| 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 | 36.2 | Very low | 48.9 | Very low | 243 Ų | 243 | 164.8 Ų | 164.8 | 100% | 1.197 | 75% | 0.753 | S | S | * | * | 0 | 139.4 | 0 | -75.2 | 169.7 | 165.6 | 0 | 0 | 108.5 | |||||
| 2 | Y | 37.1 | Very low | 50.5 | Low | 222 Ų | 222 | 157.3 Ų | 157.3 | 87% | 0.871 | 73% | 0.728 | S | S | * | * | trans | -82.4 | 142.9 | 176.6 | -75.9 | -101.1 | 0 | 0 | 0 | 110.6 | ||||
| 3 | H | 38.8 | Very low | 52.1 | Low | 184 Ų | 184 | 155.5 Ų | 155.5 | 85% | 0.852 | 72% | 0.717 | S | S | * | * | trans | -136.8 | 82.7 | 165.3 | -114.9 | -63.3 | 0 | 0 | 0 | 110.3 | K5 | H3-K5 PolarHBondContact O-N 3.34Š| ||
| 4 | I | 42.4 | Very low | 53.5 | Low | 133 Ų | 133 | 155.5 Ų | 155.5 | 68% | 0.682 | 72% | 0.715 | S | S | * | * | trans | -72.3 | 117.9 | 169.1 | -64.1 | 172.3 | 0 | 0 | 0 | 107.4 | F6 | I4-F6 PolarHBondContact O-N 3.38Š| ||
| 5 | K | 49.2 | Very low | 54.8 | Low | 172 Ų | 172 | 152.1 Ų | 152.1 | 75% | 0.748 | 70% | 0.703 | S | S | * | * | trans | -79.7 | 107.6 | 173.1 | -72.9 | -173.9 | 177.3 | -179.2 | 0 | 109.5 | H3 Y7 | H3-K5 PolarHBondContact O-N 3.34Å; K5-Y7 PolarHBondContact O-N 3.28Å | ||
| 6 | F | 45.7 | Very low | 56 | Low | 193 Ų | 193 | 147.4 Ų | 147.4 | 85% | 0.846 | 68% | 0.684 | S | S | * | * | P | Polyproline II helix | trans | -62.6 | 119.4 | 164.1 | -83.6 | -97.9 | 0 | 0 | 0 | 109.5 | I4 | I4-F6 PolarHBondContact O-N 3.38Š|
| 7 | Y | 49.5 | Very low | 56.8 | Low | 170 Ų | 170 | 142.4 Ų | 142.4 | 67% | 0.667 | 67% | 0.669 | S | S | * | * | P | Polyproline II helix | trans | -79.4 | 139.6 | 165.1 | -79 | -92.2 | 0 | 0 | 0 | 109.3 | K5 T11 | K5-Y7 PolarHBondContact O-N 3.28Å; Y7-T11 HydrophobicContact CD1-CG2 4.37Å |
| 8 | P | 57.2 | Low | 57.8 | Low | 83 Ų | 83 | 139.6 Ų | 139.6 | 54% | 0.539 | 66% | 0.658 | S | S | . | * | P | Polyproline II helix | trans | -67.7 | 144.9 | -179.9 | 28 | -33.6 | 0 | 0 | 0 | 111 | R10 T11 | P8-R10 PolarHBondContact O-N 2.86Å; P8-T11 WeakPolarHBondContact O-CB 3.44Å; P8-T11 PolarHBondContact O-N 3Å |
| 9 | I | 59 | Low | 58.5 | Low | 138 Ų | 138 | 137.9 Ų | 137.9 | 71% | 0.708 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -53.3 | -32.3 | -173 | -64.8 | 167.2 | 0 | 0 | 0 | 112.7 | T11 V12 F13 | I9-T11 VanDerWaalsContact C-N 3.3Å; I9-T11 PolarHBondContact O-N 2.79Å; I9-V12 PolarHBondContact O-N 3.46Å; I9-F13 HydrophobicContact CG2-CD2 4.37Å; I9-F13 PolarHBondContact O-N 2.98Å |
| 10 | R | 58.1 | Low | 59.1 | Low | 217 Ų | 217 | 137.6 Ų | 137.6 | 82% | 0.819 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -58.3 | -35.2 | 174.4 | -77.1 | -175.2 | 169.9 | -178.7 | -3.2 | 113.8 | P8 F14 | P8-R10 PolarHBondContact O-N 2.86Å; R10-F14 PolarHBondContact O-N 3.33Å |
| 11 | T | 65.2 | Low | 59.6 | Low | 58 Ų | 58 | 136.1 Ų | 136.1 | 36% | 0.356 | 65% | 0.647 | S | S | . | * | H | α-helix | trans | -71 | -37.9 | 178.3 | -52.2 | 0 | 0 | 0 | 0 | 111.4 | Y7 P8 I9 F14 L15 | Y7-T11 HydrophobicContact CD1-CG2 4.37Å; P8-T11 WeakPolarHBondContact O-CB 3.44Å; P8-T11 PolarHBondContact O-N 3Å; I9-T11 VanDerWaalsContact C-N 3.3Å; I9-T11 PolarHBondContact O-N 2.79Å; T11-F14 PolarHBondContact O-N 3Å; T11-L15 PolarHBondContact O-N 2.91Å |
| 12 | V | 67.2 | Low | 61.3 | Low | 74 Ų | 74 | 128.8 Ų | 128.8 | 45% | 0.448 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -66.2 | -44.4 | 175 | -176.6 | 0 | 0 | 0 | 0 | 110.4 | I9 F14 L15 I16 | I9-V12 PolarHBondContact O-N 3.46Å; V12-F14 PolarHBondContact O-N 2.98Å; V12-L15 PolarHBondContact O-N 3.26Å; V12-I16 HydrophobicContact CG1-CD1 3.99Å; V12-I16 WeakPolarHBondContact O-CG1 3.36Å; V12-I16 PolarHBondContact O-N 3.22Å |
| 13 | F | 71.2 | Confident | 62.7 | Low | 135 Ų | 135 | 124 Ų | 124 | 59% | 0.592 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -59.8 | -43.5 | 174.1 | -114.3 | -88.4 | 0 | 0 | 0 | 112.5 | I9 L15 I16 C17 | I9-F13 HydrophobicContact CG2-CD2 4.37Å; I9-F13 PolarHBondContact O-N 2.98Å; F13-L15 PolarHBondContact O-N 2.89Å; F13-I16 PolarHBondContact O-N 3.27Å; F13-C17 PolarHBondContact O-N 3.06Å; F13-C17 PolarHBondContact O-SG 3.44Å; F13-C17 VanDerWaalsContact O-SG 3.37Å |
| 14 | F | 72.7 | Confident | 63.8 | Low | 155 Ų | 155 | 117.2 Ų | 117.2 | 68% | 0.68 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -61 | -41.1 | 176.1 | -111.2 | -89.6 | 0 | 0 | 0 | 112.7 | R10 T11 V12 C17 L18 | R10-F14 PolarHBondContact O-N 3.33Å; T11-F14 PolarHBondContact O-N 3Å; V12-F14 PolarHBondContact O-N 2.98Å; F14-C17 PolarHBondContact O-N 3.41Å; F14-L18 WeakPolarHBondContact O-CB 3.47Å; F14-L18 PolarHBondContact O-N 3.37Å |
| 15 | L | 72.3 | Confident | 64.8 | Low | 104 Ų | 104 | 116.1 Ų | 116.1 | 55% | 0.545 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -64.8 | -41.4 | 175.3 | -82 | 161.7 | 0 | 0 | 0 | 112.3 | T11 V12 F13 L18 L19 | T11-L15 PolarHBondContact O-N 2.91Å; V12-L15 PolarHBondContact O-N 3.26Å; F13-L15 PolarHBondContact O-N 2.89Å; L15-L18 PolarHBondContact O-N 3.43Å; L15-L19 WeakPolarHBondContact O-CG 3.38Å; L15-L19 PolarHBondContact O-N 3.23Å |
| 16 | I | 74.3 | Confident | 65.3 | Low | 77 Ų | 77 | 116.1 Ų | 116.1 | 40% | 0.395 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -63.7 | -44.2 | 175.7 | -67.4 | 167.3 | 0 | 0 | 0 | 110.6 | V12 F13 L19 H20 | V12-I16 HydrophobicContact CG1-CD1 3.99Å; V12-I16 WeakPolarHBondContact O-CG1 3.36Å; V12-I16 PolarHBondContact O-N 3.22Å; F13-I16 PolarHBondContact O-N 3.27Å; I16-L19 PolarHBondContact O-N 2.95Å; I16-H20 PolarHBondContact O-N 2.97Å; I16-H20 PolarHBondContact O-ND1 3.33Å |
| 17 | C | 70.1 | Confident | 66.1 | Low | 63 Ų | 63 | 111.1 Ų | 111.1 | 43% | 0.426 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -63.4 | -39.3 | 175 | -69.7 | 0 | 0 | 0 | 0 | 112.4 | F13 F14 H20 L21 | F13-C17 PolarHBondContact O-N 3.06Å; F13-C17 PolarHBondContact O-SG 3.44Å; F13-C17 VanDerWaalsContact O-SG 3.37Å; F14-C17 PolarHBondContact O-N 3.41Å; C17-H20 PolarHBondContact O-N 3.32Å; C17-L21 PolarHBondContact O-N 3.46Å |
| 18 | L | 74.4 | Confident | 66.6 | Low | 92 Ų | 92 | 111.5 Ų | 111.5 | 48% | 0.482 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -61.9 | -44 | 174.6 | -128.9 | 77.8 | 0 | 0 | 0 | 111.5 | F14 L15 H20 L21 I22 | F14-L18 WeakPolarHBondContact O-CB 3.47Å; F14-L18 PolarHBondContact O-N 3.37Å; L15-L18 PolarHBondContact O-N 3.43Å; L18-H20 VanDerWaalsContact C-N 3.34Å; L18-H20 PolarHBondContact O-N 3.26Å; L18-L21 PolarHBondContact O-N 2.89Å; L18-I22 WeakPolarHBondContact O-CB 3.24Å; L18-I22 WeakPolarHBondContact O-CD1 3.45Å; L18-I22 VanDerWaalsContact O-CG1 3.24Å; L18-I22 WeakPolarHBondContact O-CG1 3.5Å; L18-I22 PolarHBondContact O-N 3.33Å |
| 19 | L | 71.1 | Confident | 66.6 | Low | 108 Ų | 108 | 115.9 Ų | 115.9 | 57% | 0.565 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -62.3 | -39.8 | 176.6 | -75.1 | 164.7 | 0 | 0 | 0 | 112.1 | L15 I16 I22 Q23 | L15-L19 WeakPolarHBondContact O-CG 3.38Å; L15-L19 PolarHBondContact O-N 3.23Å; I16-L19 PolarHBondContact O-N 2.95Å; L19-I22 PolarHBondContact O-N 3.02Å; L19-Q23 VanDerWaalsContact O-CG 3.32Å; L19-Q23 WeakPolarHBondContact O-CG 3.32Å; L19-Q23 PolarHBondContact O-N 2.81Å |
