.3 | 0 | 0 | 0 | 0 | 110.4 | C40 W45 R46 Q47 | C40-C43 HydrophobicContact CB-CB 3.58Å; C40-C43 WeakPolarHBondContact CB-SG 3.33Å; C40-C43 WeakPolarHBondContact O-CA 3.38Å; C40-C43 WeakPolarHBondContact O-CB 3.16Å; C40-C43 PolarHBondContact O-N 2.77Å; C40-C43 WeakPolarHBondContact SG-CB 3.3Å; C40-C43 PolarHBondContact SG-N 3.45Å; C40-C43 CovalentContact SG-SG 2.05Å; C40-C43 PolarHBondContact SG-SG 3.38Å; C43-W45 VanDerWaalsContact C-N 3.35Å; C43-W45 PolarHBondContact O-N 3.49Å; C43-R46 PolarHBondContact O-N 3.06Å; C43-Q47 WeakPolarHBondContact O-CB 3.39Å; C43-Q47 PolarHBondContact O-N 3.4Å |
| 44 | A | 85.1 | Confident | 78.2 | Confident | 46 Ų | 46 | 117.3 Ų | 117.3 | 38% | 0.38 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -60.8 | -42.5 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | C40 Q47 N48 | C40-A44 PolarHBondContact O-N 3.32Å; A44-Q47 PolarHBondContact O-N 3.43Å; A44-N48 WeakPolarHBondContact O-CB 3.29Å; A44-N48 VanDerWaalsContact O-CG 3.28Å; A44-N48 PolarHBondContact O-N 2.91Å; A44-N48 PolarHBondContact O-OD1 3.16Å |
| 45 | W | 84.4 | Confident | 80.4 | Confident | 173 Ų | 173 | 116.5 Ų | 116.5 | 66% | 0.655 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -64.9 | -42.8 | 175.4 | -178.2 | 82.6 | 0 | 0 | 0 | 112.6 | N41 C43 Q47 N48 T49 | N41-W45 WeakPolarHBondContact O-CB 3.41Å; N41-W45 PolarHBondContact O-N 3.44Å; C43-W45 VanDerWaalsContact C-N 3.35Å; C43-W45 PolarHBondContact O-N 3.49Å; W45-Q47 VanDerWaalsContact C-N 3.3Å; W45-Q47 PolarHBondContact O-N 3.48Å; W45-N48 PolarHBondContact O-N 3.44Å; W45-T49 VanDerWaalsContact O-CB 3.3Å; W45-T49 WeakPolarHBondContact O-CB 3.28Å; W45-T49 PolarHBondContact O-N 3.42Å; W45-T49 PolarHBondContact O-OG1 2.92Å |
| 46 | R | 86.7 | Confident | 82.3 | Confident | 174 Ų | 174 | 111 Ų | 111 | 66% | 0.657 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -61.1 | -40.4 | 173.4 | -77.8 | 171.2 | -176.2 | -178.6 | 2 | 111.4 | A42 C43 R50 | A42-R46 WeakPolarHBondContact O-CB 3.19Å; A42-R46 WeakPolarHBondContact O-CG 3.46Å; A42-R46 PolarHBondContact O-N 3.39Å; C43-R46 PolarHBondContact O-N 3.06Å; R46-R50 VanDerWaalsContact O-CB 3.24Å; R46-R50 WeakPolarHBondContact O-CB 3.37Å; R46-R50 PolarHBondContact O-N 2.83Å |
| 47 | Q | 87 | Confident | 84.4 | Confident | 139 Ų | 139 | 105.3 Ų | 105.3 | 65% | 0.65 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -69 | -43.9 | 179.5 | -167.5 | 161.1 | -5.8 | 0 | 0 | 111.6 | C43 A44 W45 R50 Y51 | C43-Q47 WeakPolarHBondContact O-CB 3.39Å; C43-Q47 PolarHBondContact O-N 3.4Å; A44-Q47 PolarHBondContact O-N 3.43Å; W45-Q47 VanDerWaalsContact C-N 3.3Å; W45-Q47 PolarHBondContact O-N 3.48Å; Q47-R50 PolarHBondContact O-N 3.39Å; Q47-Y51 WeakPolarHBondContact O-CB 3.48Å; Q47-Y51 PolarHBondContact O-N 2.83Å |
| 48 | N | 87.4 | Confident | 86.3 | Confident | 107 Ų | 107 | 102.7 Ų | 102.7 | 57% | 0.572 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -62.7 | -45.2 | 173.9 | -72.9 | 0.2 | 0 | 0 | 0 | 111.2 | A44 W45 R50 Y51 S52 | A44-N48 WeakPolarHBondContact O-CB 3.29Å; A44-N48 VanDerWaalsContact O-CG 3.28Å; A44-N48 PolarHBondContact O-N 2.91Å; A44-N48 PolarHBondContact O-OD1 3.16Å; W45-N48 PolarHBondContact O-N 3.44Å; N48-R50 VanDerWaalsContact C-N 3.32Å; N48-R50 PolarHBondContact O-N 3.45Å; N48-Y51 PolarHBondContact O-N 3.4Å; N48-S52 PolarHBondContact O-N 3.4Å; N48-S52 PolarHBondContact O-OG 3.17Å; N48-S52 VanDerWaalsContact O-OG 3.13Å |
| 49 | T | 89.1 | Confident | 87.8 | Confident | 33 Ų | 33 | 105.4 Ų | 105.4 | 20% | 0.202 | 52% | 0.523 | C | S | . | . | H | α-helix | trans | -62 | -41.4 | 176.7 | -55.6 | 0 | 0 | 0 | 0 | 111.3 | W45 R53 | W45-T49 VanDerWaalsContact O-CB 3.3Å; W45-T49 WeakPolarHBondContact O-CB 3.28Å; W45-T49 PolarHBondContact O-N 3.42Å; W45-T49 PolarHBondContact O-OG1 2.92Å; T49-R53 WeakPolarHBondContact O-CB 3.39Å; T49-R53 VanDerWaalsContact O-CG 3.25Å; T49-R53 WeakPolarHBondContact O-CG 3.5Å; T49-R53 PolarHBondContact O-N 3.16Å |
| 50 | R | 93.4 | Very high | 88.9 | Confident | 180 Ų | 180 | 102.2 Ų | 102.2 | 68% | 0.679 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -62.3 | -44.8 | 174.8 | -177.6 | -177.5 | 177.7 | -169.8 | 0.5 | 110.9 | R46 Q47 N48 R53 I54 | R46-R50 VanDerWaalsContact O-CB 3.24Å; R46-R50 WeakPolarHBondContact O-CB 3.37Å; R46-R50 PolarHBondContact O-N 2.83Å; Q47-R50 PolarHBondContact O-N 3.39Å; N48-R50 VanDerWaalsContact C-N 3.32Å; N48-R50 PolarHBondContact O-N 3.45Å; R50-R53 PolarHBondContact O-N 3.12Å; R50-I54 HydrophobicContact CG-CD1 3.92Å; R50-I54 VanDerWaalsContact O-CG1 3.24Å; R50-I54 WeakPolarHBondContact O-CG1 3.34Å; R50-I54 PolarHBondContact O-N 3.09Å |
| 51 | Y | 93.6 | Very high | 89.4 | Confident | 131 Ų | 131 | 103.8 Ų | 103.8 | 51% | 0.514 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -62.9 | -48.2 | 179 | -174.6 | -96.2 | 0 | 0 | 0 | 111.5 | Q47 N48 R53 I54 E55 | Q47-Y51 WeakPolarHBondContact O-CB 3.48Å; Q47-Y51 PolarHBondContact O-N 2.83Å; N48-Y51 PolarHBondContact O-N 3.4Å; Y51-R53 VanDerWaalsContact C-N 3.33Å; Y51-R53 PolarHBondContact O-N 3.47Å; Y51-I54 WeakPolarHBondContact O-CB 3.17Å; Y51-I54 PolarHBondContact O-N 2.85Å; Y51-I54 VanDerWaalsContact O-N 3.11Å; Y51-E55 HydrophobicContact CD1-CG 4.36Å; Y51-E55 HydrophobicContact CE1-CG 3.94Å; Y51-E55 WeakPolarHBondContact CE1-OE1 3.23Å; Y51-E55 PolarHBondContact O-N 3.3Å; Y51-E55 PolarHBondContact OH-OE1 2.93Å |
| 52 | S | 91.4 | Very high | 89.8 | Confident | 71 Ų | 71 | 100 Ų | 100 | 50% | 0.497 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -60.6 | -39.5 | 175.4 | -58.5 | 0 | 0 | 0 | 0 | 112.6 | N48 E55 A56 | N48-S52 PolarHBondContact O-N 3.4Å; N48-S52 PolarHBondContact O-OG 3.17Å; N48-S52 VanDerWaalsContact O-OG 3.13Å; S52-E55 PolarHBondContact O-N 3.13Å; S52-A56 WeakPolarHBondContact O-CB 3.45Å; S52-A56 PolarHBondContact O-N 3.45Å |
| 53 | R | 94.2 | Very high | 90.1 | Very high | 171 Ų | 171 | 99.7 Ų | 99.7 | 65% | 0.645 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -64.2 | -41.1 | 174.1 | -75.3 | 176.2 | -174.7 | -177.3 | 2.6 | 111.9 | T49 R50 Y51 E55 A56 I57 | T49-R53 WeakPolarHBondContact O-CB 3.39Å; T49-R53 VanDerWaalsContact O-CG 3.25Å; T49-R53 WeakPolarHBondContact O-CG 3.5Å; T49-R53 PolarHBondContact O-N 3.16Å; R50-R53 PolarHBondContact O-N 3.12Å; Y51-R53 VanDerWaalsContact C-N 3.33Å; Y51-R53 PolarHBondContact O-N 3.47Å; R53-E55 VanDerWaalsContact C-N 3.34Å; R53-A56 PolarHBondContact O-N 3.43Å; R53-I57 VanDerWaalsContact O-CG1 3.23Å; R53-I57 WeakPolarHBondContact O-CG1 3.48Å; R53-I57 PolarHBondContact O-N 2.86Å |
| 54 | I | 95.2 | Very high | 90.1 | Very high | 67 Ų | 67 | 100.8 Ų | 100.8 | 34% | 0.344 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -63.3 | -42.5 | 177.1 | -71.5 | 165 | 0 | 0 | 0 | 110.5 | R50 Y51 I57 K58 | R50-I54 HydrophobicContact CG-CD1 3.92Å; R50-I54 VanDerWaalsContact O-CG1 3.24Å; R50-I54 WeakPolarHBondContact O-CG1 3.34Å; R50-I54 PolarHBondContact O-N 3.09Å; Y51-I54 WeakPolarHBondContact O-CB 3.17Å; Y51-I54 PolarHBondContact O-N 2.85Å; Y51-I54 VanDerWaalsContact O-N 3.11Å; I54-I57 PolarHBondContact O-N 3.49Å; I54-K58 HydrophobicContact CG2-CD 4.38Å; I54-K58 WeakPolarHBondContact O-CG 3.44Å; I54-K58 PolarHBondContact O-N 2.87Å |