| 20 | H | 70.1 | Confident | 66.2 | Low | 130 Ų | 130 | 115.1 Ų | 115.1 | 60% | 0.602 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -67.8 | -37.6 | 175.3 | -75.5 | 69.3 | 0 | 0 | 0 | 112.4 | I16 C17 L18 Q23 A24 | I16-H20 PolarHBondContact O-N 2.97Å; I16-H20 PolarHBondContact O-ND1 3.33Å; C17-H20 PolarHBondContact O-N 3.32Å; L18-H20 VanDerWaalsContact C-N 3.34Å; L18-H20 PolarHBondContact O-N 3.26Å; H20-Q23 PolarHBondContact O-N 3.46Å; H20-A24 WeakPolarHBondContact O-CB 3.36Å; H20-A24 PolarHBondContact O-N 3.15Å |
| 21 | L | 69.9 | Low | 65.8 | Low | 108 Ų | 108 | 112.5 Ų | 112.5 | 57% | 0.565 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -63.8 | -44.6 | 172.5 | -83.7 | 159.8 | 0 | 0 | 0 | 111.9 | C17 L18 Q23 A24 E25 | C17-L21 PolarHBondContact O-N 3.46Å; L18-L21 PolarHBondContact O-N 2.89Å; L21-Q23 VanDerWaalsContact C-N 3.35Å; L21-Q23 PolarHBondContact O-N 3.49Å; L21-A24 PolarHBondContact O-N 2.97Å; L21-E25 PolarHBondContact O-N 2.98Å |
| 22 | I | 72.9 | Confident | 64.9 | Low | 88 Ų | 88 | 119.2 Ų | 119.2 | 45% | 0.451 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -64.5 | -38.3 | 178.3 | -68.5 | 162.3 | 0 | 0 | 0 | 111.4 | L18 L19 R26 | L18-I22 WeakPolarHBondContact O-CB 3.24Å; L18-I22 WeakPolarHBondContact O-CD1 3.45Å; L18-I22 VanDerWaalsContact O-CG1 3.24Å; L18-I22 WeakPolarHBondContact O-CG1 3.5Å; L18-I22 PolarHBondContact O-N 3.33Å; L19-I22 PolarHBondContact O-N 3.02Å; I22-R26 PolarHBondContact O-N 3.42Å |
| 23 | Q | 65.2 | Low | 63.7 | Low | 121 Ų | 121 | 123.3 Ų | 123.3 | 57% | 0.565 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -64.1 | -47.3 | 171.5 | -72.9 | -72.7 | 9.8 | 0 | 0 | 111.5 | L19 H20 L21 E25 R26 V27 | L19-Q23 VanDerWaalsContact O-CG 3.32Å; L19-Q23 WeakPolarHBondContact O-CG 3.32Å; L19-Q23 PolarHBondContact O-N 2.81Å; H20-Q23 PolarHBondContact O-N 3.46Å; L21-Q23 VanDerWaalsContact C-N 3.35Å; L21-Q23 PolarHBondContact O-N 3.49Å; Q23-E25 VanDerWaalsContact C-N 3.32Å; Q23-E25 PolarHBondContact O-N 2.94Å; Q23-R26 PolarHBondContact O-N 3.22Å; Q23-V27 WeakPolarHBondContact O-CG2 3.43Å; Q23-V27 PolarHBondContact O-N 2.99Å |
| 24 | A | 63 | Low | 62.3 | Low | 42 Ų | 42 | 121 Ų | 121 | 35% | 0.347 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -61.8 | -37.3 | 178 | 0 | 0 | 0 | 0 | 0 | 112.8 | H20 L21 R28 | H20-A24 WeakPolarHBondContact O-CB 3.36Å; H20-A24 PolarHBondContact O-N 3.15Å; L21-A24 PolarHBondContact O-N 2.97Å; A24-R28 WeakPolarHBondContact O-CB 3.31Å; A24-R28 VanDerWaalsContact O-CG 3.31Å; A24-R28 WeakPolarHBondContact O-CG 3.49Å; A24-R28 PolarHBondContact O-N 3.32Å |
| 25 | E | 62.1 | Low | 60.5 | Low | 111 Ų | 111 | 121.3 Ų | 121.3 | 52% | 0.519 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -70.1 | -36.6 | 173.8 | -73.2 | -152.2 | 127 | 0 | 0 | 113 | L21 Q23 R28 R29 | L21-E25 PolarHBondContact O-N 2.98Å; Q23-E25 VanDerWaalsContact C-N 3.32Å; Q23-E25 PolarHBondContact O-N 2.94Å; E25-R28 PolarHBondContact O-N 3Å; E25-R29 WeakPolarHBondContact O-CG 3.48Å; E25-R29 PolarHBondContact O-N 2.85Å |
| 26 | R | 59.5 | Low | 58.6 | Low | 172 Ų | 172 | 123.5 Ų | 123.5 | 65% | 0.649 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -60.5 | -45.9 | 171.8 | -86.5 | -174.2 | 166.4 | -165.9 | -4.5 | 111.7 | I22 Q23 R28 R29 L30 | I22-R26 PolarHBondContact O-N 3.42Å; Q23-R26 PolarHBondContact O-N 3.22Å; R26-R28 VanDerWaalsContact C-N 3.34Å; R26-R28 PolarHBondContact O-N 3.46Å; R26-R29 PolarHBondContact O-N 3.18Å; R26-L30 PolarHBondContact O-N 3.33Å |
| 27 | V | 62.6 | Low | 56.8 | Low | 87 Ų | 87 | 126.2 Ų | 126.2 | 53% | 0.527 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -63.5 | -38.8 | 176.5 | 176.2 | 0 | 0 | 0 | 0 | 111.5 | Q23 K31 | Q23-V27 WeakPolarHBondContact O-CG2 3.43Å; Q23-V27 PolarHBondContact O-N 2.99Å; V27-K31 PolarHBondContact O-N 3.03Å |
| 28 | R | 61 | Low | 55.3 | Low | 179 Ų | 179 | 129.2 Ų | 129.2 | 68% | 0.675 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -67.3 | -35.8 | 174.3 | -74.6 | 175.1 | -179.4 | -175.6 | 1.1 | 113.3 | A24 E25 R26 R32 | A24-R28 WeakPolarHBondContact O-CB 3.31Å; A24-R28 VanDerWaalsContact O-CG 3.31Å; A24-R28 WeakPolarHBondContact O-CG 3.49Å; A24-R28 PolarHBondContact O-N 3.32Å; E25-R28 PolarHBondContact O-N 3Å; R26-R28 VanDerWaalsContact C-N 3.34Å; R26-R28 PolarHBondContact O-N 3.46Å; R28-R32 WeakPolarHBondContact O-CG 3.46Å; R28-R32 PolarHBondContact O-N 3.03Å |
| 29 | R | 56.8 | Low | 53.3 | Low | 174 Ų | 174 | 130.7 Ų | 130.7 | 66% | 0.657 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -69.5 | -43 | 174.6 | -74.5 | -173.6 | -174.2 | -148 | 2.9 | 111.7 | E25 R26 K31 R32 Q33 | E25-R29 WeakPolarHBondContact O-CG 3.48Å; E25-R29 PolarHBondContact O-N 2.85Å; R26-R29 PolarHBondContact O-N 3.18Å; R29-K31 PolarHBondContact O-N 3.18Å; R29-R32 PolarHBondContact O-N 3.38Å; R29-R32 VanDerWaalsContact O-N 3.13Å; R29-Q33 PolarHBondContact O-N 2.94Å; R29-Q33 VanDerWaalsContact O-N 3.13Å |
| 30 | L | 50.7 | Low | 51.8 | Low | 122 Ų | 122 | 131.3 Ų | 131.3 | 64% | 0.639 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -60.8 | -44 | 176 | -77.9 | 164.8 | 0 | 0 | 0 | 112.1 | R26 R32 Q33 | R26-L30 PolarHBondContact O-N 3.33Å; L30-R32 VanDerWaalsContact C-N 3.3Å; L30-R32 PolarHBondContact O-N 3.36Å; L30-Q33 PolarHBondContact O-N 3.4Å |
| 31 | K | 48.5 | Very low | 50 | Low | 163 Ų | 163 | 128.5 Ų | 128.5 | 71% | 0.709 | 67% | 0.673 | S | S | * | * | H | α-helix | trans | -61.5 | -34.6 | 173.5 | -84 | -160.8 | 168 | -166.1 | 0 | 113.6 | V27 R29 Q33 A34 | V27-K31 PolarHBondContact O-N 3.03Å; R29-K31 PolarHBondContact O-N 3.18Å; K31-Q33 VanDerWaalsContact C-N 3.32Å; K31-Q33 PolarHBondContact O-N 3.18Å; K31-A34 PolarHBondContact O-N 2.86Å |
| 32 | R | 48.2 | Very low | 48.4 | Very low | 198 Ų | 198 | 130.3 Ų | 130.3 | 75% | 0.747 | 69% | 0.689 | S | S | * | * | H | α-helix | trans | -78.6 | -7.7 | 177.1 | -74.9 | -175.3 | 175.9 | -165.7 | -1.8 | 115 | R28 R29 L30 | R28-R32 WeakPolarHBondContact O-CG 3.46Å; R28-R32 PolarHBondContact O-N 3.03Å; R29-R32 PolarHBondContact O-N 3.38Å; R29-R32 VanDerWaalsContact O-N 3.13Å; L30-R32 VanDerWaalsContact C-N 3.3Å; L30-R32 PolarHBondContact O-N 3.36Å |
| 33 | Q | 41.9 | Very low | 46.6 | Very low | 160 Ų | 160 | 135.8 Ų | 135.8 | 75% | 0.748 | 71% | 0.709 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98 | 6.6 | 173 | -68.3 | -173 | -68.5 | 0 | 0 | 112.8 | R29 L30 K31 | R29-Q33 PolarHBondContact O-N 2.94Å; R29-Q33 VanDerWaalsContact O-N 3.13Å; L30-Q33 PolarHBondContact O-N 3.4Å; K31-Q33 VanDerWaalsContact C-N 3.32Å; K31-Q33 PolarHBondContact O-N 3.18Å |
| 34 | A | 40.4 | Very low | 44.8 | Very low | 87 Ų | 87 | 133.4 Ų | 133.4 | 72% | 0.719 | 72% | 0.717 | S | S | * | * | S | Bend | trans | -104 | 0.1 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | K31 | K31-A34 PolarHBondContact O-N 2.86Š|
| 35 | E | 35.2 | Very low | 43.6 | Very low | 162 Ų | 162 | 137.4 Ų | 137.4 | 76% | 0.757 | 74% | 0.739 | S | S | * | * | S | Bend | trans | -112 | 3.4 | -172.5 | -65.4 | -179.6 | 132.4 | 0 | 0 | 113.7 | ||
| 36 | D | 33.6 | Very low | 42.4 | Very low | 149 Ų | 149 | 136.7 Ų | 136.7 | 80% | 0.797 | 75% | 0.753 | S | S | * | * | trans | -122.7 | 67 | -170.6 | -122.2 | -30 | 0 | 0 | 0 | 112.9 | ||||
| 37 | V | 35.7 | Very low | 41.2 | Very low | 135 Ų | 135 | 134.1 Ų | 134.1 | 82% | 0.818 | 76% | 0.758 | S | S | * | * | trans | -136.9 | 117.6 | 162.5 | -177.7 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 38 | P | 37.8 | Very low | 39.7 | Very low | 125 Ų | 125 | 140.3 Ų | 140.3 | 81% | 0.812 | 78% | 0.778 | S | S | * | * | trans | -77.8 | 139.6 | -169.3 | 29.6 | -35.3 | 0 | 0 | 0 | 113.7 | ||||
| 39 | S | 32.8 | Very low | 38.2 | Very low | 124 Ų | 124 | 135.2 Ų | 135.2 | 87% | 0.867 | 78% | 0.781 | S | S | * | * | trans | -83.1 | 127 | 173.9 | 179 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 40 | S | 39 | Very low | 37.1 | Very low | 120 Ų | 120 | 133 Ų | 133 | 84% | 0.839 | 79% | 0.786 | S | S | * | * | trans | -128.5 | 97 | 164.7 | 65.3 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 41 | G | 33.9 | Very low | 36 | Very low | 71 Ų | 71 | 132.3 Ų | 132.3 | 73% | 0.732 | 79% | 0.787 | S | S | * | * | trans | -90.5 | 142.5 | -174.9 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 42 | V | 36.4 | Very low | 35.3 | Very low | 146 Ų | 146 | 130.7 Ų | 130.7 | 89% | 0.885 | 79% | 0.791 | S | S | * | * | trans | -127.2 | 142.9 | 159.1 | -178.1 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 43 | K | 33.6 | Very low | 34.2 | Very low | 204 Ų | 204 | 130 Ų | 130 | 89% | 0.887 | 79% | 0.79 | S | S | * | * | trans | -72.8 | 148.4 | -177.4 | -66.1 | 175.9 | 179 | 175.7 | 0 | 111 | ||||
| 44 | G | 29.2 | Very low | 33.8 | Very low | 70 Ų | 70 | 134.1 Ų | 134.1 | 72% | 0.722 | 80% | 0.799 | S | S | * | * | trans | -74 | -156.2 | -180 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 45 | P | 36.5 | Very low | 33.3 | Very low | 127 Ų | 127 | 135.6 Ų | 135.6 | 83% | 0.825 | 80% | 0.799 | S | S | * | * | cis | -110.2 | 176.4 | 22.5 | 40.9 | -34.6 | 0 | 0 | 0 | 115 | ||||
| 46 | A | 36.7 | Very low | 33.2 | Very low | 96 Ų | 96 | 131.2 Ų | 131.2 | 79% | 0.793 | 80% | 0.797 | S | S | * | * | trans | -69.2 | 149.2 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 47 | P | 35.8 | Very low | 33 | Very low | 117 Ų | 117 | 128.7 Ų | 128.7 | 76% | 0.76 | 80% | 0.796 | S | S | * | * | -137.3 | 152.8 | 112 | 37.7 | -27.6 | 0 | 0 | 0 | 115.4 | |||||
| 48 | F | 30.8 | Very low | 32.8 | Very low | 218 Ų | 218 | 131 Ų | 131 | 96% | 0.956 | 80% | 0.801 | S | S | * | * | trans | -6.9 | 128.9 | 167.7 | -60.2 | -89 | 0 | 0 | 0 | 121.1 | ||||
| 49 | G | 28.3 | Very low | 32.7 | Very low | 71 Ų | 71 | 128.4 Ų | 128.4 | 73% | 0.732 | 80% | 0.796 | S | S | * | * | trans | 146.1 | 131.6 | 162.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 50 | V | 34.9 | Very low | 32.7 | Very low | 127 Ų | 127 | 129.2 Ų | 129.2 | 77% | 0.77 | 80% | 0.796 | S | S | * | * | cis | -140.6 | 134.4 | -1.6 | 174.9 | 0 | 0 | 0 | 0 | 108.7 | T52 | V50-T52 PolarHBondContact O-N 3.42Š| ||
| 51 | T | 26.7 | Very low | 32.7 | Very low | 108 Ų | 108 | 132.2 Ų | 132.2 | 66% | 0.663 | 80% | 0.797 | S | S | * | * | trans | -73.2 | 105.6 | 164.6 | 25.9 | 0 | 0 | 0 | 0 | 109.5 | Y53 | T51-Y53 WeakPolarHBondContact O-CD2 3.43Å; T51-Y53 PolarHBondContact O-N 3.23Å | ||
| 52 | T | 33.4 | Very low | 33 | Very low | 129 Ų | 129 | 131.8 Ų | 131.8 | 79% | 0.791 | 79% | 0.792 | S | S | * | * | trans | -75.2 | 73.4 | 176.7 | -44.3 | 0 | 0 | 0 | 0 | 110.9 | V50 R54 | V50-T52 PolarHBondContact O-N 3.42Å; T52-R54 PolarHBondContact O-N 3.02Å; T52-R54 VanDerWaalsContact O-N 3.15Å | ||
| 53 | Y | 26.2 | Very low | 33 | Very low | 183 Ų | 183 | 133.7 Ų | 133.7 | 72% | 0.718 | 79% | 0.792 | S | S | * | * | trans | -58.2 | 116.1 | 164.8 | -66.9 | -90.8 | 0 | 0 | 0 | 109 | T51 V55 | T51-Y53 WeakPolarHBondContact O-CD2 3.43Å; T51-Y53 PolarHBondContact O-N 3.23Å; Y53-V55 PolarHBondContact O-N 2.77Å | ||
| 54 | R | 32.9 | Very low | 33.6 | Very low | 248 Ų | 248 | 135.6 Ų | 135.6 | 94% | 0.936 | 79% | 0.793 | S | S | * | * | trans | -74.9 | 78.7 | 156.4 | -87.4 | -168.1 | 170.1 | -167.8 | -1.6 | 108.6 | T52 G56 | T52-R54 PolarHBondContact O-N 3.02Å; T52-R54 VanDerWaalsContact O-N 3.15Å; R54-G56 PolarHBondContact O-N 2.89Å | ||
| 55 | V | 30.2 | Very low | 34.3 | Very low | 118 Ų | 118 | 134.8 Ų | 134.8 | 72% | 0.715 | 79% | 0.785 | S | S | * | * | trans | -71.2 | 82.6 | 162.6 | -173.7 | 0 | 0 | 0 | 0 | 107.8 | Y53 | Y53-V55 PolarHBondContact O-N 2.77Š| ||
| 56 | G | 33.1 | Very low | 34.4 | Very low | 69 Ų | 69 | 134.5 Ų | 134.5 | 71% | 0.711 | 78% | 0.783 | S | S | * | * | trans | -66.8 | 130.7 | 157.2 | 0 | 0 | 0 | 0 | 0 | 108.2 | R54 | R54-G56 PolarHBondContact O-N 2.89Š| ||
| 57 | A | 30.2 | Very low | 35 | Very low | 96 Ų | 96 | 135.4 Ų | 135.4 | 79% | 0.793 | 78% | 0.781 | S | S | * | * | trans | -41.3 | 141.4 | -168.1 | 0 | 0 | 0 | 0 | 0 | 115.7 | G59 | A57-G59 PolarHBondContact O-N 3.32Š| ||
| 58 | M | 31.5 | Very low | 35.5 | Very low | 184 Ų | 184 | 133.5 Ų | 133.5 | 91% | 0.906 | 78% | 0.782 | S | S | * | * | trans | -57.9 | 109.5 | 168.3 | -70.3 | 174 | 174.9 | 0 | 0 | 110.4 | ||||
| 59 | G | 34.4 | Very low | 35.9 | Very low | 70 Ų | 70 | 124.5 Ų | 124.5 | 72% | 0.722 | 75% | 0.746 | S | S | * | * | trans | -66.9 | 138.6 | 146.1 | 0 | 0 | 0 | 0 | 0 | 108.3 | A57 | A57-G59 PolarHBondContact O-N 3.32Š| ||
| 60 | V | 34.1 | Very low | 36.9 | Very low | 141 Ų | 141 | 124.8 Ų | 124.8 | 86% | 0.855 | 74% | 0.735 | S | S | * | * | trans | -57 | 142.3 | -179.6 | -74.5 | 0 | 0 | 0 | 0 | 111.5 | G62 | V60-G62 PolarHBondContact O-N 3.05Š| ||
| 61 | Q | 39.1 | Very low | 37.6 | Very low | 184 Ų | 184 | 120.9 Ų | 120.9 | 86% | 0.86 | 72% | 0.72 | S | S | * | * | trans | -61.7 | 102.1 | 166.6 | 176.4 | -179.8 | -16.7 | 0 | 0 | 108.1 | E63 | Q61-E63 PolarHBondContact O-N 3.07Š| ||
| 62 | G | 39.2 | Very low | 38.3 | Very low | 62 Ų | 62 | 121.8 Ų | 121.8 | 64% | 0.639 | 73% | 0.728 | S | S | * | * | trans | -59.3 | 130.2 | 164.7 | 0 | 0 | 0 | 0 | 0 | 108.7 | V60 | V60-G62 PolarHBondContact O-N 3.05Š| ||
| 63 | E | 35.8 | Very low | 39.1 | Very low | 186 Ų | 186 | 122.8 Ų | 122.8 | 87% | 0.869 | 73% | 0.728 | S | S | * | * | trans | -58.5 | 144.9 | 178.2 | -63.9 | -172.3 | 125 | 0 | 0 | 110.3 | Q61 G65 | Q61-E63 PolarHBondContact O-N 3.07Å; E63-G65 PolarHBondContact O-N 3.25Å | ||
| 64 | R | 46.1 | Very low | 40.3 | Very low | 243 Ų | 243 | 116.1 Ų | 116.1 | 92% | 0.917 | 72% | 0.715 | S | S | * | * | trans | -63.7 | 102.8 | 171.4 | 173.1 | -174 | -92.2 | -173 | -7.1 | 107.4 | ||||
| 65 | G | 45.2 | Very low | 40.7 | Very low | 53 Ų | 53 | 108.8 Ų | 108.8 | 55% | 0.546 | 70% | 0.7 | S | S | . | * | P | Polyproline II helix | trans | -52.1 | 145.1 | 172 | 0 | 0 | 0 | 0 | 0 | 111 | E63 | E63-G65 PolarHBondContact O-N 3.25Š|
| 66 | P | 38.7 | Very low | 41.6 | Very low | 122 Ų | 122 | 108.4 Ų | 108.4 | 79% | 0.792 | 70% | 0.7 | S | S | * | * | P | Polyproline II helix | trans | -59.1 | 148 | -176.5 | 25 | -34.3 | 0 | 0 | 0 | 110.8 | G68 | P66-G68 PolarHBondContact O-N 2.95Š|
| 67 | P | 49.2 | Very low | 42.4 | Very low | 114 Ų | 114 | 107 Ų | 107 | 74% | 0.74 | 69% | 0.685 | S | S | * | * | P | Polyproline II helix | trans | -53 | 127.8 | -177.1 | -27.1 | 34.8 | 0 | 0 | 0 | 112.1 | P69 | P67-P69 WeakPolarHBondContact O-CD 3.3Å; P67-P69 VanDerWaalsContact O-CG 3.23Å; P67-P69 WeakPolarHBondContact O-CG 3.34Å; P67-P69 VanDerWaalsContact O-N 3.11Å |
| 68 | G | 46.3 | Very low | 43 | Very low | 77 Ų | 77 | 106.7 Ų | 106.7 | 79% | 0.794 | 68% | 0.682 | S | S | * | * | trans | -55.5 | 111.2 | 173.5 | 0 | 0 | 0 | 0 | 0 | 110.3 | P66 | P66-G68 PolarHBondContact O-N 2.95Š| ||