| 55 | E | 92.4 | Very high | 90 | Very high | 77 Ų | 77 | 103.1 Ų | 103.1 | 36% | 0.36 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -63.9 | -43 | 175.7 | -70 | -173.9 | 148.4 | 0 | 0 | 112.1 | Y51 S52 R53 I57 K58 I59 | Y51-E55 HydrophobicContact CD1-CG 4.36Å; Y51-E55 HydrophobicContact CE1-CG 3.94Å; Y51-E55 WeakPolarHBondContact CE1-OE1 3.23Å; Y51-E55 PolarHBondContact O-N 3.3Å; Y51-E55 PolarHBondContact OH-OE1 2.93Å; S52-E55 PolarHBondContact O-N 3.13Å; R53-E55 VanDerWaalsContact C-N 3.34Å; E55-I57 VanDerWaalsContact C-N 3.34Å; E55-I57 PolarHBondContact O-N 2.83Å; E55-K58 WeakPolarHBondContact O-CB 3.35Å; E55-K58 PolarHBondContact O-N 2.9Å; E55-I59 WeakPolarHBondContact O-CG1 3.25Å; E55-I59 PolarHBondContact O-N 3.34Å; E55-I59 VanDerWaalsContact O-N 3.09Å |
| 56 | A | 92 | Very high | 90 | Very high | 55 Ų | 55 | 103.1 Ų | 103.1 | 46% | 0.455 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -59.7 | -44.2 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | S52 R53 K58 I59 Q60 | S52-A56 WeakPolarHBondContact O-CB 3.45Å; S52-A56 PolarHBondContact O-N 3.45Å; R53-A56 PolarHBondContact O-N 3.43Å; A56-K58 PolarHBondContact O-N 3.03Å; A56-I59 PolarHBondContact O-N 3.42Å; A56-Q60 VanDerWaalsContact O-CB 3.29Å; A56-Q60 WeakPolarHBondContact O-CB 3.4Å; A56-Q60 PolarHBondContact O-N 3.12Å |
| 57 | I | 93.8 | Very high | 89.8 | Confident | 89 Ų | 89 | 98.3 Ų | 98.3 | 46% | 0.456 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -62.2 | -43.5 | 176.9 | -70.2 | 164.5 | 0 | 0 | 0 | 110.9 | R53 I54 E55 I59 Q60 I61 | R53-I57 VanDerWaalsContact O-CG1 3.23Å; R53-I57 WeakPolarHBondContact O-CG1 3.48Å; R53-I57 PolarHBondContact O-N 2.86Å; I54-I57 PolarHBondContact O-N 3.49Å; E55-I57 VanDerWaalsContact C-N 3.34Å; E55-I57 PolarHBondContact O-N 2.83Å; I57-I59 VanDerWaalsContact C-N 3.33Å; I57-I59 PolarHBondContact O-N 3.06Å; I57-Q60 PolarHBondContact O-N 3.02Å; I57-I61 HydrophobicContact CG2-CD1 3.65Å; I57-I61 HydrophobicContact CG2-CG1 4.23Å; I57-I61 WeakPolarHBondContact O-CB 3.33Å; I57-I61 VanDerWaalsContact O-CG1 3.28Å; I57-I61 WeakPolarHBondContact O-CG1 3.39Å; I57-I61 PolarHBondContact O-N 3.15Å |
| 58 | K | 92.3 | Very high | 89.7 | Confident | 119 Ų | 119 | 100.8 Ų | 100.8 | 52% | 0.517 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -56.9 | -47.9 | 177.1 | -74.2 | 171.3 | -179.8 | 176.8 | 0 | 111.3 | I54 E55 A56 I61 L62 | I54-K58 HydrophobicContact CG2-CD 4.38Å; I54-K58 WeakPolarHBondContact O-CG 3.44Å; I54-K58 PolarHBondContact O-N 2.87Å; E55-K58 WeakPolarHBondContact O-CB 3.35Å; E55-K58 PolarHBondContact O-N 2.9Å; A56-K58 PolarHBondContact O-N 3.03Å; K58-I61 PolarHBondContact O-N 3.01Å; K58-L62 WeakPolarHBondContact O-CG 3.24Å; K58-L62 PolarHBondContact O-N 3.48Å; K58-L62 VanDerWaalsContact O-N 3.15Å |
| 59 | I | 90.3 | Very high | 89.6 | Confident | 117 Ų | 117 | 100.8 Ų | 100.8 | 60% | 0.6 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -66.8 | -42.4 | 179.8 | -62.7 | 164.1 | 0 | 0 | 0 | 110.5 | E55 A56 I57 I61 L62 S63 | E55-I59 WeakPolarHBondContact O-CG1 3.25Å; E55-I59 PolarHBondContact O-N 3.34Å; E55-I59 VanDerWaalsContact O-N 3.09Å; A56-I59 PolarHBondContact O-N 3.42Å; I57-I59 VanDerWaalsContact C-N 3.33Å; I57-I59 PolarHBondContact O-N 3.06Å; I59-I61 PolarHBondContact O-N 2.87Å; I59-L62 PolarHBondContact O-N 3.37Å; I59-S63 WeakPolarHBondContact O-CB 3.48Å; I59-S63 PolarHBondContact O-N 3.28Å |
| 60 | Q | 88.1 | Confident | 89.5 | Confident | 93 Ų | 93 | 102.6 Ų | 102.6 | 44% | 0.435 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -62.6 | -41.8 | 179 | -168.8 | 179.3 | 17.5 | 0 | 0 | 111.6 | A56 I57 S63 K64 | A56-Q60 VanDerWaalsContact O-CB 3.29Å; A56-Q60 WeakPolarHBondContact O-CB 3.4Å; A56-Q60 PolarHBondContact O-N 3.12Å; I57-Q60 PolarHBondContact O-N 3.02Å; Q60-S63 PolarHBondContact O-N 2.91Å; Q60-K64 HydrophobicContact CG-CD 4.48Å; Q60-K64 HydrophobicContact CG-CG 4.46Å; Q60-K64 WeakPolarHBondContact O-CB 2.92Å; Q60-K64 VanDerWaalsContact O-CG 3.3Å; Q60-K64 WeakPolarHBondContact O-CG 3.24Å; Q60-K64 PolarHBondContact O-N 3.41Å |
| 61 | I | 91.5 | Very high | 89 | Confident | 90 Ų | 90 | 98.1 Ų | 98.1 | 46% | 0.462 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -60.8 | -48.7 | 175.1 | -71.2 | 168.1 | 0 | 0 | 0 | 110.6 | I57 K58 I59 S63 K64 L65 | I57-I61 HydrophobicContact CG2-CD1 3.65Å; I57-I61 HydrophobicContact CG2-CG1 4.23Å; I57-I61 WeakPolarHBondContact O-CB 3.33Å; I57-I61 VanDerWaalsContact O-CG1 3.28Å; I57-I61 WeakPolarHBondContact O-CG1 3.39Å; I57-I61 PolarHBondContact O-N 3.15Å; K58-I61 PolarHBondContact O-N 3.01Å; I59-I61 PolarHBondContact O-N 2.87Å; I61-S63 VanDerWaalsContact C-N 3.32Å; I61-S63 PolarHBondContact O-N 3.46Å; I61-K64 PolarHBondContact O-N 3.15Å; I61-L65 HydrophobicContact CG2-CD1 3.79Å; I61-L65 HydrophobicContact CG2-CG 4.4Å; I61-L65 WeakPolarHBondContact O-CB 3.3Å; I61-L65 WeakPolarHBondContact O-CG 3.4Å; I61-L65 PolarHBondContact O-N 3.18Å |
| 62 | L | 89.5 | Confident | 88.5 | Confident | 47 Ų | 47 | 100 Ų | 100 | 25% | 0.246 | 52% | 0.519 | C | S | . | . | H | α-helix | trans | -60.3 | -42.6 | 178.4 | -69 | 173.6 | 0 | 0 | 0 | 111.6 | K58 I59 L65 R66 L67 A70 | K58-L62 WeakPolarHBondContact O-CG 3.24Å; K58-L62 PolarHBondContact O-N 3.48Å; K58-L62 VanDerWaalsContact O-N 3.15Å; I59-L62 PolarHBondContact O-N 3.37Å; L62-L65 PolarHBondContact O-N 3.13Å; L62-R66 PolarHBondContact O-N 3.24Å; L62-L67 HydrophobicContact CD2-CB 4.14Å; L62-L67 PolarHBondContact O-N 3.21Å; L62-A70 HydrophobicContact CD2-CB 4.46Å |
| 63 | S | 88.4 | Confident | 88 | Confident | 52 Ų | 52 | 101 Ų | 101 | 36% | 0.364 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -61.8 | -48.2 | 175.5 | 179.1 | 0 | 0 | 0 | 0 | 112.2 | I59 Q60 I61 L65 R66 Y112 | I59-S63 WeakPolarHBondContact O-CB 3.48Å; I59-S63 PolarHBondContact O-N 3.28Å; Q60-S63 PolarHBondContact O-N 2.91Å; I61-S63 VanDerWaalsContact C-N 3.32Å; I61-S63 PolarHBondContact O-N 3.46Å; S63-L65 VanDerWaalsContact C-N 3.33Å; S63-L65 PolarHBondContact O-N 2.96Å; S63-R66 PolarHBondContact O-N 2.86Å; S63-Y112 PolarHBondContact OG-OH 3.38Å; S63-Y112 VanDerWaalsContact OG-OH 3.09Å |
| 64 | K | 86.5 | Confident | 87.4 | Confident | 86 Ų | 86 | 96.1 Ų | 96.1 | 37% | 0.374 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63.1 | -38.9 | 179.1 | -74.9 | -167.6 | 173.9 | -154.1 | 0 | 112.4 | Q60 I61 R66 | Q60-K64 HydrophobicContact CG-CD 4.48Å; Q60-K64 HydrophobicContact CG-CG 4.46Å; Q60-K64 WeakPolarHBondContact O-CB 2.92Å; Q60-K64 VanDerWaalsContact O-CG 3.3Å; Q60-K64 WeakPolarHBondContact O-CG 3.24Å; Q60-K64 PolarHBondContact O-N 3.41Å; I61-K64 PolarHBondContact O-N 3.15Å; K64-R66 PolarHBondContact O-N 3.29Å |
| 65 | L | 83.6 | Confident | 86.5 | Confident | 95 Ų | 95 | 101.1 Ų | 101.1 | 50% | 0.497 | 53% | 0.529 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -79.3 | -4.2 | 176.1 | -64.7 | 177 | 0 | 0 | 0 | 113.5 | I61 L62 S63 L67 | I61-L65 HydrophobicContact CG2-CD1 3.79Å; I61-L65 HydrophobicContact CG2-CG 4.4Å; I61-L65 WeakPolarHBondContact O-CB 3.3Å; I61-L65 WeakPolarHBondContact O-CG 3.4Å; I61-L65 PolarHBondContact O-N 3.18Å; L62-L65 PolarHBondContact O-N 3.13Å; S63-L65 VanDerWaalsContact C-N 3.33Å; S63-L65 PolarHBondContact O-N 2.96Å; L65-L67 VanDerWaalsContact C-N 3.26Å; L65-L67 HydrophobicContact CB-CD1 3.85Å; L65-L67 HydrophobicContact CB-CG 3.9Å; L65-L67 HydrophobicContact CD1-CD1 4.1Å; L65-L67 PolarHBondContact O-N 3.41Å |
| 66 | R | 83.5 | Confident | 85.4 | Confident | 173 Ų | 173 | 102 Ų | 102 | 65% | 0.653 | 54% | 0.536 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 55.6 | 41.4 | -176.1 | -57.5 | 178.7 | 171.4 | -173.8 | -6.8 | 112.3 | L62 S63 K64 H113 | L62-R66 PolarHBondContact O-N 3.24Å; S63-R66 PolarHBondContact O-N 2.86Å; K64-R66 PolarHBondContact O-N 3.29Å; R66-H113 PolarHBondContact NE-CE1 2.89Å; R66-H113 VanDerWaalsContact NE-CE1 3.32Å; R66-H113 PolarHBondContact NE-ND1 3.1Å; R66-H113 VanDerWaalsContact NE-ND1 3.16Å; R66-H113 PolarHBondContact NH2-CD2 3.09Å; R66-H113 VanDerWaalsContact NH2-CG 3.35Å; R66-H113 PolarHBondContact NH2-NE2 3.41Å |
| 67 | L | 83.4 | Confident | 84.3 | Confident | 72 Ų | 72 | 100.6 Ų | 100.6 | 38% | 0.377 | 52% | 0.524 | S | S | . | . | trans | -109.4 | 132.2 | 177.4 | -62.4 | 175.2 | 0 | 0 | 0 | 109.6 | L62 L65 | L62-L67 HydrophobicContact CD2-CB 4.14Å; L62-L67 PolarHBondContact O-N 3.21Å; L65-L67 VanDerWaalsContact C-N 3.26Å; L65-L67 HydrophobicContact CB-CD1 3.85Å; L65-L67 HydrophobicContact CB-CG 3.9Å; L65-L67 HydrophobicContact CD1-CD1 4.1Å; L65-L67 PolarHBondContact O-N 3.41Å | ||
| 68 | E | 83.4 | Confident | 83.2 | Confident | 192 Ų | 192 | 99.8 Ų | 99.8 | 90% | 0.897 | 52% | 0.52 | S | S | * | . | S | Bend | trans | -74.1 | -38 | 174 | -65.2 | -178.7 | 176.3 | 0 | 0 | 111.5 | ||
| 69 | T | 87 | Confident | 82 | Confident | 106 Ų | 106 | 103.2 Ų | 103.2 | 65% | 0.65 | 53% | 0.53 | S | S | * | . | S | Bend | trans | -137.7 | 154.7 | -179 | 54.9 | 0 | 0 | 0 | 0 | 110.5 | ||
| 70 | A | 86.9 | Confident | 80.8 | Confident | 71 Ų | 71 | 105.5 Ų | 105.5 | 59% | 0.587 | 54% | 0.538 | S | S | * | . | trans | -63.1 | 132.9 | 173.3 | 0 | 0 | 0 | 0 | 0 | 109.5 | L62 N72 | L62-A70 HydrophobicContact CD2-CB 4.46Å; A70-N72 PolarHBondContact O-N 3.2Å | ||
| 71 | P | 82.6 | Confident | 79.6 | Confident | 87 Ų | 87 | 106.7 Ų | 106.7 | 57% | 0.565 | 55% | 0.547 | S | S | * | . | trans | -62.9 | 126.7 | -179.1 | 24.1 | -31.9 | 0 | 0 | 0 | 110 | I73 | P71-I73 HydrophobicContact CB-CD1 4.12Å; P71-I73 HydrophobicContact CB-CG1 4.19Å; P71-I73 PolarHBondContact O-N 3.47Å | ||
| 72 | N | 82.9 | Confident | 78.4 | Confident | 170 Ų | 170 | 106.2 Ų | 106.2 | 91% | 0.909 | 54% | 0.544 | S | S | * | . | trans | -79.3 | 83.4 | -178.8 | -172.3 | 4.3 | 0 | 0 | 0 | 110.4 | A70 | A70-N72 PolarHBondContact O-N 3.2Š| ||
| 73 | I | 81 | Confident | 77.1 | Confident | 92 Ų | 92 | 106.5 Ų | 106.5 | 47% | 0.472 | 55% | 0.549 | S | S | . | . | trans | -125.3 | 123.1 | -179.6 | -48.6 | 176.1 | 0 | 0 | 0 | 108.9 | P71 A77 I78 | P71-I73 HydrophobicContact CB-CD1 4.12Å; P71-I73 HydrophobicContact CB-CG1 4.19Å; P71-I73 PolarHBondContact O-N 3.47Å; I73-A77 HydrophobicContact CG2-CB 3.9Å; I73-I78 HydrophobicContact CB-CG1 4.43Å; I73-I78 HydrophobicContact CG2-CD1 4.38Å; I73-I78 HydrophobicContact CG2-CG1 3.59Å | ||
| 74 | S | 80.3 | Confident | 75.8 | Confident | 68 Ų | 68 | 115.7 Ų | 115.7 | 48% | 0.476 | 58% | 0.576 | S | S | . | * | trans | -76.2 | 155.7 | 176.4 | 71.3 | 0 | 0 | 0 | 0 | 111.7 | D76 A77 I78 | S74-D76 PolarHBondContact O-N 2.99Å; S74-A77 WeakPolarHBondContact O-CB 3.15Å; S74-A77 PolarHBondContact O-N 3.16Å; S74-A77 VanDerWaalsContact O-N 3.13Å; S74-A77 WeakPolarHBondContact OG-CB 3.32Å; S74-A77 PolarHBondContact OG-N 3.49Å; S74-A77 VanDerWaalsContact OG-N 3.16Å; S74-I78 WeakPolarHBondContact O-CG1 3.4Å; S74-I78 PolarHBondContact O-N 3.26Å | ||
| 75 | K | 76.8 | Confident | 74.6 | Confident | 173 Ų | 173 | 112.4 Ų | 112.4 | 75% | 0.752 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -57.4 | -31.7 | 177.1 | -70.3 | -175.3 | 179.4 | -179.4 | 0 | 112.9 | R79 | K75-R79 WeakPolarHBondContact O-CG 3.05Å; K75-R79 PolarHBondContact O-N 3.25Å |
| 76 | D | 70.6 | Confident | 73.6 | Confident | 94 Ų | 94 | 111.5 Ų | 111.5 | 50% | 0.503 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -78.9 | -35.5 | 178.4 | -61.4 | -46.4 | 0 | 0 | 0 | 112.3 | S74 I78 R79 Q80 | S74-D76 PolarHBondContact O-N 2.99Å; D76-I78 VanDerWaalsContact C-N 3.29Å; D76-I78 PolarHBondContact O-N 2.97Å; D76-R79 PolarHBondContact O-N 3.37Å; D76-R79 IonicContact OD1-NH1 3.43Å; D76-Q80 WeakPolarHBondContact O-CG 3.33Å; D76-Q80 PolarHBondContact O-N 3.44Å; D76-Q80 VanDerWaalsContact O-N 3.09Å |
| 77 | A | 68.9 | Low | 72.7 | Confident | 26 Ų | 26 | 104.5 Ų | 104.5 | 22% | 0.215 | 54% | 0.542 | C | S | . | . | H | α-helix | trans | -61.6 | -40.5 | 169.5 | 0 | 0 | 0 | 0 | 0 | 110.7 | I73 S74 R79 Q80 L81 | I73-A77 HydrophobicContact CG2-CB 3.9Å; S74-A77 WeakPolarHBondContact O-CB 3.15Å; S74-A77 PolarHBondContact O-N 3.16Å; S74-A77 VanDerWaalsContact O-N 3.13Å; S74-A77 WeakPolarHBondContact OG-CB 3.32Å; S74-A77 PolarHBondContact OG-N 3.49Å; S74-A77 VanDerWaalsContact OG-N 3.16Å; A77-R79 VanDerWaalsContact C-N 3.33Å; A77-R79 PolarHBondContact O-N 2.91Å; A77-Q80 PolarHBondContact O-N 3.33Å; A77-L81 HydrophobicContact CB-CD1 4.24Å; A77-L81 WeakPolarHBondContact O-CB 3.08Å; A77-L81 WeakPolarHBondContact O-CG 3.1Å; A77-L81 PolarHBondContact O-N 2.95Å |
| 78 | I | 70.6 | Confident | 72 | Confident | 72 Ų | 72 | 102.3 Ų | 102.3 | 37% | 0.369 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -57.9 | -45 | 173.8 | -67.9 | 172 | 0 | 0 | 0 | 111 | I73 S74 D76 Q80 L81 L82 | I73-I78 HydrophobicContact CB-CG1 4.43Å; I73-I78 HydrophobicContact CG2-CD1 4.38Å; I73-I78 HydrophobicContact CG2-CG1 3.59Å; S74-I78 WeakPolarHBondContact O-CG1 3.4Å; S74-I78 PolarHBondContact O-N 3.26Å; D76-I78 VanDerWaalsContact C-N 3.29Å; D76-I78 PolarHBondContact O-N 2.97Å; I78-Q80 VanDerWaalsContact C-N 3.32Å; I78-Q80 PolarHBondContact O-N 3.35Å; I78-L81 PolarHBondContact O-N 3.09Å; I78-L82 HydrophobicContact CG2-CD1 3.3Å; I78-L82 HydrophobicContact CG2-CG 4.01Å; I78-L82 WeakPolarHBondContact O-CB 3.37Å; I78-L82 WeakPolarHBondContact O-CG 3.42Å; I78-L82 PolarHBondContact O-N 2.95Å |
| 79 | R | 66.6 | Low | 71.1 | Confident | 192 Ų | 192 | 101.7 Ų | 101.7 | 73% | 0.725 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -66.6 | -30.1 | 179.5 | -73.5 | 172.2 | 173.8 | 169.5 | -5.3 | 114 | K75 D76 A77 | K75-R79 WeakPolarHBondContact O-CG 3.05Å; K75-R79 PolarHBondContact O-N 3.25Å; D76-R79 PolarHBondContact O-N 3.37Å; D76-R79 IonicContact OD1-NH1 3.43Å; A77-R79 VanDerWaalsContact C-N 3.33Å; A77-R79 PolarHBondContact O-N 2.91Å |
| 80 | Q | 64.8 | Low | 70.3 | Confident | 165 Ų | 165 | 103.1 Ų | 103.1 | 77% | 0.771 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -83.6 | -38.1 | 178 | -69 | 178.4 | 7.6 | 0 | 0 | 112.1 | D76 A77 I78 | D76-Q80 WeakPolarHBondContact O-CG 3.33Å; D76-Q80 PolarHBondContact O-N 3.44Å; D76-Q80 VanDerWaalsContact O-N 3.09Å; A77-Q80 PolarHBondContact O-N 3.33Å; I78-Q80 VanDerWaalsContact C-N 3.32Å; I78-Q80 PolarHBondContact O-N 3.35Å |
| 81 | L | 62.9 | Low | 69.4 | Low | 118 Ų | 118 | 102 Ų | 102 | 62% | 0.618 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -87.6 | -26.7 | -174.6 | -64.6 | 172 | 0 | 0 | 0 | 113.3 | A77 I78 P83 | A77-L81 HydrophobicContact CB-CD1 4.24Å; A77-L81 WeakPolarHBondContact O-CB 3.08Å; A77-L81 WeakPolarHBondContact O-CG 3.1Å; A77-L81 PolarHBondContact O-N 2.95Å; I78-L81 PolarHBondContact O-N 3.09Å; L81-P83 WeakPolarHBondContact O-CD 3.33Å |
| 82 | L | 65.6 | Low | 68.8 | Low | 79 Ų | 79 | 102.5 Ų | 102.5 | 41% | 0.414 | 50% | 0.499 | S | S | . | . | S | Bend | trans | -78.6 | 108.2 | 171.7 | -75.2 | 175.2 | 0 | 0 | 0 | 109.1 | I78 R84 L88 | I78-L82 HydrophobicContact CG2-CD1 3.3Å; I78-L82 HydrophobicContact CG2-CG 4.01Å; I78-L82 WeakPolarHBondContact O-CB 3.37Å; I78-L82 WeakPolarHBondContact O-CG 3.42Å; I78-L82 PolarHBondContact O-N 2.95Å; L82-R84 PolarHBondContact O-N 3.38Å; L82-L88 HydrophobicContact CD2-CD1 4.01Å; L82-L88 HydrophobicContact CD2-CD2 3.79Å |