| 69 | P | 38.7 | Very low | 43.5 | Very low | 29 Ų | 29 | 103.8 Ų | 103.8 | 19% | 0.188 | 68% | 0.68 | C | S | . | * | P | Polyproline II helix | trans | -74.7 | 163.5 | -163.2 | -26.5 | 40.2 | 0 | 0 | 0 | 114.6 | P67 G71 G647 P648 P649 | P67-P69 WeakPolarHBondContact O-CD 3.3Å; P67-P69 VanDerWaalsContact O-CG 3.23Å; P67-P69 WeakPolarHBondContact O-CG 3.34Å; P67-P69 VanDerWaalsContact O-N 3.11Å; P69-G71 PolarHBondContact O-N 3.49Å; P69-G647 VanDerWaalsContact CB-C 3.49Å; P69-G647 WeakPolarHBondContact CB-O 3.45Å; P69-G647 VanDerWaalsContact CG-C 3.42Å; P69-P648 VanDerWaalsContact CG-C 3.43Å; P69-P648 WeakPolarHBondContact CG-O 2.91Å; P69-P649 HydrophobicContact CB-CB 4.36Å; P69-P649 HydrophobicContact CB-CG 4.45Å |
| 70 | P | 49.9 | Very low | 44.1 | Very low | 78 Ų | 78 | 103.9 Ų | 103.9 | 51% | 0.506 | 68% | 0.682 | S | S | . | * | P | Polyproline II helix | trans | -61.2 | 132.5 | -172 | -17.6 | 28.2 | 0 | 0 | 0 | 111 | R646 | P70-R646 PolarHBondContact O-NH2 3.03Š|
| 71 | G | 48.4 | Very low | 44.4 | Very low | 44 Ų | 44 | 102.5 Ų | 102.5 | 45% | 0.454 | 68% | 0.678 | S | S | . | * | P | Polyproline II helix | trans | -63.2 | 173.3 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | P69 | P69-G71 PolarHBondContact O-N 3.49Š|
| 72 | P | 42.2 | Very low | 44.7 | Very low | 128 Ų | 128 | 99.8 Ų | 99.8 | 83% | 0.831 | 68% | 0.676 | S | S | * | * | P | Polyproline II helix | trans | -65 | 144.6 | 173.7 | 29.2 | -34.8 | 0 | 0 | 0 | 110.9 | ||
| 73 | D | 49.1 | Very low | 45.1 | Very low | 150 Ų | 150 | 99.9 Ų | 99.9 | 80% | 0.802 | 68% | 0.677 | S | S | * | * | P | Polyproline II helix | trans | -64.8 | 139.5 | 178.2 | -59.1 | -71.7 | 0 | 0 | 0 | 111.6 | ||
| 74 | G | 52.2 | Low | 45.3 | Very low | 43 Ų | 43 | 96.8 Ų | 96.8 | 44% | 0.443 | 67% | 0.673 | S | S | . | * | P | Polyproline II helix | trans | -70.9 | 138.8 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112 | ||
| 75 | P | 42 | Very low | 45.2 | Very low | 94 Ų | 94 | 91.2 Ų | 91.2 | 61% | 0.61 | 67% | 0.669 | S | S | * | * | P | Polyproline II helix | trans | -63.1 | 127.4 | -173.6 | 26 | -34.8 | 0 | 0 | 0 | 111.2 | P595 G596 | P75-P595 CarbonylContact O-C 3.48Å; P75-P595 VanDerWaalsContact O-C 3.25Å; P75-P595 WeakPolarHBondContact O-CA 3.04Å; P75-P595 WeakPolarHBondContact O-CB 3.41Å; P75-G596 PolarHBondContact O-N 3.46Å |
| 76 | P | 48.9 | Very low | 45.3 | Very low | 110 Ų | 110 | 92.4 Ų | 92.4 | 71% | 0.714 | 68% | 0.681 | S | S | * | * | B | Isolated β-bridge | trans | -53.2 | 140 | -159.5 | -32.2 | 36.1 | 0 | 0 | 0 | 118.5 | P595 G596 | P76-P595 WeakPolarHBondContact O-CB 3.31Å; P76-G596 CarbonylContact C-O 2.81Å |
| 77 | G | 48.8 | Very low | 45.5 | Very low | 39 Ų | 39 | 96.6 Ų | 96.6 | 40% | 0.402 | 69% | 0.687 | S | S | . | * | P | Polyproline II helix | trans | -49.2 | 129.8 | 177.3 | 0 | 0 | 0 | 0 | 0 | 114.3 | S79 P595 G596 | G77-S79 PolarHBondContact O-N 3.13Å; G77-P595 WeakPolarHBondContact CA-O 3.47Å; G77-G596 PolarHBondContact N-O 3.22Å |
| 78 | A | 42.8 | Very low | 45.4 | Very low | 89 Ų | 89 | 98 Ų | 98 | 74% | 0.736 | 69% | 0.693 | S | S | * | * | P | Polyproline II helix | trans | -61.6 | 133.5 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | G80 | A78-G80 PolarHBondContact O-N 3.19Š|
| 79 | S | 42.6 | Very low | 45.5 | Very low | 123 Ų | 123 | 97.6 Ų | 97.6 | 86% | 0.86 | 69% | 0.689 | S | S | * | * | P | Polyproline II helix | trans | -61 | 128.1 | 179.6 | -60.5 | 0 | 0 | 0 | 0 | 112 | G77 | G77-S79 PolarHBondContact O-N 3.13Š|
| 80 | G | 47.5 | Very low | 46 | Very low | 73 Ų | 73 | 99.3 Ų | 99.3 | 75% | 0.753 | 71% | 0.712 | S | S | * | * | P | Polyproline II helix | trans | -65.2 | 147.3 | 165.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | A78 | A78-G80 PolarHBondContact O-N 3.19Š|
| 81 | S | 39.5 | Very low | 45.9 | Very low | 112 Ų | 112 | 101.9 Ų | 101.9 | 78% | 0.783 | 73% | 0.729 | S | S | * | * | P | Polyproline II helix | trans | -64.5 | 147.7 | 178.5 | 50.6 | 0 | 0 | 0 | 0 | 112.4 | ||
| 82 | P | 46.1 | Very low | 45.8 | Very low | 127 Ų | 127 | 103.2 Ų | 103.2 | 83% | 0.825 | 74% | 0.743 | S | S | * | * | P | Polyproline II helix | trans | -56.6 | 137.9 | 174.4 | -25 | 34.7 | 0 | 0 | 0 | 113 | ||
| 83 | G | 47.5 | Very low | 46 | Very low | 63 Ų | 63 | 104.8 Ų | 104.8 | 65% | 0.649 | 74% | 0.743 | S | S | * | * | P | Polyproline II helix | trans | -68.7 | 156.1 | 165.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||
| 84 | P | 39.4 | Very low | 46.1 | Very low | 122 Ų | 122 | 103.2 Ų | 103.2 | 79% | 0.792 | 74% | 0.74 | S | S | * | * | P | Polyproline II helix | trans | -68.9 | 160.5 | -172.6 | 28.4 | -35.8 | 0 | 0 | 0 | 113.4 | ||
| 85 | P | 45.1 | Very low | 46 | Very low | 126 Ų | 126 | 104.3 Ų | 104.3 | 82% | 0.818 | 75% | 0.752 | S | S | * | * | P | Polyproline II helix | trans | -54.1 | 148.2 | 179.3 | -27.4 | 35.8 | 0 | 0 | 0 | 114.4 | ||
| 86 | G | 46.7 | Very low | 46.1 | Very low | 78 Ų | 78 | 105.9 Ų | 105.9 | 80% | 0.804 | 76% | 0.762 | S | S | * | * | P | Polyproline II helix | trans | -61.9 | 143.3 | -178.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||
| 87 | K | 42.1 | Very low | 46.3 | Very low | 210 Ų | 210 | 108.5 Ų | 108.5 | 91% | 0.913 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -69.6 | 139.6 | 173.1 | -64.6 | -175.1 | 179.4 | -177.6 | 0 | 110.2 | ||
| 88 | T | 47.1 | Very low | 46.3 | Very low | 142 Ų | 142 | 109.6 Ų | 109.6 | 87% | 0.871 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -56.4 | 140 | 177.2 | -36.8 | 0 | 0 | 0 | 0 | 111.1 | ||
| 89 | G | 48.1 | Very low | 46.3 | Very low | 70 Ų | 70 | 113.1 Ų | 113.1 | 72% | 0.722 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -61.7 | 141.9 | -176.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||
| 90 | G | 49.9 | Very low | 46.8 | Very low | 65 Ų | 65 | 113 Ų | 113 | 67% | 0.67 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -70 | 161.5 | 169.1 | 0 | 0 | 0 | 0 | 0 | 112 | ||
| 91 | P | 48.9 | Very low | 46.9 | Very low | 132 Ų | 132 | 112.4 Ų | 112.4 | 86% | 0.857 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -60.2 | 145.6 | 177.4 | 26.4 | -34.6 | 0 | 0 | 0 | 111.5 | ||
| 92 | G | 46.3 | Very low | 47.2 | Very low | 72 Ų | 72 | 112.9 Ų | 112.9 | 74% | 0.742 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -58.2 | 138.7 | -173.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||
| 93 | I | 46.2 | Very low | 47.5 | Very low | 161 Ų | 161 | 113 Ų | 113 | 83% | 0.826 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -61.2 | 130.6 | 174.6 | -48.2 | 173.4 | 0 | 0 | 0 | 108.2 | G95 | I93-G95 PolarHBondContact O-N 3.48Š|
| 94 | P | 50.5 | Low | 47.8 | Very low | 116 Ų | 116 | 113.3 Ų | 113.3 | 75% | 0.753 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -53.1 | 131.2 | 170.4 | -26.1 | 35.2 | 0 | 0 | 0 | 110.4 | ||
| 95 | G | 50.4 | Low | 48.1 | Very low | 66 Ų | 66 | 112.3 Ų | 112.3 | 68% | 0.68 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -54.4 | 141.5 | -175.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | I93 I97 | I93-G95 PolarHBondContact O-N 3.48Å; G95-I97 PolarHBondContact O-N 3.36Å |
| 96 | P | 44.7 | Very low | 48.2 | Very low | 127 Ų | 127 | 114 Ų | 114 | 83% | 0.825 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -58.2 | 136.4 | -176 | 24.6 | -34.1 | 0 | 0 | 0 | 110.4 | G98 | P96-G98 PolarHBondContact O-N 3.13Å; P96-G98 VanDerWaalsContact O-N 3.09Å |