| 83 | P | 61.8 | Low | 68.2 | Low | 53 Ų | 53 | 98.5 Ų | 98.5 | 34% | 0.344 | 48% | 0.478 | S | S | . | . | trans | -62.3 | 141.3 | 171.1 | 28.2 | -34.3 | 0 | 0 | 0 | 108.6 | L81 A85 L88 M122 | L81-P83 WeakPolarHBondContact O-CD 3.33Å; P83-A85 HydrophobicContact CB-CB 4.31Å; P83-A85 HydrophobicContact CG-CB 4.3Å; P83-A85 PolarHBondContact O-N 3.36Å; P83-L88 HydrophobicContact CG-CD1 4.05Å; P83-M122 HydrophobicContact CG-CE 3.57Å; P83-M122 HydrophobicContact CG-SD 4.28Å | ||
| 84 | R | 61.2 | Low | 67.5 | Low | 246 Ų | 246 | 100 Ų | 100 | 93% | 0.928 | 48% | 0.483 | S | S | * | . | trans | -73.3 | 57.7 | 167.1 | -65 | -175.9 | -177.5 | -178.5 | 0.3 | 109.9 | L82 | L82-R84 PolarHBondContact O-N 3.38Š| ||
| 85 | A | 61.4 | Low | 66.9 | Low | 17 Ų | 17 | 103.2 Ų | 103.2 | 14% | 0.14 | 49% | 0.486 | C | S | . | . | trans | -85.7 | 133.2 | 177.6 | 0 | 0 | 0 | 0 | 0 | 108.5 | P83 P87 L88 R89 | P83-A85 HydrophobicContact CB-CB 4.31Å; P83-A85 HydrophobicContact CG-CB 4.3Å; P83-A85 PolarHBondContact O-N 3.36Å; A85-P87 VanDerWaalsContact C-N 3.33Å; A85-P87 HydrophobicContact CB-CG 4.06Å; A85-L88 WeakPolarHBondContact O-CB 3.33Å; A85-L88 PolarHBondContact O-N 2.93Å; A85-L88 VanDerWaalsContact O-N 3.08Å; A85-R89 PolarHBondContact O-N 3.4Å | ||
| 86 | P | 62.8 | Low | 66.1 | Low | 76 Ų | 76 | 101.3 Ų | 101.3 | 49% | 0.494 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -44 | -44.7 | 172.9 | -28.7 | 35.5 | 0 | 0 | 0 | 115.8 | L88 R89 E90 W158 | P86-L88 VanDerWaalsContact C-N 3.28Å; P86-L88 PolarHBondContact O-N 2.87Å; P86-R89 PolarHBondContact O-N 2.95Å; P86-R89 VanDerWaalsContact O-N 3.13Å; P86-E90 PolarHBondContact O-N 3.11Å; P86-W158 HydrophobicContact CB-CH2 4.29Å; P86-W158 HydrophobicContact CB-CZ3 4.07Å; P86-W158 HydrophobicContact CG-CZ3 3.94Å |
| 87 | P | 65.8 | Low | 65.4 | Low | 26 Ų | 26 | 102.1 Ų | 102.1 | 17% | 0.169 | 49% | 0.492 | C | S | . | . | H | α-helix | trans | -67.9 | -27.1 | -177.8 | 29 | -40.7 | 0 | 0 | 0 | 113.4 | A85 R89 L91 W158 | A85-P87 VanDerWaalsContact C-N 3.33Å; A85-P87 HydrophobicContact CB-CG 4.06Å; P87-R89 VanDerWaalsContact C-N 3.31Å; P87-L91 VanDerWaalsContact O-CG 3.28Å; P87-L91 WeakPolarHBondContact O-CG 3.47Å; P87-L91 PolarHBondContact O-N 2.74Å; P87-L91 VanDerWaalsContact O-N 3.13Å; P87-W158 HydrophobicContact CB-CZ2 3.99Å; P87-W158 HydrophobicContact CG-CD2 3.97Å; P87-W158 VanDerWaalsContact CG-CE2 3.49Å; P87-W158 HydrophobicContact CG-CG 4.44Å; P87-W158 HydrophobicContact CG-CH2 4.23Å; P87-W158 HydrophobicContact CG-CZ2 3.63Å |
| 88 | L | 67.3 | Low | 64.9 | Low | 26 Ų | 26 | 109 Ų | 109 | 14% | 0.136 | 52% | 0.52 | C | S | . | . | H | α-helix | trans | -73.9 | -31.6 | 178 | -129.1 | 154.4 | 0 | 0 | 0 | 110.4 | L82 P83 A85 P86 I92 I120 | L82-L88 HydrophobicContact CD2-CD1 4.01Å; L82-L88 HydrophobicContact CD2-CD2 3.79Å; P83-L88 HydrophobicContact CG-CD1 4.05Å; A85-L88 WeakPolarHBondContact O-CB 3.33Å; A85-L88 PolarHBondContact O-N 2.93Å; A85-L88 VanDerWaalsContact O-N 3.08Å; P86-L88 VanDerWaalsContact C-N 3.28Å; P86-L88 PolarHBondContact O-N 2.87Å; L88-I92 HydrophobicContact CD2-CD1 4.26Å; L88-I92 WeakPolarHBondContact O-CD1 3.21Å; L88-I92 VanDerWaalsContact O-CG1 3.24Å; L88-I92 WeakPolarHBondContact O-CG1 3.43Å; L88-I92 PolarHBondContact O-N 3.31Å; L88-I92 VanDerWaalsContact O-N 3.12Å; L88-I120 HydrophobicContact CD1-CD1 3.81Å; L88-I120 HydrophobicContact CG-CD1 3.72Å |
| 89 | R | 66.4 | Low | 64.1 | Low | 179 Ų | 179 | 114 Ų | 114 | 68% | 0.675 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -74.7 | -41.4 | 175.4 | -165.8 | 163.6 | -175.7 | 169.7 | -0.7 | 111.8 | A85 P86 P87 L91 I92 D93 | A85-R89 PolarHBondContact O-N 3.4Å; P86-R89 PolarHBondContact O-N 2.95Å; P86-R89 VanDerWaalsContact O-N 3.13Å; P87-R89 VanDerWaalsContact C-N 3.31Å; R89-L91 VanDerWaalsContact C-N 3.29Å; R89-L91 PolarHBondContact O-N 3.42Å; R89-I92 PolarHBondContact O-N 2.7Å; R89-I92 VanDerWaalsContact O-N 3.16Å; R89-D93 WeakPolarHBondContact O-CB 3.38Å; R89-D93 PolarHBondContact O-N 2.84Å |
| 90 | E | 68.3 | Low | 63.4 | Low | 135 Ų | 135 | 111.9 Ų | 111.9 | 63% | 0.631 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -57.8 | -41.9 | 171.9 | -74.7 | 173.3 | 178.5 | 0 | 0 | 111.9 | P86 D93 Q94 | P86-E90 PolarHBondContact O-N 3.11Å; E90-D93 PolarHBondContact O-N 2.87Å; E90-Q94 WeakPolarHBondContact O-CB 3.41Å; E90-Q94 PolarHBondContact O-N 3.13Å |
| 91 | L | 68.8 | Low | 63 | Low | 47 Ų | 47 | 108.8 Ų | 108.8 | 25% | 0.246 | 53% | 0.526 | C | S | . | . | H | α-helix | trans | -62.7 | -45.3 | 174.2 | -72.1 | 167.9 | 0 | 0 | 0 | 111.7 | P87 R89 Q94 Y95 T118 I120 | P87-L91 VanDerWaalsContact O-CG 3.28Å; P87-L91 WeakPolarHBondContact O-CG 3.47Å; P87-L91 PolarHBondContact O-N 2.74Å; P87-L91 VanDerWaalsContact O-N 3.13Å; R89-L91 VanDerWaalsContact C-N 3.29Å; R89-L91 PolarHBondContact O-N 3.42Å; L91-Q94 PolarHBondContact O-N 3.18Å; L91-Y95 VanDerWaalsContact O-CD2 3.22Å; L91-Y95 WeakPolarHBondContact O-CD2 3.31Å; L91-Y95 PolarHBondContact O-N 3.3Å; L91-T118 HydrophobicContact CD1-CG2 4.45Å; L91-I120 HydrophobicContact CD1-CD1 4.23Å |
| 92 | I | 71.1 | Confident | 62.6 | Low | 98 Ų | 98 | 108.6 Ų | 108.6 | 50% | 0.503 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -62.1 | -47.1 | 177.7 | -67.8 | 161.6 | 0 | 0 | 0 | 110.6 | L88 R89 Q94 Y95 D96 | L88-I92 HydrophobicContact CD2-CD1 4.26Å; L88-I92 WeakPolarHBondContact O-CD1 3.21Å; L88-I92 VanDerWaalsContact O-CG1 3.24Å; L88-I92 WeakPolarHBondContact O-CG1 3.43Å; L88-I92 PolarHBondContact O-N 3.31Å; L88-I92 VanDerWaalsContact O-N 3.12Å; R89-I92 PolarHBondContact O-N 2.7Å; R89-I92 VanDerWaalsContact O-N 3.16Å; I92-Q94 VanDerWaalsContact C-N 3.3Å; I92-Q94 PolarHBondContact O-N 2.86Å; I92-Y95 PolarHBondContact O-N 2.92Å; I92-D96 PolarHBondContact O-N 3.48Å |
| 93 | D | 68.8 | Low | 62.2 | Low | 87 Ų | 87 | 109.2 Ų | 109.2 | 47% | 0.465 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -65 | -33.7 | -177.9 | -66.7 | -11.9 | 0 | 0 | 0 | 111.4 | R89 E90 Y95 | R89-D93 WeakPolarHBondContact O-CB 3.38Å; R89-D93 PolarHBondContact O-N 2.84Å; E90-D93 PolarHBondContact O-N 2.87Å; D93-Y95 VanDerWaalsContact C-N 3.29Å; D93-Y95 PolarHBondContact O-N 2.86Å |
| 94 | Q | 67.4 | Low | 61.8 | Low | 124 Ų | 124 | 114.4 Ų | 114.4 | 58% | 0.579 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -63.7 | -32.5 | 175.7 | -175.9 | 178.6 | 3.9 | 0 | 0 | 113 | E90 L91 I92 | E90-Q94 WeakPolarHBondContact O-CB 3.41Å; E90-Q94 PolarHBondContact O-N 3.13Å; L91-Q94 PolarHBondContact O-N 3.18Å; I92-Q94 VanDerWaalsContact C-N 3.3Å; I92-Q94 PolarHBondContact O-N 2.86Å |
| 95 | Y | 66.3 | Low | 61.4 | Low | 134 Ų | 134 | 104.9 Ų | 104.9 | 53% | 0.525 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -102.3 | -7.3 | -176.4 | -71.2 | -76.7 | 0 | 0 | 0 | 114 | L91 I92 D93 V97 E117 | L91-Y95 VanDerWaalsContact O-CD2 3.22Å; L91-Y95 WeakPolarHBondContact O-CD2 3.31Å; L91-Y95 PolarHBondContact O-N 3.3Å; I92-Y95 PolarHBondContact O-N 2.92Å; D93-Y95 VanDerWaalsContact C-N 3.29Å; D93-Y95 PolarHBondContact O-N 2.86Å; Y95-V97 VanDerWaalsContact C-N 3.33Å; Y95-E117 PolarHBondContact OH-OE2 2.92Å; Y95-E117 VanDerWaalsContact OH-OE2 3.13Å |
| 96 | D | 61.9 | Low | 60.8 | Low | 134 Ų | 134 | 108.9 Ų | 108.9 | 72% | 0.717 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -77.6 | -20.7 | 174.5 | -158.4 | 30.7 | 0 | 0 | 0 | 112.2 | I92 Q98 | I92-D96 PolarHBondContact O-N 3.48Å; D96-Q98 PolarHBondContact O-N 3.44Å; D96-Q98 VanDerWaalsContact O-N 3.15Å |
| 97 | V | 56 | Low | 60.3 | Low | 111 Ų | 111 | 112.7 Ų | 112.7 | 67% | 0.673 | 59% | 0.591 | S | S | * | * | S | Bend | trans | -79.5 | 102.6 | 173.5 | -159.4 | 0 | 0 | 0 | 0 | 108.7 | Y95 R99 | Y95-V97 VanDerWaalsContact C-N 3.33Å; V97-R99 PolarHBondContact O-N 2.83Å |