| 97 | I | 52 | Low | 48.4 | Very low | 166 Ų | 166 | 113.5 Ų | 113.5 | 85% | 0.851 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -55 | 120.7 | 167.8 | -64.7 | 174.6 | 0 | 0 | 0 | 106.6 | G95 L99 | G95-I97 PolarHBondContact O-N 3.36Å; I97-L99 PolarHBondContact O-N 3.09Å |
| 98 | G | 48.1 | Very low | 48.5 | Very low | 62 Ų | 62 | 113 Ų | 113 | 64% | 0.639 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -53.9 | 127.3 | -176 | 0 | 0 | 0 | 0 | 0 | 110.4 | P96 | P96-G98 PolarHBondContact O-N 3.13Å; P96-G98 VanDerWaalsContact O-N 3.09Å |
| 99 | L | 44.3 | Very low | 48.9 | Very low | 162 Ų | 162 | 112.2 Ų | 112.2 | 85% | 0.848 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -50.8 | 132.4 | 177 | -68.6 | 171.8 | 0 | 0 | 0 | 109.2 | I97 G101 | I97-L99 PolarHBondContact O-N 3.09Å; L99-G101 PolarHBondContact O-N 3.43Å; L99-G101 VanDerWaalsContact O-N 3.16Å |
| 100 | P | 52.1 | Low | 49 | Very low | 121 Ų | 121 | 112 Ų | 112 | 79% | 0.786 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -50 | 126.2 | 165.6 | -25.4 | 34.8 | 0 | 0 | 0 | 108.5 | ||
| 101 | G | 50.7 | Low | 48.7 | Very low | 60 Ų | 60 | 120.3 Ų | 120.3 | 62% | 0.619 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -54.6 | 143.1 | -176.3 | 0 | 0 | 0 | 0 | 0 | 110.6 | L99 | L99-G101 PolarHBondContact O-N 3.43Å; L99-G101 VanDerWaalsContact O-N 3.16Å |
| 102 | P | 44.9 | Very low | 48.7 | Very low | 123 Ų | 123 | 121.7 Ų | 121.7 | 80% | 0.799 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -54.5 | 136.3 | -179.6 | 23.8 | -33.9 | 0 | 0 | 0 | 109.4 | G104 | P102-G104 PolarHBondContact O-N 3.44Š|
| 103 | P | 53.6 | Low | 48.9 | Very low | 130 Ų | 130 | 121.8 Ų | 121.8 | 84% | 0.844 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -48.2 | 127.2 | 175.2 | -29.3 | 35.8 | 0 | 0 | 0 | 110.3 | A105 | P103-A105 PolarHBondContact O-N 3.34Š|
| 104 | G | 53.4 | Low | 48.4 | Very low | 69 Ų | 69 | 123 Ų | 123 | 71% | 0.711 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -56.8 | 130.9 | -176.7 | 0 | 0 | 0 | 0 | 0 | 110.1 | P102 D106 | P102-G104 PolarHBondContact O-N 3.44Å; G104-D106 PolarHBondContact O-N 3.17Å |
| 105 | A | 44.2 | Very low | 48.3 | Very low | 101 Ų | 101 | 122.1 Ų | 122.1 | 84% | 0.835 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -53.4 | 126.7 | -174.9 | 0 | 0 | 0 | 0 | 0 | 111.2 | P103 G107 | P103-A105 PolarHBondContact O-N 3.34Å; A105-G107 PolarHBondContact O-N 3.34Å |
| 106 | D | 48.2 | Very low | 48.2 | Very low | 161 Ų | 161 | 122.2 Ų | 122.2 | 86% | 0.861 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -51 | 128.7 | -176.8 | -78.1 | -53 | 0 | 0 | 0 | 111.3 | G104 K108 | G104-D106 PolarHBondContact O-N 3.17Å; D106-K108 PolarHBondContact O-N 3.36Å |
| 107 | G | 51.2 | Low | 47.8 | Very low | 68 Ų | 68 | 123.9 Ų | 123.9 | 70% | 0.701 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -58.3 | 127.6 | 179.4 | 0 | 0 | 0 | 0 | 0 | 110.1 | A105 | A105-G107 PolarHBondContact O-N 3.34Š|
| 108 | K | 44.5 | Very low | 48.1 | Very low | 198 Ų | 198 | 121.8 Ų | 121.8 | 86% | 0.861 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -49.3 | 128.6 | 174.6 | -68.3 | -179.7 | 179.6 | 178.1 | 0 | 109.1 | D106 G110 | D106-K108 PolarHBondContact O-N 3.36Å; K108-G110 PolarHBondContact O-N 3.44Å |
| 109 | P | 54.7 | Low | 48.1 | Very low | 127 Ų | 127 | 122.3 Ų | 122.3 | 83% | 0.825 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -48.7 | 141.2 | 171.4 | -29.4 | 36.2 | 0 | 0 | 0 | 110.8 | ||
| 110 | G | 51.4 | Low | 48 | Very low | 64 Ų | 64 | 120 Ų | 120 | 66% | 0.66 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -56.9 | 154 | -177.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | K108 D112 | K108-G110 PolarHBondContact O-N 3.44Å; G110-D112 PolarHBondContact O-N 3.03Å; G110-D112 VanDerWaalsContact O-N 3.14Å |
| 111 | R | 43.7 | Very low | 47.9 | Very low | 241 Ų | 241 | 120.1 Ų | 120.1 | 91% | 0.909 | 80% | 0.802 | S | S | * | * | trans | -66 | 113.3 | 165.2 | -76.3 | -177.6 | 171.2 | -169.8 | -3.5 | 108.1 | ||||
| 112 | D | 47.2 | Very low | 47.8 | Very low | 160 Ų | 160 | 120.2 Ų | 120.2 | 86% | 0.856 | 80% | 0.803 | S | S | * | * | trans | -56.6 | 146.2 | 161.2 | -69.6 | -44.2 | 0 | 0 | 0 | 109.6 | G110 | G110-D112 PolarHBondContact O-N 3.03Å; G110-D112 VanDerWaalsContact O-N 3.14Å | ||
| 113 | G | 51 | Low | 47.4 | Very low | 74 Ų | 74 | 124.2 Ų | 124.2 | 76% | 0.763 | 81% | 0.811 | S | S | * | * | trans | -62.7 | 151.4 | -164.4 | 0 | 0 | 0 | 0 | 0 | 114.6 | A115 | G113-A115 PolarHBondContact O-N 3.15Å; G113-A115 VanDerWaalsContact O-N 3.11Å | ||
| 114 | E | 35.3 | Very low | 47.3 | Very low | 187 Ų | 187 | 124.9 Ų | 124.9 | 87% | 0.874 | 81% | 0.812 | S | S | * | * | trans | -60.2 | 114 | 175.9 | -64.4 | -177.3 | 149.4 | 0 | 0 | 110.7 | G116 | E114-G116 PolarHBondContact O-N 2.9Š| ||
| 115 | A | 49.3 | Very low | 47.3 | Very low | 97 Ų | 97 | 124.3 Ų | 124.3 | 80% | 0.802 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -65 | 119 | 168.9 | 0 | 0 | 0 | 0 | 0 | 108.9 | G113 | G113-A115 PolarHBondContact O-N 3.15Å; G113-A115 VanDerWaalsContact O-N 3.11Å |
| 116 | G | 47.9 | Very low | 47.5 | Very low | 68 Ų | 68 | 125.4 Ų | 125.4 | 70% | 0.701 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -58.4 | 141.8 | -169.4 | 0 | 0 | 0 | 0 | 0 | 114.1 | E114 P118 | E114-G116 PolarHBondContact O-N 2.9Å; G116-P118 WeakPolarHBondContact O-CD 3.4Å |
| 117 | N | 37.1 | Very low | 48.1 | Very low | 162 Ų | 162 | 124 Ų | 124 | 87% | 0.866 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -50.4 | 118.7 | -175.6 | -65.7 | -52.8 | 0 | 0 | 0 | 113 | ||
| 118 | P | 58.3 | Low | 48.1 | Very low | 123 Ų | 123 | 123.9 Ų | 123.9 | 80% | 0.799 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -59.4 | 143 | 162.4 | -21.5 | 34.5 | 0 | 0 | 0 | 110.4 | G116 | G116-P118 WeakPolarHBondContact O-CD 3.4Š|
| 119 | G | 47.9 | Very low | 48.1 | Very low | 72 Ų | 72 | 120.9 Ų | 120.9 | 74% | 0.742 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -61.1 | 150.5 | -172.5 | 0 | 0 | 0 | 0 | 0 | 114.3 | S121 | G119-S121 PolarHBondContact O-N 2.65Å; G119-S121 VanDerWaalsContact O-N 3.16Å |
| 120 | A | 41.6 | Very low | 48.2 | Very low | 115 Ų | 115 | 120.8 Ų | 120.8 | 95% | 0.95 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -59.6 | 116.7 | -179.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||
| 121 | S | 49.9 | Very low | 48.1 | Very low | 123 Ų | 123 | 121 Ų | 121 | 86% | 0.86 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -97.2 | 148.9 | 166.8 | -158.3 | 0 | 0 | 0 | 0 | 109.9 | G119 | G119-S121 PolarHBondContact O-N 2.65Å; G119-S121 VanDerWaalsContact O-N 3.16Å |
| 122 | G | 49.1 | Very low | 48.1 | Very low | 62 Ų | 62 | 115.9 Ų | 115.9 | 64% | 0.639 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -69.1 | 167.9 | -159.5 | 0 | 0 | 0 | 0 | 0 | 116.6 | V124 | G122-V124 PolarHBondContact O-N 2.64Š|
| 123 | E | 37 | Very low | 48.2 | Very low | 206 Ų | 206 | 115.2 Ų | 115.2 | 96% | 0.963 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -57.2 | 118 | -179.8 | -61.1 | -176.8 | 136.7 | 0 | 0 | 112.3 | ||
| 124 | V | 51 | Low | 48 | Very low | 144 Ų | 144 | 114.4 Ų | 114.4 | 87% | 0.873 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -91.8 | 119.9 | 166.8 | -179.1 | 0 | 0 | 0 | 0 | 108.2 | G122 | G122-V124 PolarHBondContact O-N 2.64Š|