| 98 | Q | 56.8 | Low | 59.7 | Low | 169 Ų | 169 | 118.4 Ų | 118.4 | 79% | 0.79 | 62% | 0.615 | S | S | * | * | trans | -41.2 | 102 | 177.9 | -166.4 | 156.9 | 7 | 0 | 0 | 111.9 | D96 D100 | D96-Q98 PolarHBondContact O-N 3.44Å; D96-Q98 VanDerWaalsContact O-N 3.15Å; Q98-D100 PolarHBondContact O-N 3.45Å | ||
| 99 | R | 54.2 | Low | 59.1 | Low | 178 Ų | 178 | 125.9 Ų | 125.9 | 67% | 0.672 | 66% | 0.655 | S | S | * | * | trans | -79.7 | 84.6 | -177.6 | -163.8 | 173.2 | -170.9 | 176 | 1.9 | 109.3 | V97 D101 | V97-R99 PolarHBondContact O-N 2.83Å; R99-D101 HydrophobicContact CG-CB 3.37Å; R99-D101 IonicContact CZ-OD2 3.52Å; R99-D101 IonicContact NE-OD2 3.93Å; R99-D101 PolarHBondContact NE-OD2 2.84Å; R99-D101 IonicContact NH2-OD2 3.48Å; R99-D101 PolarHBondContact NH2-OD2 3.45Å; R99-D101 PolarHBondContact O-N 3.28Å; R99-D101 VanDerWaalsContact O-N 3.12Å | ||
| 100 | D | 51.8 | Low | 58.6 | Low | 147 Ų | 147 | 124.1 Ų | 124.1 | 79% | 0.786 | 66% | 0.659 | S | S | * | * | trans | -76.4 | 34.8 | 158.4 | -79.5 | -9.8 | 0 | 0 | 0 | 110.6 | Q98 S102 | Q98-D100 PolarHBondContact O-N 3.45Å; D100-S102 PolarHBondContact O-N 3.16Å | ||
| 101 | D | 55.7 | Low | 58.3 | Low | 100 Ų | 100 | 121.8 Ų | 121.8 | 54% | 0.535 | 65% | 0.651 | S | S | . | * | trans | -89 | 105 | -179.5 | -159 | 17.3 | 0 | 0 | 0 | 107.7 | R99 S103 | R99-D101 HydrophobicContact CG-CB 3.37Å; R99-D101 IonicContact CZ-OD2 3.52Å; R99-D101 IonicContact NE-OD2 3.93Å; R99-D101 PolarHBondContact NE-OD2 2.84Å; R99-D101 IonicContact NH2-OD2 3.48Å; R99-D101 PolarHBondContact NH2-OD2 3.45Å; R99-D101 PolarHBondContact O-N 3.28Å; R99-D101 VanDerWaalsContact O-N 3.12Å; D101-S103 PolarHBondContact O-N 2.05Å | ||
| 102 | S | 55.6 | Low | 58.2 | Low | 115 Ų | 115 | 125.3 Ų | 125.3 | 80% | 0.804 | 66% | 0.662 | S | S | * | * | trans | -71.2 | 70.3 | 172.8 | 20.9 | 0 | 0 | 0 | 0 | 108.5 | D100 D104 | D100-S102 PolarHBondContact O-N 3.16Å; S102-D104 PolarHBondContact O-N 3.14Å | ||
| 103 | S | 56.8 | Low | 58.4 | Low | 91 Ų | 91 | 123.7 Ų | 123.7 | 64% | 0.636 | 65% | 0.652 | S | S | * | * | trans | -72.9 | 97.3 | 169.9 | 176.3 | 0 | 0 | 0 | 0 | 107.8 | D101 G105 | D101-S103 PolarHBondContact O-N 2.05Å; S103-G105 VanDerWaalsContact C-N 3.33Å; S103-G105 PolarHBondContact O-N 2.85Å | ||
| 104 | D | 54.1 | Low | 58.5 | Low | 163 Ų | 163 | 122.4 Ų | 122.4 | 87% | 0.872 | 65% | 0.654 | S | S | * | * | trans | -55.4 | 96 | 164.2 | -170.7 | 23.9 | 0 | 0 | 0 | 108.6 | S102 S106 | S102-D104 PolarHBondContact O-N 3.14Å; D104-S106 PolarHBondContact O-N 2.87Å | ||
| 105 | G | 53.3 | Low | 58.8 | Low | 46 Ų | 46 | 122 Ų | 122 | 47% | 0.474 | 66% | 0.66 | S | S | . | * | trans | -82 | 112.3 | -175.5 | 0 | 0 | 0 | 0 | 0 | 109.9 | S103 L107 | S103-G105 VanDerWaalsContact C-N 3.33Å; S103-G105 PolarHBondContact O-N 2.85Å; G105-L107 PolarHBondContact O-N 2.91Å | ||
| 106 | S | 48.4 | Very low | 59.1 | Low | 100 Ų | 100 | 120.7 Ų | 120.7 | 70% | 0.699 | 67% | 0.666 | S | S | * | * | trans | -64.3 | 104.3 | 161.6 | 65 | 0 | 0 | 0 | 0 | 107.8 | D104 E108 | D104-S106 PolarHBondContact O-N 2.87Å; S106-E108 PolarHBondContact O-N 2.7Å; S106-E108 VanDerWaalsContact O-N 3.09Å | ||
| 107 | L | 51.4 | Low | 59.8 | Low | 156 Ų | 156 | 121 Ų | 121 | 82% | 0.817 | 66% | 0.663 | S | S | * | * | trans | -67.3 | 104.2 | 178.3 | -60.9 | 170.8 | 0 | 0 | 0 | 108.6 | G105 | G105-L107 PolarHBondContact O-N 2.91Š| ||
| 108 | E | 53.2 | Low | 60.9 | Low | 146 Ų | 146 | 120 Ų | 120 | 68% | 0.682 | 66% | 0.657 | S | S | * | * | trans | -83.6 | 144.1 | 161.5 | -66.3 | -169.7 | 174.4 | 0 | 0 | 108.4 | S106 D110 D111 | S106-E108 PolarHBondContact O-N 2.7Å; S106-E108 VanDerWaalsContact O-N 3.09Å; E108-D110 PolarHBondContact O-N 2.83Å; E108-D111 PolarHBondContact N-OD2 3.03Å; E108-D111 WeakPolarHBondContact O-CB 3.47Å; E108-D111 PolarHBondContact O-N 3Å; E108-D111 VanDerWaalsContact O-N 3.09Å | ||
| 109 | D | 54.3 | Low | 62 | Low | 183 Ų | 183 | 116.3 Ų | 116.3 | 98% | 0.979 | 64% | 0.642 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.8 | -7 | -168.5 | -78 | -38 | 0 | 0 | 0 | 115.7 | ||
| 110 | D | 57.2 | Low | 63.4 | Low | 142 Ų | 142 | 111.8 Ų | 111.8 | 76% | 0.759 | 63% | 0.63 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.2 | 3.1 | -179.4 | -130.9 | -2.1 | 0 | 0 | 0 | 113.7 | E108 Y112 | E108-D110 PolarHBondContact O-N 2.83Å; D110-Y112 PolarHBondContact O-N 3.28Å; D110-Y112 VanDerWaalsContact O-N 3.13Å |
| 111 | D | 60.9 | Low | 64.9 | Low | 86 Ų | 86 | 106.9 Ų | 106.9 | 46% | 0.46 | 61% | 0.606 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -75.6 | 6.4 | -174.6 | -83 | -24.3 | 0 | 0 | 0 | 115.7 | E108 H113 | E108-D111 PolarHBondContact N-OD2 3.03Å; E108-D111 WeakPolarHBondContact O-CB 3.47Å; E108-D111 PolarHBondContact O-N 3Å; E108-D111 VanDerWaalsContact O-N 3.09Å; D111-H113 PolarHBondContact O-N 2.95Å |
| 112 | Y | 67.7 | Low | 66.1 | Low | 122 Ų | 122 | 106.3 Ų | 106.3 | 48% | 0.478 | 60% | 0.601 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -67 | -30.7 | 177.1 | -174.1 | -98.7 | 0 | 0 | 0 | 112 | S63 D110 | S63-Y112 PolarHBondContact OG-OH 3.38Å; S63-Y112 VanDerWaalsContact OG-OH 3.09Å; D110-Y112 PolarHBondContact O-N 3.28Å; D110-Y112 VanDerWaalsContact O-N 3.13Å |
| 113 | H | 75.3 | Confident | 67.4 | Low | 63 Ų | 63 | 103.8 Ų | 103.8 | 29% | 0.292 | 58% | 0.582 | S | S | . | * | S | Bend | trans | -100.3 | 149.1 | -178 | -66.4 | -66.1 | 0 | 0 | 0 | 112.5 | R66 D111 T115 | R66-H113 PolarHBondContact NE-CE1 2.89Å; R66-H113 VanDerWaalsContact NE-CE1 3.32Å; R66-H113 PolarHBondContact NE-ND1 3.1Å; R66-H113 VanDerWaalsContact NE-ND1 3.16Å; R66-H113 PolarHBondContact NH2-CD2 3.09Å; R66-H113 VanDerWaalsContact NH2-CG 3.35Å; R66-H113 PolarHBondContact NH2-NE2 3.41Å; D111-H113 PolarHBondContact O-N 2.95Å; H113-T115 PolarHBondContact O-N 3.07Å |
| 114 | A | 71.2 | Confident | 68.4 | Low | 61 Ų | 61 | 102.6 Ų | 102.6 | 50% | 0.504 | 57% | 0.571 | S | S | . | * | P | Polyproline II helix | trans | -65.9 | 130.5 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||
| 115 | T | 72.4 | Confident | 69 | Low | 115 Ų | 115 | 103.7 Ų | 103.7 | 71% | 0.706 | 57% | 0.571 | S | S | * | * | P | Polyproline II helix | trans | -79.1 | 130.6 | 173 | -58.5 | 0 | 0 | 0 | 0 | 109.9 | H113 | H113-T115 PolarHBondContact O-N 3.07Š|
| 116 | T | 73.1 | Confident | 69.3 | Low | 106 Ų | 106 | 103.6 Ų | 103.6 | 65% | 0.65 | 56% | 0.563 | S | S | * | * | trans | -86 | 114 | 178 | -55.8 | 0 | 0 | 0 | 0 | 110.1 | I119 | T116-I119 HydrophobicContact CG2-CD1 4.23Å; T116-I119 HydrophobicContact CG2-CG1 3.69Å | ||
| 117 | E | 76.3 | Confident | 69.5 | Low | 142 Ų | 142 | 106.5 Ų | 106.5 | 66% | 0.664 | 57% | 0.57 | S | S | * | * | trans | -88.1 | -47.5 | 178.4 | -62.3 | -178.9 | 163.1 | 0 | 0 | 112.5 | Y95 | Y95-E117 PolarHBondContact OH-OE2 2.92Å; Y95-E117 VanDerWaalsContact OH-OE2 3.13Å | ||
| 118 | T | 78.4 | Confident | 69.6 | Low | 89 Ų | 89 | 107 Ų | 107 | 55% | 0.546 | 57% | 0.566 | S | S | . | * | trans | -134.5 | 136.2 | -175.5 | -61.5 | 0 | 0 | 0 | 0 | 111.2 | L91 I120 | L91-T118 HydrophobicContact CD1-CG2 4.45Å; T118-I120 HydrophobicContact CG2-CG1 4.43Å | ||
| 119 | I | 81.4 | Confident | 69.2 | Low | 91 Ų | 91 | 107.4 Ų | 107.4 | 47% | 0.467 | 57% | 0.572 | S | S | . | * | trans | -113.5 | 121.5 | 178.6 | -56.3 | 175.2 | 0 | 0 | 0 | 109.1 | T116 I147 | T116-I119 HydrophobicContact CG2-CD1 4.23Å; T116-I119 HydrophobicContact CG2-CG1 3.69Å; I119-I147 HydrophobicContact CD1-CD1 3.52Å; I119-I147 HydrophobicContact CD1-CG1 3.74Å; I119-I147 HydrophobicContact CG2-CD1 4.39Å | ||