| 125 | G | 52.9 | Low | 48.3 | Very low | 57 Ų | 57 | 111.5 Ų | 111.5 | 59% | 0.588 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -64 | 163 | -173 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||
| 126 | P | 48.5 | Very low | 48.6 | Very low | 124 Ų | 124 | 113.3 Ų | 113.3 | 81% | 0.805 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -66.3 | 143.4 | -172.5 | 26.9 | -35.4 | 0 | 0 | 0 | 113.1 | G128 | P126-G128 PolarHBondContact O-N 2.95Š|
| 127 | P | 60.1 | Low | 48.4 | Very low | 132 Ų | 132 | 113.7 Ų | 113.7 | 86% | 0.857 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -58.6 | 131.4 | 172.9 | -25 | 34.8 | 0 | 0 | 0 | 112.8 | ||
| 128 | G | 51.6 | Low | 48.6 | Very low | 65 Ų | 65 | 114.7 Ų | 114.7 | 67% | 0.67 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -72.8 | 149.8 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | P126 | P126-G128 PolarHBondContact O-N 2.95Š|
| 129 | P | 45.1 | Very low | 47.9 | Very low | 135 Ų | 135 | 118.5 Ų | 118.5 | 88% | 0.877 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -72.3 | 149.4 | -172.8 | 29.5 | -36.1 | 0 | 0 | 0 | 113.7 | ||
| 130 | S | 55.9 | Low | 48.2 | Very low | 126 Ų | 126 | 117.7 Ų | 117.7 | 88% | 0.881 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -73.6 | 135.3 | 176.6 | -49.5 | 0 | 0 | 0 | 0 | 112.6 | ||
| 131 | G | 50.5 | Low | 48.3 | Very low | 67 Ų | 67 | 118.7 Ų | 118.7 | 69% | 0.691 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -80.1 | 159.7 | 174 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||
| 132 | P | 43.4 | Very low | 48.3 | Very low | 135 Ų | 135 | 119 Ų | 119 | 88% | 0.877 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -80.7 | 149.1 | -169.8 | 32.2 | -36.5 | 0 | 0 | 0 | 114.7 | ||
| 133 | T | 48.1 | Very low | 48.1 | Very low | 145 Ų | 145 | 119.3 Ų | 119.3 | 89% | 0.89 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -72.1 | 129.3 | -178 | -44.5 | 0 | 0 | 0 | 0 | 113.5 | ||
| 134 | G | 47.8 | Very low | 48.4 | Very low | 58 Ų | 58 | 117.7 Ų | 117.7 | 60% | 0.598 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -86.6 | 159.9 | 168.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||
| 135 | P | 41.2 | Very low | 47.9 | Very low | 125 Ų | 125 | 121 Ų | 121 | 81% | 0.812 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -78.4 | 154.8 | -165.7 | 30.8 | -36.4 | 0 | 0 | 0 | 114.9 | ||
| 136 | P | 54.7 | Low | 47.7 | Very low | 135 Ų | 135 | 121.3 Ų | 121.3 | 88% | 0.877 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -69.1 | 134.6 | -176.7 | -19.8 | 33.3 | 0 | 0 | 0 | 114.8 | ||
| 137 | G | 45.2 | Very low | 47.2 | Very low | 76 Ų | 76 | 125.1 Ų | 125.1 | 78% | 0.784 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -87.4 | 145.7 | 171.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||
| 138 | L | 41.8 | Very low | 46.5 | Very low | 184 Ų | 184 | 128.8 Ų | 128.8 | 96% | 0.963 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -63.8 | 145.6 | -169 | -68.5 | 165.5 | 0 | 0 | 0 | 115.2 | ||
| 139 | K | 43.3 | Very low | 46.5 | Very low | 203 Ų | 203 | 129 Ų | 129 | 88% | 0.883 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -68.6 | 129.6 | -178.6 | -176.4 | 178.4 | -178.3 | 177.5 | 0 | 112.8 | ||
| 140 | G | 53.9 | Low | 46.4 | Very low | 55 Ų | 55 | 131.2 Ų | 131.2 | 57% | 0.567 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -75.8 | 159.8 | 174.4 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||
| 141 | P | 44.1 | Very low | 46.2 | Very low | 136 Ų | 136 | 136.7 Ų | 136.7 | 88% | 0.883 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -74.5 | 154 | -179.3 | 31.4 | -35.7 | 0 | 0 | 0 | 113.1 | ||
| 142 | V | 49.3 | Very low | 46.2 | Very low | 128 Ų | 128 | 136.4 Ų | 136.4 | 78% | 0.776 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -81.7 | 127.8 | -175 | 176.6 | 0 | 0 | 0 | 0 | 112 | ||
| 143 | G | 45.4 | Very low | 46.3 | Very low | 70 Ų | 70 | 137.2 Ų | 137.2 | 72% | 0.722 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -101.2 | 135.8 | 165.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | K145 | G143-K145 PolarHBondContact O-N 2.94Š|
| 144 | L | 43 | Very low | 46.9 | Very low | 172 Ų | 172 | 136.2 Ų | 136.2 | 90% | 0.901 | 80% | 0.803 | S | S | * | * | trans | -86.3 | 104.9 | -168.1 | -67.8 | 167.7 | 0 | 0 | 0 | 114 | ||||
| 145 | K | 39.2 | Very low | 46.8 | Very low | 212 Ų | 212 | 136.9 Ų | 136.9 | 92% | 0.922 | 81% | 0.81 | S | S | * | * | trans | -163.3 | 128.6 | 154.9 | -155.4 | 172.5 | -175 | 178.4 | 0 | 110.2 | G143 | G143-K145 PolarHBondContact O-N 2.94Š| ||
| 146 | G | 49.3 | Very low | 47 | Very low | 65 Ų | 65 | 142.7 Ų | 142.7 | 67% | 0.67 | 82% | 0.816 | S | S | * | * | cis | -159 | 176.4 | -10.8 | 0 | 0 | 0 | 0 | 0 | 109.1 | K148 | G146-K148 PolarHBondContact O-N 2.9Š| ||
| 147 | K | 37.3 | Very low | 46.7 | Very low | 204 Ų | 204 | 143.7 Ų | 143.7 | 89% | 0.887 | 81% | 0.814 | S | S | * | * | trans | -62.2 | 105.8 | 178.6 | -72.1 | -167 | 174.4 | -163.7 | 0 | 110.7 | ||||
| 148 | K | 46 | Very low | 46.6 | Very low | 209 Ų | 209 | 143.8 Ų | 143.8 | 91% | 0.909 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -76.9 | 128.6 | 160.3 | -168.4 | 173.2 | -177.9 | 179.2 | 0 | 106.7 | G146 | G146-K148 PolarHBondContact O-N 2.9Š|
| 149 | G | 51.1 | Low | 46.7 | Very low | 69 Ų | 69 | 141.8 Ų | 141.8 | 71% | 0.711 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -57.6 | 144.1 | -162.2 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||
| 150 | E | 44.6 | Very low | 46.9 | Very low | 181 Ų | 181 | 140.7 Ų | 140.7 | 85% | 0.846 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -56.6 | 140.4 | 161.7 | -73.5 | 148.8 | 172.1 | 0 | 0 | 108.8 | G152 | E150-G152 PolarHBondContact O-N 2.97Š|
| 151 | R | 50.8 | Low | 46.6 | Very low | 242 Ų | 242 | 141.6 Ų | 141.6 | 91% | 0.913 | 82% | 0.817 | S | S | * | * | trans | -66.5 | 108.3 | 168.4 | 175.1 | -175.9 | -69.2 | 170.8 | -2.9 | 106 | ||||
| 152 | G | 50.7 | Low | 46.6 | Very low | 61 Ų | 61 | 143.1 Ų | 143.1 | 63% | 0.629 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -55.6 | 142.1 | 179.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | E150 | E150-G152 PolarHBondContact O-N 2.97Š|
| 153 | D | 45.5 | Very low | 46.5 | Very low | 152 Ų | 152 | 148.1 Ų | 148.1 | 81% | 0.813 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -54.6 | 145.3 | 172.7 | -61.6 | -56.3 | 0 | 0 | 0 | 110.1 | G155 | D153-G155 PolarHBondContact O-N 3.39Š|
| 154 | P | 60 | Low | 46.7 | Very low | 123 Ų | 123 | 148 Ų | 148 | 80% | 0.799 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -50.2 | 130.6 | 165.3 | -24.8 | 34.9 | 0 | 0 | 0 | 109.7 | R156 | P154-R156 PolarHBondContact O-N 3.27Š|
| 155 | G | 46.7 | Very low | 46.7 | Very low | 73 Ų | 73 | 147.4 Ų | 147.4 | 75% | 0.753 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -56 | 127.7 | -174.5 | 0 | 0 | 0 | 0 | 0 | 110.9 | D153 D157 | D153-G155 PolarHBondContact O-N 3.39Å; G155-D157 PolarHBondContact O-N 2.94Å |
| 156 | R | 46.1 | Very low | 46.7 | Very low | 246 Ų | 246 | 145.4 Ų | 145.4 | 93% | 0.928 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -61 | 133.4 | 170.1 | -66.1 | -177.2 | 179 | -166.3 | -1.6 | 108.6 | P154 G158 | P154-R156 PolarHBondContact O-N 3.27Å; R156-G158 PolarHBondContact O-N 2.85Å |