| 120 | I | 82.3 | Confident | 69 | Low | 83 Ų | 83 | 107.3 Ų | 107.3 | 43% | 0.426 | 57% | 0.568 | S | S | . | * | trans | -107.1 | 120.4 | 173.5 | -57.9 | 178.4 | 0 | 0 | 0 | 107.8 | L88 L91 T118 M122 | L88-I120 HydrophobicContact CD1-CD1 3.81Å; L88-I120 HydrophobicContact CG-CD1 3.72Å; L91-I120 HydrophobicContact CD1-CD1 4.23Å; T118-I120 HydrophobicContact CG2-CG1 4.43Å; I120-M122 HydrophobicContact CG2-CE 3.8Å | ||
| 121 | T | 82.9 | Confident | 68.4 | Low | 44 Ų | 44 | 108.4 Ų | 108.4 | 27% | 0.27 | 57% | 0.569 | S | S | . | * | trans | -120.3 | 125.9 | -178.3 | -55 | 0 | 0 | 0 | 0 | 110.2 | F141 F143 | T121-F141 HydrophobicContact CG2-CD1 4.45Å; T121-F143 HydrophobicContact CG2-CE1 4.25Å; T121-F143 WeakPolarHBondContact OG1-CE1 3.26Å | ||
| 122 | M | 82.3 | Confident | 67.5 | Low | 89 Ų | 89 | 108.4 Ų | 108.4 | 44% | 0.438 | 58% | 0.581 | S | S | . | * | P | Polyproline II helix | trans | -84.8 | 154.4 | 174.1 | -56.5 | -52.8 | 168.8 | 0 | 0 | 110.6 | P83 I120 T124 | P83-M122 HydrophobicContact CG-CE 3.57Å; P83-M122 HydrophobicContact CG-SD 4.28Å; I120-M122 HydrophobicContact CG2-CE 3.8Å; M122-T124 PolarHBondContact O-N 2.92Å |
| 123 | P | 83 | Confident | 66.6 | Low | 61 Ų | 61 | 109.4 Ų | 109.4 | 40% | 0.396 | 59% | 0.594 | S | S | . | * | P | Polyproline II helix | trans | -53.6 | 131.5 | 171.3 | -25.2 | 35 | 0 | 0 | 0 | 111.1 | C139 F141 | P123-C139 HydrophobicContact CB-CB 3.9Å; P123-C139 HydrophobicContact CG-CB 3.95Å; P123-F141 HydrophobicContact CG-CE1 3.94Å; P123-F141 HydrophobicContact CG-CZ 4.16Å |
| 124 | T | 77.3 | Confident | 65.5 | Low | 67 Ų | 67 | 110.4 Ų | 110.4 | 41% | 0.411 | 62% | 0.622 | S | S | . | * | B | Isolated β-bridge | trans | -77.5 | 131.5 | 171.1 | -47.7 | 0 | 0 | 0 | 0 | 108.6 | M122 S126 F140 | M122-T124 PolarHBondContact O-N 2.92Å; T124-S126 PolarHBondContact O-N 3.28Å; T124-F140 PolarHBondContact N-O 3.3Å |
| 125 | E | 66.5 | Low | 64.6 | Low | 186 Ų | 186 | 115.5 Ų | 115.5 | 87% | 0.869 | 63% | 0.633 | S | S | * | * | P | Polyproline II helix | trans | -61.2 | 124.6 | 170.1 | -62.8 | -168.7 | 172.9 | 0 | 0 | 108.4 | ||
| 126 | S | 60.1 | Low | 63.8 | Low | 43 Ų | 43 | 115.8 Ų | 115.8 | 30% | 0.301 | 64% | 0.637 | S | S | . | * | P | Polyproline II helix | trans | -84 | 130.8 | 179.1 | 63.2 | 0 | 0 | 0 | 0 | 109.9 | T124 F128 | T124-S126 PolarHBondContact O-N 3.28Å; S126-F128 PolarHBondContact O-N 2.95Å |
| 127 | D | 53.3 | Low | 63.4 | Low | 162 Ų | 162 | 117 Ų | 117 | 87% | 0.866 | 63% | 0.633 | S | S | * | * | S | Bend | trans | -58.9 | -6.5 | 168.7 | -70.9 | -33.9 | 0 | 0 | 0 | 113.7 | L129 | D127-L129 PolarHBondContact O-N 3.34Š|
| 128 | F | 52.5 | Low | 63 | Low | 166 Ų | 166 | 114.1 Ų | 114.1 | 73% | 0.728 | 63% | 0.628 | S | S | * | * | trans | -71.4 | 68.7 | 167.8 | -60.5 | -69.4 | 0 | 0 | 0 | 110.1 | S126 M130 | S126-F128 PolarHBondContact O-N 2.95Å; F128-M130 PolarHBondContact O-N 3.46Å; F128-M130 VanDerWaalsContact O-N 3.11Å | ||
| 129 | L | 45.6 | Very low | 62.9 | Low | 154 Ų | 154 | 112.8 Ų | 112.8 | 81% | 0.806 | 62% | 0.621 | S | S | * | * | trans | -47.1 | 117.3 | 158.4 | -78 | 167.7 | 0 | 0 | 0 | 108 | D127 | D127-L129 PolarHBondContact O-N 3.34Š| ||
| 130 | M | 49.8 | Very low | 62.9 | Low | 182 Ų | 182 | 112.8 Ų | 112.8 | 90% | 0.897 | 62% | 0.618 | S | S | * | * | trans | 36 | 93 | 155.9 | -64.6 | -171 | 172.1 | 0 | 0 | 115.7 | F128 | F128-M130 PolarHBondContact O-N 3.46Å; F128-M130 VanDerWaalsContact O-N 3.11Å | ||
| 131 | Q | 43.9 | Very low | 63 | Low | 164 Ų | 164 | 112.6 Ų | 112.6 | 77% | 0.766 | 61% | 0.614 | S | S | * | * | trans | -148.1 | 130 | 146.3 | -141.1 | 171.7 | 36 | 0 | 0 | 115.2 | K137 | Q131-K137 PolarHBondContact O-NZ 2.92Å; Q131-K137 VanDerWaalsContact O-NZ 3.13Å | ||
| 132 | A | 42.3 | Very low | 62.9 | Low | 87 Ų | 87 | 118.4 Ų | 118.4 | 72% | 0.719 | 64% | 0.636 | S | S | * | * | S | Bend | trans | 69.6 | 116.4 | 165.4 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||
| 133 | D | 49.6 | Very low | 62.9 | Low | 142 Ų | 142 | 119.8 Ų | 119.8 | 76% | 0.759 | 64% | 0.64 | S | S | * | * | S | Bend | trans | 94 | 21.4 | 154.4 | -144.6 | 34.2 | 0 | 0 | 0 | 119.5 | K135 | D133-K135 PolarHBondContact O-N 3.32Š|
| 134 | G | 50.9 | Low | 62.6 | Low | 85 Ų | 85 | 120.2 Ų | 120.2 | 88% | 0.876 | 64% | 0.644 | S | S | * | * | S | Bend | trans | 69.4 | 3.4 | 163.5 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||
| 135 | K | 52.9 | Low | 62.2 | Low | 167 Ų | 167 | 123 Ų | 123 | 73% | 0.726 | 67% | 0.666 | S | S | * | * | trans | -102.5 | 124.2 | 174.3 | -64.3 | 178.1 | -174.2 | 174.2 | 0 | 110.2 | D133 K137 | D133-K135 PolarHBondContact O-N 3.32Å; K135-K137 PolarHBondContact O-N 3.06Å | ||
| 136 | P | 54.8 | Low | 62.5 | Low | 121 Ų | 121 | 122.7 Ų | 122.7 | 79% | 0.786 | 66% | 0.662 | S | S | * | * | trans | -65.5 | 123.7 | 177.8 | 25.9 | -32.1 | 0 | 0 | 0 | 110 | C138 | P136-C138 PolarHBondContact O-N 2.93Š| ||
| 137 | K | 64.6 | Low | 63.2 | Low | 132 Ų | 132 | 123.5 Ų | 123.5 | 57% | 0.574 | 66% | 0.662 | S | S | * | * | trans | -74.8 | 61.6 | 172.5 | -73.4 | 174.4 | 176.4 | 160 | 0 | 110.5 | Q131 K135 | Q131-K137 PolarHBondContact O-NZ 2.92Å; Q131-K137 VanDerWaalsContact O-NZ 3.13Å; K135-K137 PolarHBondContact O-N 3.06Å | ||
| 138 | C | 67.8 | Low | 64.2 | Low | 82 Ų | 82 | 120.5 Ų | 120.5 | 55% | 0.554 | 64% | 0.643 | S | S | * | * | trans | -87 | 151.9 | 159 | -164.4 | 0 | 0 | 0 | 0 | 107.7 | P136 | P136-C138 PolarHBondContact O-N 2.93Š| ||
| 139 | C | 77.4 | Confident | 65.4 | Low | 61 Ų | 61 | 122.5 Ų | 122.5 | 41% | 0.412 | 65% | 0.647 | S | S | . | * | cis | -138 | 130 | 5 | -55.6 | 0 | 0 | 0 | 0 | 108.3 | P123 F141 | P123-C139 HydrophobicContact CB-CB 3.9Å; P123-C139 HydrophobicContact CG-CB 3.95Å; C139-F141 HydrophobicContact CB-CE2 3.95Å; C139-F141 HydrophobicContact CB-CZ 4.03Å | ||
| 140 | F | 80.4 | Confident | 67 | Low | 90 Ų | 90 | 120.4 Ų | 120.4 | 40% | 0.395 | 64% | 0.636 | S | S | . | * | B | Isolated β-bridge | trans | -102.2 | 130.1 | 175.5 | -66.7 | -88.2 | 0 | 0 | 0 | 109.3 | T124 L177 | T124-F140 PolarHBondContact N-O 3.3Å; F140-L177 HydrophobicContact CE1-CD1 4.38Å; F140-L177 HydrophobicContact CZ-CD1 4.12Å |
| 141 | F | 84.8 | Confident | 68.6 | Low | 79 Ų | 79 | 119.1 Ų | 119.1 | 35% | 0.346 | 63% | 0.626 | S | S | . | * | trans | -108.7 | 113.9 | 177.2 | -60.3 | -83.4 | 0 | 0 | 0 | 108.6 | T121 P123 C139 F143 L157 | T121-F141 HydrophobicContact CG2-CD1 4.45Å; P123-F141 HydrophobicContact CG-CE1 3.94Å; P123-F141 HydrophobicContact CG-CZ 4.16Å; C139-F141 HydrophobicContact CB-CE2 3.95Å; C139-F141 HydrophobicContact CB-CZ 4.03Å; F141-F143 HydrophobicContact CB-CD2 4.29Å; F141-F143 HydrophobicContact CB-CE2 3.61Å; F141-F143 HydrophobicContact CB-CZ 4.09Å; F141-L157 HydrophobicContact CE2-CD1 4.11Å; F141-L157 HydrophobicContact CZ-CD1 3.71Å | ||
| 142 | K | 81.2 | Confident | 70.5 | Confident | 166 Ų | 166 | 115 Ų | 115 | 72% | 0.722 | 61% | 0.612 | S | S | * | * | trans | -97.1 | 108 | 174.2 | -170.9 | 176.5 | -179.3 | -179.7 | 0 | 109.1 | ||||
| 143 | F | 81.6 | Confident | 72.6 | Confident | 119 Ų | 119 | 118 Ų | 118 | 52% | 0.522 | 62% | 0.621 | S | S | . | * | trans | -90 | 145.6 | 173.2 | -67.2 | -78.1 | 0 | 0 | 0 | 110.3 | T121 F141 I147 | T121-F143 HydrophobicContact CG2-CE1 4.25Å; T121-F143 WeakPolarHBondContact OG1-CE1 3.26Å; F141-F143 HydrophobicContact CB-CD2 4.29Å; F141-F143 HydrophobicContact CB-CE2 3.61Å; F141-F143 HydrophobicContact CB-CZ 4.09Å; F143-I147 HydrophobicContact CB-CD1 4.14Å; F143-I147 HydrophobicContact CD1-CD1 3.76Å; F143-I147 HydrophobicContact CG-CD1 4.39Å | ||
| 144 | S | 76.6 | Confident | 74.3 | Confident | 70 Ų | 70 | 118.4 Ų | 118.4 | 49% | 0.49 | 62% | 0.616 | S | S | . | * | trans | -69.8 | 148.1 | 172 | 82.5 | 0 | 0 | 0 | 0 | 110.3 | K146 I147 | S144-K146 PolarHBondContact O-N 3.38Å; S144-I147 PolarHBondContact O-N 3.33Å | ||
| 145 | S | 70.6 | Confident | 76 | Confident | 124 Ų | 124 | 118.7 Ų | 118.7 | 87% | 0.867 | 61% | 0.61 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.9 | -7.9 | 177.2 | 52.5 | 0 | 0 | 0 | 0 | 114.1 | I147 | S145-I147 VanDerWaalsContact C-N 3.27Å; S145-I147 PolarHBondContact O-N 3Å |
| 146 | K | 71.8 | Confident | 77.6 | Confident | 181 Ų | 181 | 116 Ų | 116 | 79% | 0.787 | 60% | 0.6 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.1 | -16.5 | 176.9 | -62.8 | 179.7 | -180 | 179.3 | 0 | 112.8 | S144 Q148 | S144-K146 PolarHBondContact O-N 3.38Å; K146-Q148 PolarHBondContact O-N 3.33Å |
| 147 | I | 75.4 | Confident | 79.1 | Confident | 59 Ų | 59 | 114.7 Ų | 114.7 | 30% | 0.303 | 59% | 0.586 | S | S | . | * | trans | -83.5 | 110 | 179.1 | -56.8 | 173 | 0 | 0 | 0 | 108.3 | I119 F143 S144 S145 V152 | I119-I147 HydrophobicContact CD1-CD1 3.52Å; I119-I147 HydrophobicContact CD1-CG1 3.74Å; I119-I147 HydrophobicContact CG2-CD1 4.39Å; F143-I147 HydrophobicContact CB-CD1 4.14Å; F143-I147 HydrophobicContact CD1-CD1 3.76Å; F143-I147 HydrophobicContact CG-CD1 4.39Å; S144-I147 PolarHBondContact O-N 3.33Å; S145-I147 VanDerWaalsContact C-N 3.27Å; S145-I147 PolarHBondContact O-N 3Å; I147-V152 HydrophobicContact CG2-CG2 4.41Å | ||
| 148 | Q | 74.1 | Confident | 80.1 | Confident | 99 Ų | 99 | 114.5 Ų | 114.5 | 46% | 0.463 | 58% | 0.581 | S | S | . | * | trans | -86.1 | 130.6 | 175.2 | -53.7 | 178.7 | -14.2 | 0 | 0 | 109.6 | K146 N150 K151 | K146-Q148 PolarHBondContact O-N 3.33Å; Q148-N150 WeakPolarHBondContact CB-OD1 3.38Å; Q148-N150 PolarHBondContact O-N 3.42Å; Q148-K151 HydrophobicContact CB-CG 4.42Å; Q148-K151 PolarHBondContact O-N 3.07Å; Q148-K151 VanDerWaalsContact O-N 3.15Å; Q148-K151 VanDerWaalsContact OE1-CE 3.31Å | ||
| 149 | Y | 77.2 | Confident | 80.9 | Confident | 209 Ų | 209 | 115.1 Ų | 115.1 | 82% | 0.82 | 58% | 0.578 | S | S | * | * | G | 310 helix | trans | -61.8 | -31.4 | -176 | 63.3 | -90.6 | 0 | 0 | 0 | 113.1 | K151 V152 | Y149-K151 PolarHBondContact O-N 2.87Å; Y149-V152 PolarHBondContact O-N 3.1Å |
| 150 | N | 80.4 | Confident | 81.2 | Confident | 109 Ų | 109 | 120.8 Ų | 120.8 | 58% | 0.583 | 59% | 0.592 | S | S | * | * | G | 310 helix | trans | -70.6 | -15.6 | 179.8 | 63.9 | -33.5 | 0 | 0 | 0 | 113.6 | Q148 | Q148-N150 WeakPolarHBondContact CB-OD1 3.38Å; Q148-N150 PolarHBondContact O-N 3.42Å |
| 151 | K | 83.1 | Confident | 81.4 | Confident | 156 Ų | 156 | 121.1 Ų | 121.1 | 68% | 0.678 | 60% | 0.598 | S | S | * | * | G | 310 helix | trans | -93.6 | -1.7 | 176.3 | -64.3 | -170.7 | 175.6 | -171.4 | 0 | 113 | Q148 Y149 V153 | Q148-K151 HydrophobicContact CB-CG 4.42Å; Q148-K151 PolarHBondContact O-N 3.07Å; Q148-K151 VanDerWaalsContact O-N 3.15Å; Q148-K151 VanDerWaalsContact OE1-CE 3.31Å; Y149-K151 PolarHBondContact O-N 2.87Å; K151-V153 PolarHBondContact O-N 3.28Å |
| 152 | V | 83.2 | Confident | 81.3 | Confident | 78 Ų | 78 | 127.3 Ų | 127.3 | 47% | 0.473 | 62% | 0.619 | S | S | . | * | trans | -82.9 | 108.7 | -177.6 | -178 | 0 | 0 | 0 | 0 | 109.8 | I147 Y149 A155 | I147-V152 HydrophobicContact CG2-CG2 4.41Å; Y149-V152 PolarHBondContact O-N 3.1Å; V152-A155 HydrophobicContact CG1-CB 4.43Å | ||
| 153 | V | 86.3 | Confident | 81.4 | Confident | 148 Ų | 148 | 124.8 Ų | 124.8 | 90% | 0.897 | 62% | 0.619 | S | S | * | * | trans | -79.3 | -40.7 | 176.4 | -179 | 0 | 0 | 0 | 0 | 111.6 | K151 | K151-V153 PolarHBondContact O-N 3.28Š| ||
| 154 | K | 84.8 | Confident | 81.7 | Confident | 152 Ų | 152 | 123.2 Ų | 123.2 | 66% | 0.661 | 62% | 0.619 | S | S | * | * | trans | -151.1 | 140.6 | -174.5 | -172.4 | 176.6 | 177.9 | -171.4 | 0 | 110.9 | Q156 | K154-Q156 HydrophobicContact CG-CG 4.37Š| ||
| 155 | A | 87.3 | Confident | 82.1 | Confident | 90 Ų | 90 | 130.3 Ų | 130.3 | 74% | 0.744 | 64% | 0.641 | S | S | * | * | trans | -134.5 | 129.3 | 174.4 | 0 | 0 | 0 | 0 | 0 | 110.2 | V152 | V152-A155 HydrophobicContact CG1-CB 4.43Š| ||
| 156 | Q | 85.3 | Confident | 83 | Confident | 111 Ų | 111 | 128.7 Ų | 128.7 | 52% | 0.519 | 63% | 0.626 | S | S | . | * | trans | -134.6 | 136 | -179.2 | -68.4 | -175 | -34.6 | 0 | 0 | 110.3 | K154 W158 | K154-Q156 HydrophobicContact CG-CG 4.37Å; Q156-W158 VanDerWaalsContact OE1-CZ2 3.28Å | ||
| 157 | L | 87.8 | Confident | 83.7 | Confident | 94 Ų | 94 | 126.6 Ų | 126.6 | 49% | 0.492 | 63% | 0.631 | S | S | . | * | trans | -98.5 | 122.5 | 172.8 | 178.3 | 63 | 0 | 0 | 0 | 109.4 | F141 I159 I174 | F141-L157 HydrophobicContact CE2-CD1 4.11Å; F141-L157 HydrophobicContact CZ-CD1 3.71Å; L157-I159 HydrophobicContact CD2-CD1 4.36Å; L157-I159 HydrophobicContact CG-CG1 4.3Å; L157-I174 HydrophobicContact CD2-CD1 4.34Å; L157-I174 HydrophobicContact CD2-CG2 4.07Å | ||
| 158 | W | 84.5 | Confident | 84.4 | Confident | 128 Ų | 128 | 127.6 Ų | 127.6 | 49% | 0.485 | 64% | 0.64 | S | S | . | * | trans | -102.4 | 127.8 | 179.5 | -63.9 | 86.4 | 0 | 0 | 0 | 110.3 | P86 P87 Q156 | P86-W158 HydrophobicContact CB-CH2 4.29Å; P86-W158 HydrophobicContact CB-CZ3 4.07Å; P86-W158 HydrophobicContact CG-CZ3 3.94Å; P87-W158 HydrophobicContact CB-CZ2 3.99Å; P87-W158 HydrophobicContact CG-CD2 3.97Å; P87-W158 VanDerWaalsContact CG-CE2 3.49Å; P87-W158 HydrophobicContact CG-CG 4.44Å; P87-W158 HydrophobicContact CG-CH2 4.23Å; P87-W158 HydrophobicContact CG-CZ2 3.63Å; Q156-W158 VanDerWaalsContact OE1-CZ2 3.28Å | ||
| 159 | I | 85.1 | Confident | 85.1 | Confident | 95 Ų | 95 | 128.5 Ų | 128.5 | 49% | 0.487 | 65% | 0.652 | S | S | . | * | trans | -123.5 | 130.2 | 177.8 | -57.1 | 176.8 | 0 | 0 | 0 | 108.1 | L157 L161 V172 I174 | L157-I159 HydrophobicContact CD2-CD1 4.36Å; L157-I159 HydrophobicContact CG-CG1 4.3Å; I159-L161 HydrophobicContact CG2-CD2 4.47Å; I159-V172 HydrophobicContact CD1-CG1 4.19Å; I159-I174 HydrophobicContact CD1-CD1 3.95Å; I159-I174 HydrophobicContact CD1-CG1 4Å | ||
| 160 | Y | 83.6 | Confident | 85.6 | Confident | 179 Ų | 179 | 122.5 Ų | 122.5 | 70% | 0.702 | 64% | 0.637 | S | S | * | * | P | Polyproline II helix | trans | -98 | 116.9 | 177 | -179.8 | -107.8 | 0 | 0 | 0 | 110.7 | R162 | Y160-R162 HydrophobicContact CD1-CG 4.26Å; Y160-R162 HydrophobicContact CE1-CG 3.96Å |
| 161 | L | 84.1 | Confident | 85.9 | Confident | 98 Ų | 98 | 126.2 Ų | 126.2 | 51% | 0.513 | 65% | 0.649 | S | S | . | * | P | Polyproline II helix | trans | -88.4 | 121.8 | 172.2 | -60 | -179.5 | 0 | 0 | 0 | 109.1 | I159 V170 V172 | I159-L161 HydrophobicContact CG2-CD2 4.47Å; L161-V170 HydrophobicContact CD2-CG1 4.34Å; L161-V172 HydrophobicContact CD1-CG2 4.21Å; L161-V172 HydrophobicContact CD2-CG2 3.95Å |
| 162 | R | 83.2 | Confident | 86.1 | Confident | 209 Ų | 209 | 122.7 Ų | 122.7 | 79% | 0.789 | 64% | 0.64 | S | S | * | * | P | Polyproline II helix | trans | -69 | 144.7 | 177.7 | -73.5 | -171.6 | -69.7 | -169.9 | -2.4 | 110.6 | Y160 V164 | Y160-R162 HydrophobicContact CD1-CG 4.26Å; Y160-R162 HydrophobicContact CE1-CG 3.96Å; R162-V164 PolarHBondContact O-N 3.45Å |
| 163 | P | 83.9 | Confident | 86.2 | Confident | 112 Ų | 112 | 126.3 Ų | 126.3 | 73% | 0.727 | 65% | 0.652 | S | S | * | * | P | Polyproline II helix | trans | -61.9 | 136.1 | 176 | 26.1 | -33.6 | 0 | 0 | 0 | 110.5 | ||