| 157 | D | 46.9 | Very low | 46.6 | Very low | 157 Ų | 157 | 145.7 Ų | 145.7 | 84% | 0.84 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -54.2 | 136.3 | 172.3 | -64.9 | -59.9 | 0 | 0 | 0 | 110.4 | G155 V159 | G155-D157 PolarHBondContact O-N 2.94Å; D157-V159 PolarHBondContact O-N 2.91Å |
| 158 | G | 44.2 | Very low | 46.9 | Very low | 77 Ų | 77 | 140.4 Ų | 140.4 | 79% | 0.794 | 81% | 0.813 | S | S | * | * | trans | -67.4 | 114.7 | -176.2 | 0 | 0 | 0 | 0 | 0 | 110.8 | R156 E160 | R156-G158 PolarHBondContact O-N 2.85Å; G158-E160 PolarHBondContact O-N 2.02Å | ||
| 159 | V | 43.8 | Very low | 46.9 | Very low | 142 Ų | 142 | 136.9 Ų | 136.9 | 86% | 0.861 | 81% | 0.811 | S | S | * | * | trans | -59.5 | 129.8 | 171 | -177.1 | 0 | 0 | 0 | 0 | 108.8 | D157 G161 | D157-V159 PolarHBondContact O-N 2.91Å; V159-G161 PolarHBondContact O-N 2.9Å | ||
| 160 | E | 47.3 | Very low | 46.5 | Very low | 180 Ų | 180 | 137 Ų | 137 | 84% | 0.841 | 81% | 0.813 | S | S | * | * | trans | -55.9 | 129 | -180 | -170.4 | 174.8 | -172.4 | 0 | 0 | 110.9 | G158 I162 | G158-E160 PolarHBondContact O-N 2.02Å; E160-I162 PolarHBondContact O-N 3.11Å | ||
| 161 | G | 46.6 | Very low | 46.3 | Very low | 74 Ų | 74 | 137.3 Ų | 137.3 | 76% | 0.763 | 82% | 0.819 | S | S | * | * | trans | -71.4 | 97.4 | -172.3 | 0 | 0 | 0 | 0 | 0 | 112 | V159 R163 | V159-G161 PolarHBondContact O-N 2.9Å; G161-R163 PolarHBondContact O-N 3.48Å | ||
| 162 | I | 44.3 | Very low | 46.2 | Very low | 169 Ų | 169 | 135 Ų | 135 | 87% | 0.867 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -52.8 | 130.7 | 173.3 | 49.4 | 172.9 | 0 | 0 | 0 | 111.5 | E160 G164 | E160-I162 PolarHBondContact O-N 3.11Å; I162-G164 PolarHBondContact O-N 3.21Å |
| 163 | R | 48.3 | Very low | 45.8 | Very low | 232 Ų | 232 | 135.5 Ų | 135.5 | 88% | 0.875 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -54.7 | 118.4 | 178.5 | 179.1 | -176.9 | -171.9 | 156.7 | 1.3 | 110.5 | G161 | G161-R163 PolarHBondContact O-N 3.48Š|
| 164 | G | 49.9 | Very low | 45.8 | Very low | 68 Ų | 68 | 140.5 Ų | 140.5 | 70% | 0.701 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -69.5 | 137.2 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | I162 | I162-G164 PolarHBondContact O-N 3.21Š|
| 165 | D | 42.2 | Very low | 45 | Very low | 160 Ų | 160 | 141.8 Ų | 141.8 | 86% | 0.856 | 84% | 0.84 | S | S | * | * | P | Polyproline II helix | trans | -72.6 | 155.3 | -177.8 | -65.6 | -62.4 | 0 | 0 | 0 | 114.2 | G167 | D165-G167 PolarHBondContact O-N 3.12Š|
| 166 | I | 40 | Very low | 44.7 | Very low | 170 Ų | 170 | 142.1 Ų | 142.1 | 87% | 0.872 | 84% | 0.843 | S | S | * | * | trans | -83 | 96.5 | -177.5 | -59.6 | 175.3 | 0 | 0 | 0 | 109.9 | ||||
| 167 | G | 47.1 | Very low | 44.7 | Very low | 70 Ų | 70 | 135.7 Ų | 135.7 | 72% | 0.722 | 84% | 0.842 | S | S | * | * | P | Polyproline II helix | trans | -73.7 | 139.3 | 166.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | D165 | D165-G167 PolarHBondContact O-N 3.12Š|
| 168 | A | 42.1 | Very low | 44.5 | Very low | 94 Ų | 94 | 140.3 Ų | 140.3 | 78% | 0.777 | 85% | 0.848 | S | S | * | * | P | Polyproline II helix | trans | -72.7 | 156.1 | -167.8 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||
| 169 | P | 45.9 | Very low | 44.6 | Very low | 134 Ų | 134 | 140.4 Ų | 140.4 | 87% | 0.87 | 85% | 0.848 | S | S | * | * | P | Polyproline II helix | trans | -80.5 | 127.1 | -172.2 | -12.5 | 29.9 | 0 | 0 | 0 | 114.9 | ||
| 170 | G | 43.4 | Very low | 44.8 | Very low | 73 Ų | 73 | 137.3 Ų | 137.3 | 75% | 0.753 | 85% | 0.846 | S | S | * | * | trans | 58.8 | 118.7 | 133.9 | 0 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 171 | L | 41.5 | Very low | 44.8 | Very low | 187 Ų | 187 | 136 Ų | 136 | 98% | 0.979 | 85% | 0.85 | S | S | * | * | trans | -109.3 | 151.5 | 147.1 | -81.2 | 172.7 | 0 | 0 | 0 | 110.3 | ||||
| 172 | M | 47.4 | Very low | 45.4 | Very low | 194 Ų | 194 | 135.3 Ų | 135.3 | 96% | 0.956 | 84% | 0.842 | S | S | * | * | trans | -126.3 | 139.2 | -155.6 | -171 | -158.2 | -53.5 | 0 | 0 | 113.4 | ||||
| 173 | G | 43.4 | Very low | 45.8 | Very low | 71 Ų | 71 | 133.4 Ų | 133.4 | 73% | 0.732 | 84% | 0.841 | S | S | * | * | trans | 160 | 138.7 | 165 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 174 | R | 45.1 | Very low | 45.8 | Very low | 256 Ų | 256 | 127.3 Ų | 127.3 | 97% | 0.966 | 84% | 0.84 | S | S | * | * | cis | -143.6 | 157.6 | -0.9 | -104.1 | 175.6 | 156.9 | -171.3 | -6.3 | 109.1 | ||||
| 175 | T | 42.4 | Very low | 46.3 | Very low | 151 Ų | 151 | 127 Ų | 127 | 93% | 0.926 | 84% | 0.837 | S | S | * | * | trans | -97 | 146.7 | -173.6 | 43.6 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 176 | G | 41.5 | Very low | 46.7 | Very low | 80 Ų | 80 | 125.9 Ų | 125.9 | 83% | 0.825 | 84% | 0.838 | S | S | * | * | trans | 155.8 | 132.6 | 164.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 177 | A | 44.6 | Very low | 47.4 | Very low | 110 Ų | 110 | 123.3 Ų | 123.3 | 91% | 0.909 | 84% | 0.836 | S | S | * | * | cis | -149.9 | 156.8 | -5.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 178 | R | 42.6 | Very low | 47.8 | Very low | 255 Ų | 255 | 123.4 Ų | 123.4 | 96% | 0.962 | 84% | 0.836 | S | S | * | * | trans | -37.4 | 141.1 | -178.4 | -177.5 | -173.8 | -166.4 | 170.9 | 4.5 | 120.1 | ||||
| 179 | G | 47.5 | Very low | 48.2 | Very low | 78 Ų | 78 | 125.1 Ų | 125.1 | 80% | 0.804 | 84% | 0.837 | S | S | * | * | trans | 155.3 | 134.4 | 150.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 180 | G | 48.4 | Very low | 48.9 | Very low | 78 Ų | 78 | 124.5 Ų | 124.5 | 80% | 0.804 | 83% | 0.833 | S | S | * | * | cis | -158.2 | 163.5 | -8.6 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 181 | V | 47.7 | Very low | 49.4 | Very low | 153 Ų | 153 | 124.5 Ų | 124.5 | 93% | 0.927 | 83% | 0.834 | S | S | * | * | P | Polyproline II helix | trans | -76.9 | 130.5 | -168.3 | 177.9 | 0 | 0 | 0 | 0 | 112.9 | ||
| 182 | G | 57.8 | Low | 49.6 | Very low | 58 Ų | 58 | 124.6 Ų | 124.6 | 60% | 0.598 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -100.9 | 149.1 | 158.5 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||
| 183 | P | 53.3 | Low | 49.8 | Very low | 130 Ų | 130 | 122.1 Ų | 122.1 | 84% | 0.844 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -71.5 | 156 | -173.8 | 29.8 | -35.7 | 0 | 0 | 0 | 113.3 | ||
| 184 | A | 48.9 | Very low | 50.3 | Low | 103 Ų | 103 | 121.3 Ų | 121.3 | 85% | 0.851 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -69.4 | 135.3 | -179.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||
| 185 | G | 59.7 | Low | 50.5 | Low | 63 Ų | 63 | 115.2 Ų | 115.2 | 65% | 0.649 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -71.5 | 162 | 162.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||
| 186 | P | 50.7 | Low | 51.1 | Low | 135 Ų | 135 | 112.6 Ų | 112.6 | 88% | 0.877 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -63.5 | 151.2 | -174.6 | 26.6 | -35.1 | 0 | 0 | 0 | 112.7 | G188 | P186-G188 PolarHBondContact O-N 3.31Š|
| 187 | S | 55.3 | Low | 51.5 | Low | 117 Ų | 117 | 112 Ų | 112 | 82% | 0.818 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -54.7 | 133.5 | 176.9 | -61.7 | 0 | 0 | 0 | 0 | 111.6 | ||
| 188 | G | 54.5 | Low | 51.6 | Low | 71 Ų | 71 | 111.6 Ų | 111.6 | 73% | 0.732 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -58.4 | 140.3 | 163.7 | 0 | 0 | 0 | 0 | 0 | 109.8 | P186 | P186-G188 PolarHBondContact O-N 3.31Š|