| 164 | V | 86.4 | Confident | 86.2 | Confident | 86 Ų | 86 | 124.7 Ų | 124.7 | 52% | 0.521 | 64% | 0.637 | S | S | . | * | P | Polyproline II helix | trans | -102 | 144.4 | 177.6 | -70.7 | 0 | 0 | 0 | 0 | 109.9 | R162 T166 | R162-V164 PolarHBondContact O-N 3.45Å; V164-T166 VanDerWaalsContact C-N 3.3Å; V164-T166 WeakPolarHBondContact CG2-O 3.3Å; V164-T166 PolarHBondContact O-N 3.43Å |
| 165 | K | 86.8 | Confident | 86.1 | Confident | 219 Ų | 219 | 123.5 Ų | 123.5 | 95% | 0.952 | 64% | 0.637 | S | S | * | * | S | Bend | trans | -70.2 | -28.7 | -179.5 | -66.3 | -176.9 | 179.4 | -178.6 | 0 | 112.7 | ||
| 166 | T | 88.9 | Confident | 86 | Confident | 90 Ų | 90 | 129.8 Ų | 129.8 | 55% | 0.552 | 64% | 0.641 | S | S | * | * | S | Bend | trans | -120.5 | 144.8 | 178.9 | 51.4 | 0 | 0 | 0 | 0 | 109.6 | V164 T168 | V164-T166 VanDerWaalsContact C-N 3.3Å; V164-T166 WeakPolarHBondContact CG2-O 3.3Å; V164-T166 PolarHBondContact O-N 3.43Å; T166-T168 PolarHBondContact O-N 3.23Å |
| 167 | P | 86.2 | Confident | 85.7 | Confident | 138 Ų | 138 | 131 Ų | 131 | 90% | 0.896 | 65% | 0.651 | S | S | * | * | trans | -64 | 112.9 | 178.3 | 26.4 | -32.6 | 0 | 0 | 0 | 109 | ||||
| 168 | T | 89.7 | Confident | 85.4 | Confident | 79 Ų | 79 | 132.8 Ų | 132.8 | 49% | 0.485 | 66% | 0.66 | S | S | . | * | trans | -132.4 | 143.1 | 179.4 | 50 | 0 | 0 | 0 | 0 | 109.6 | T166 | T166-T168 PolarHBondContact O-N 3.23Š| ||
| 169 | T | 88.9 | Confident | 84.9 | Confident | 118 Ų | 118 | 136.1 Ų | 136.1 | 72% | 0.724 | 68% | 0.678 | S | S | * | * | trans | -81.2 | 123.3 | 174.3 | -53.4 | 0 | 0 | 0 | 0 | 109 | F171 | T169-F171 HydrophobicContact CG2-CE2 4.03Å; T169-F171 HydrophobicContact CG2-CZ 4Å | ||
| 170 | V | 88.2 | Confident | 84.1 | Confident | 83 Ų | 83 | 137.4 Ų | 137.4 | 50% | 0.503 | 69% | 0.692 | S | S | . | * | trans | -105.6 | 119.6 | 178.8 | -178.7 | 0 | 0 | 0 | 0 | 109.2 | L161 V172 | L161-V170 HydrophobicContact CD2-CG1 4.34Å; V170-V172 HydrophobicContact CG1-CG2 4.09Å | ||
| 171 | F | 86.8 | Confident | 82.6 | Confident | 188 Ų | 188 | 134.5 Ų | 134.5 | 83% | 0.825 | 69% | 0.686 | S | S | * | * | trans | -91.6 | 118.9 | 172.3 | -65.4 | -82 | 0 | 0 | 0 | 109.7 | T169 | T169-F171 HydrophobicContact CG2-CE2 4.03Å; T169-F171 HydrophobicContact CG2-CZ 4Å | ||
| 172 | V | 87.1 | Confident | 81.4 | Confident | 81 Ų | 81 | 139.8 Ų | 139.8 | 49% | 0.491 | 71% | 0.705 | S | S | . | * | trans | -107.2 | 123.8 | 177.9 | -176 | 0 | 0 | 0 | 0 | 108.8 | I159 L161 V170 | I159-V172 HydrophobicContact CD1-CG1 4.19Å; L161-V172 HydrophobicContact CD1-CG2 4.21Å; L161-V172 HydrophobicContact CD2-CG2 3.95Å; V170-V172 HydrophobicContact CG1-CG2 4.09Å | ||
| 173 | Q | 85.4 | Confident | 80 | Confident | 155 Ų | 155 | 136 Ų | 136 | 72% | 0.724 | 70% | 0.701 | S | S | * | * | trans | -119.7 | 127.9 | 175.1 | -166.3 | 179.3 | 17.2 | 0 | 0 | 109.6 | L175 | Q173-L175 HydrophobicContact CG-CD1 4.4Å; Q173-L175 HydrophobicContact CG-CD2 4.27Å; Q173-L175 HydrophobicContact CG-CG 4.1Å | ||
| 174 | I | 86 | Confident | 78.7 | Confident | 114 Ų | 114 | 134.7 Ų | 134.7 | 59% | 0.585 | 71% | 0.707 | S | S | * | * | trans | -107 | 124.2 | 177.5 | -58.8 | 168.8 | 0 | 0 | 0 | 107.5 | L157 I159 | L157-I174 HydrophobicContact CD2-CD1 4.34Å; L157-I174 HydrophobicContact CD2-CG2 4.07Å; I159-I174 HydrophobicContact CD1-CD1 3.95Å; I159-I174 HydrophobicContact CD1-CG1 4Å | ||
| 175 | L | 83.9 | Confident | 77.1 | Confident | 126 Ų | 126 | 135.7 Ų | 135.7 | 66% | 0.66 | 71% | 0.714 | S | S | * | * | trans | -126.9 | 139.1 | -176.4 | -65.6 | 164.1 | 0 | 0 | 0 | 109.5 | Q173 | Q173-L175 HydrophobicContact CG-CD1 4.4Å; Q173-L175 HydrophobicContact CG-CD2 4.27Å; Q173-L175 HydrophobicContact CG-CG 4.1Å | ||
| 176 | R | 83.3 | Confident | 75.4 | Confident | 222 Ų | 222 | 136.7 Ų | 136.7 | 84% | 0.838 | 71% | 0.711 | S | S | * | * | trans | -88.7 | 119.7 | 172 | -177.2 | 178.9 | 177.6 | 178.5 | -0.2 | 109.3 | I178 | R176-I178 HydrophobicContact CG-CG2 4.37Å; R176-I178 PolarHBondContact O-N 3.15Å | ||
| 177 | L | 79.9 | Confident | 73.5 | Confident | 137 Ų | 137 | 139.2 Ų | 139.2 | 72% | 0.717 | 72% | 0.72 | S | S | * | * | trans | -72.5 | 110.8 | 171.2 | -64.7 | 174.9 | 0 | 0 | 0 | 109.4 | F140 | F140-L177 HydrophobicContact CE1-CD1 4.38Å; F140-L177 HydrophobicContact CZ-CD1 4.12Å | ||
| 178 | I | 81.1 | Confident | 71.8 | Confident | 132 Ų | 132 | 138 Ų | 138 | 68% | 0.677 | 71% | 0.712 | S | S | * | * | P | Polyproline II helix | trans | -99.2 | 146 | 169.5 | 57.3 | 174.1 | 0 | 0 | 0 | 108.9 | R176 | R176-I178 HydrophobicContact CG-CG2 4.37Å; R176-I178 PolarHBondContact O-N 3.15Å |
| 179 | K | 74.6 | Confident | 69.5 | Low | 198 Ų | 198 | 147.8 Ų | 147.8 | 86% | 0.861 | 75% | 0.749 | S | S | * | * | P | Polyproline II helix | trans | -59.8 | 131.1 | 171.7 | -70.7 | -178.7 | -179.6 | 178.1 | 0 | 107.7 | M181 | K179-M181 PolarHBondContact O-N 3.44Š|
| 180 | P | 67.4 | Low | 68.6 | Low | 122 Ų | 122 | 149.3 Ų | 149.3 | 79% | 0.792 | 75% | 0.75 | S | S | * | * | P | Polyproline II helix | trans | -59.1 | 119.5 | 178.5 | 22.7 | -30.9 | 0 | 0 | 0 | 108.3 | K182 | P180-K182 PolarHBondContact O-N 3.45Š|
| 181 | M | 52.2 | Low | 67.5 | Low | 117 Ų | 117 | 152.7 Ų | 152.7 | 58% | 0.576 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -66.1 | 126.6 | 176.6 | -142.2 | 159.3 | 85.2 | 0 | 0 | 107 | K179 D183 T185 | K179-M181 PolarHBondContact O-N 3.44Å; M181-D183 WeakPolarHBondContact CE-O 3.32Å; M181-D183 PolarHBondContact O-N 3.11Å; M181-D183 VanDerWaalsContact O-N 3.09Å; M181-T185 WeakPolarHBondContact CE-O 3.49Å |
| 182 | K | 60.2 | Low | 66.5 | Low | 209 Ų | 209 | 150.8 Ų | 150.8 | 91% | 0.909 | 76% | 0.759 | S | S | * | * | S | Bend | trans | -66.6 | -3.5 | 178.4 | -89.4 | -173.8 | 173.2 | -176.4 | 0 | 113.7 | P180 | P180-K182 PolarHBondContact O-N 3.45Š|
| 183 | D | 53.5 | Low | 65.3 | Low | 131 Ų | 131 | 154.9 Ų | 154.9 | 70% | 0.701 | 78% | 0.775 | S | S | * | * | S | Bend | trans | -147.2 | 106.1 | 175.9 | -98.6 | -39 | 0 | 0 | 0 | 112.4 | M181 T185 | M181-D183 WeakPolarHBondContact CE-O 3.32Å; M181-D183 PolarHBondContact O-N 3.11Å; M181-D183 VanDerWaalsContact O-N 3.09Å; D183-T185 PolarHBondContact O-N 2.96Å |
| 184 | G | 55.5 | Low | 64 | Low | 84 Ų | 84 | 154.9 Ų | 154.9 | 87% | 0.866 | 78% | 0.778 | S | S | * | * | trans | 48.4 | -7.5 | 131.5 | 0 | 0 | 0 | 0 | 0 | 123.9 | ||||
| 185 | T | 53.1 | Low | 62.5 | Low | 107 Ų | 107 | 157.6 Ų | 157.6 | 66% | 0.656 | 79% | 0.791 | S | S | * | * | trans | -106.2 | 110 | -171.8 | -45.4 | 0 | 0 | 0 | 0 | 110.9 | M181 D183 | M181-T185 WeakPolarHBondContact CE-O 3.49Å; D183-T185 PolarHBondContact O-N 2.96Å | ||
| 186 | R | 51.3 | Low | 61 | Low | 239 Ų | 239 | 159.9 Ų | 159.9 | 90% | 0.902 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -71.3 | 128.6 | 172.7 | -64.1 | 178.5 | 177 | 176.9 | -1.3 | 108.9 | ||
| 187 | I | 50.3 | Low | 59.3 | Low | 143 Ų | 143 | 155.1 Ų | 155.1 | 73% | 0.733 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -85.8 | 130.7 | 167.8 | -41.9 | 179.2 | 0 | 0 | 0 | 107.1 | ||
| 188 | P | 50 | Low | 57.6 | Low | 113 Ų | 113 | 156.6 Ų | 156.6 | 73% | 0.734 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -67.5 | 147.8 | 173.5 | 30.1 | -32.5 | 0 | 0 | 0 | 109.7 | ||
| 189 | F | 41.9 | Very low | 55.5 | Low | 284 Ų | 284 | 158.8 Ų | 158.8 | 100% | 1.246 | 82% | 0.816 | S | S | * | * | trans | -58.5 | 0 | 175.4 | -67.8 | -87.6 | 0 | 0 | 0 | 112.4 |
Retrieved 189 of 189 residues in 344.4 ms
(Link to these results)