| 189 | T | 51.5 | Low | 52 | Low | 130 Ų | 130 | 106.9 Ų | 106.9 | 80% | 0.798 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -51.5 | 138.5 | 171.5 | 46.4 | 0 | 0 | 0 | 0 | 110.1 | G191 | T189-G191 PolarHBondContact O-N 2.87Š|
| 190 | P | 59.4 | Low | 52.1 | Low | 121 Ų | 121 | 106.4 Ų | 106.4 | 79% | 0.786 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -50.1 | 130.4 | 177.6 | -26.7 | 34.8 | 0 | 0 | 0 | 111.2 | Q192 | P190-Q192 PolarHBondContact O-N 3.36Š|
| 191 | G | 54.5 | Low | 51.7 | Low | 74 Ų | 74 | 110.7 Ų | 110.7 | 76% | 0.763 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -55.8 | 125.1 | 173.3 | 0 | 0 | 0 | 0 | 0 | 108.9 | T189 V193 | T189-G191 PolarHBondContact O-N 2.87Å; G191-V193 PolarHBondContact O-N 3.41Å |
| 192 | Q | 45.6 | Very low | 51.9 | Low | 188 Ų | 188 | 109.1 Ų | 109.1 | 88% | 0.879 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -54.9 | 140.3 | 174.4 | -72.9 | -178.5 | -19.1 | 0 | 0 | 108.8 | P190 G194 | P190-Q192 PolarHBondContact O-N 3.36Å; Q192-G194 PolarHBondContact O-N 3.3Å; Q192-G194 VanDerWaalsContact O-N 3.09Å |
| 193 | V | 51 | Low | 51.6 | Low | 143 Ų | 143 | 109.9 Ų | 109.9 | 87% | 0.867 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -48.9 | 121.7 | 176.6 | 179.2 | 0 | 0 | 0 | 0 | 107.8 | G191 | G191-V193 PolarHBondContact O-N 3.41Š|
| 194 | G | 54.9 | Low | 51.2 | Low | 54 Ų | 54 | 108.4 Ų | 108.4 | 56% | 0.557 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -53.4 | 138.3 | 179.8 | 0 | 0 | 0 | 0 | 0 | 109.4 | Q192 A196 | Q192-G194 PolarHBondContact O-N 3.3Å; Q192-G194 VanDerWaalsContact O-N 3.09Å; G194-A196 PolarHBondContact O-N 3.3Å |
| 195 | P | 49 | Very low | 51.3 | Low | 127 Ų | 127 | 112.2 Ų | 112.2 | 83% | 0.825 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -53 | 142.5 | -178.6 | 22.9 | -33.5 | 0 | 0 | 0 | 109.7 | ||
| 196 | A | 54.4 | Low | 51.2 | Low | 96 Ų | 96 | 111.5 Ų | 111.5 | 79% | 0.793 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -50.7 | 145.6 | 178.6 | 0 | 0 | 0 | 0 | 0 | 110.2 | G194 A198 | G194-A196 PolarHBondContact O-N 3.3Å; A196-A198 PolarHBondContact O-N 3.11Å |
| 197 | G | 50.7 | Low | 51.3 | Low | 68 Ų | 68 | 110.9 Ų | 110.9 | 70% | 0.701 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -51 | 132.9 | -176 | 0 | 0 | 0 | 0 | 0 | 110.7 | D199 | G197-D199 PolarHBondContact O-N 3.22Å; G197-D199 VanDerWaalsContact O-N 3.09Å |
| 198 | A | 45.2 | Very low | 51.6 | Low | 102 Ų | 102 | 110.8 Ų | 110.8 | 84% | 0.843 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -52.6 | 119.7 | -175.5 | 0 | 0 | 0 | 0 | 0 | 110.1 | A196 G200 | A196-A198 PolarHBondContact O-N 3.11Å; A198-G200 PolarHBondContact O-N 3.18Å |
| 199 | D | 52.1 | Low | 51.5 | Low | 155 Ų | 155 | 110.3 Ų | 110.3 | 83% | 0.829 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -52 | 131 | 178.1 | -73 | -60 | 0 | 0 | 0 | 109.3 | G197 L201 | G197-D199 PolarHBondContact O-N 3.22Å; G197-D199 VanDerWaalsContact O-N 3.09Å; D199-L201 PolarHBondContact O-N 3.02Å |
| 200 | G | 49.1 | Very low | 51.6 | Low | 69 Ų | 69 | 110.2 Ų | 110.2 | 71% | 0.711 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -55.3 | 126 | -177.8 | 0 | 0 | 0 | 0 | 0 | 109.8 | A198 P202 | A198-G200 PolarHBondContact O-N 3.18Å; G200-P202 WeakPolarHBondContact O-CD 3.29Å |
| 201 | L | 40.1 | Very low | 51.8 | Low | 168 Ų | 168 | 113 Ų | 113 | 88% | 0.88 | 77% | 0.771 | S | S | * | * | trans | -39.7 | 114.2 | -175.5 | -73 | 172.8 | 0 | 0 | 0 | 110.3 | D199 G203 | D199-L201 PolarHBondContact O-N 3.02Å; L201-G203 PolarHBondContact O-N 3.09Å | ||
| 202 | P | 53.2 | Low | 51.6 | Low | 119 Ų | 119 | 112.3 Ų | 112.3 | 77% | 0.773 | 76% | 0.764 | S | S | * | * | trans | -53.1 | 119.9 | 179.1 | -28.9 | 36 | 0 | 0 | 0 | 109 | G200 A204 | G200-P202 WeakPolarHBondContact O-CD 3.29Å; P202-A204 PolarHBondContact O-N 3.06Å; P202-A204 VanDerWaalsContact O-N 3.16Å | ||
| 203 | G | 51.6 | Low | 51.8 | Low | 74 Ų | 74 | 111 Ų | 111 | 76% | 0.763 | 76% | 0.763 | S | S | * | * | trans | -51.5 | 125.2 | -173.3 | 0 | 0 | 0 | 0 | 0 | 109.6 | L201 Q205 | L201-G203 PolarHBondContact O-N 3.09Å; G203-Q205 PolarHBondContact O-N 3.01Å | ||
| 204 | A | 43.5 | Very low | 52.4 | Low | 100 Ų | 100 | 109.7 Ų | 109.7 | 83% | 0.826 | 76% | 0.757 | S | S | * | * | trans | -44.1 | 113.5 | -165.7 | 0 | 0 | 0 | 0 | 0 | 110.8 | P202 G206 | P202-A204 PolarHBondContact O-N 3.06Å; P202-A204 VanDerWaalsContact O-N 3.16Å; A204-G206 PolarHBondContact O-N 3.45Å | ||
| 205 | Q | 51.8 | Low | 52.3 | Low | 183 Ų | 183 | 110.5 Ų | 110.5 | 86% | 0.855 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -55.1 | 118.1 | -172.8 | -175.1 | 176.1 | 5.1 | 0 | 0 | 108.1 | G203 | G203-Q205 PolarHBondContact O-N 3.01Š|
| 206 | G | 56.3 | Low | 52.4 | Low | 48 Ų | 48 | 113.2 Ų | 113.2 | 50% | 0.495 | 77% | 0.766 | S | S | . | * | P | Polyproline II helix | trans | -53 | 146.1 | 179.1 | 0 | 0 | 0 | 0 | 0 | 109.8 | A204 | A204-G206 PolarHBondContact O-N 3.45Š|
| 207 | P | 52.9 | Low | 52.9 | Low | 121 Ų | 121 | 114.8 Ų | 114.8 | 79% | 0.786 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -49.7 | 131.7 | -179.9 | 22.6 | -33.8 | 0 | 0 | 0 | 108.5 | G209 | P207-G209 PolarHBondContact O-N 2.99Š|
| 208 | P | 61.7 | Low | 53.1 | Low | 116 Ų | 116 | 114.8 Ų | 114.8 | 75% | 0.753 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -46.6 | 122.2 | -174.8 | -31.1 | 35.5 | 0 | 0 | 0 | 110 | ||
| 209 | G | 54.1 | Low | 53.2 | Low | 61 Ų | 61 | 114.8 Ų | 114.8 | 63% | 0.629 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -50.7 | 133.1 | -177.3 | 0 | 0 | 0 | 0 | 0 | 108.7 | P207 Q211 | P207-G209 PolarHBondContact O-N 2.99Å; G209-Q211 PolarHBondContact O-N 3.16Å; G209-Q211 VanDerWaalsContact O-N 3.09Å |
| 210 | P | 53.2 | Low | 53.7 | Low | 128 Ų | 128 | 115.3 Ų | 115.3 | 83% | 0.831 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -51.7 | 125.6 | -173.1 | 21.9 | -33.5 | 0 | 0 | 0 | 108.3 | G212 | P210-G212 PolarHBondContact O-N 3.03Š|
| 211 | Q | 63.3 | Low | 54.1 | Low | 178 Ų | 178 | 114.3 Ų | 114.3 | 83% | 0.832 | 76% | 0.76 | S | S | * | * | P | Polyproline II helix | trans | -46.2 | 119.9 | -174.4 | 176.5 | 179 | -14.1 | 0 | 0 | 108.3 | G209 L213 | G209-Q211 PolarHBondContact O-N 3.16Å; G209-Q211 VanDerWaalsContact O-N 3.09Å; Q211-L213 PolarHBondContact O-N 3.18Å |
| 212 | G | 50.3 | Low | 54.7 | Low | 60 Ų | 60 | 112.7 Ų | 112.7 | 62% | 0.619 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -50.2 | 128.4 | -176.3 | 0 | 0 | 0 | 0 | 0 | 109 | P210 | P210-G212 PolarHBondContact O-N 3.03Š|
| 213 | L | 49 | Very low | 55.1 | Low | 162 Ų | 162 | 113.5 Ų | 113.5 | 85% | 0.848 | 76% | 0.762 | S | S | * | * | P | Polyproline II helix | trans | -48.3 | 132.7 | 177.7 | -69.2 | 172.6 | 0 | 0 | 0 | 107.9 | Q211 G215 | Q211-L213 PolarHBondContact O-N 3.18Å; L213-G215 PolarHBondContact O-N 3.29Å |
| 214 | P | 64.5 | Low | 55.3 | Low | 115 Ų | 115 | 113.1 Ų | 113.1 | 75% | 0.747 | 76% | 0.758 | S | S | * | * | P | Polyproline II helix | trans | -48.7 | 122.1 | 174.4 | -26.9 | 34.8 | 0 | 0 | 0 | 108.5 | E216 | P214-E216 PolarHBondContact O-N 3.31Š|
| 215 | G | 53.2 | Low | 55 | Low | 70 Ų | 70 | 116 Ų | 116 | 72% | 0.722 | 76% | 0.76 | S | S | * | * | P | Polyproline II helix | trans | -53.7 | 134 | -174.5 | 0 | 0 | 0 | 0 | 0 | 109.7 | L213 | L213-G215 PolarHBondContact O-N 3.29Š|
| 216 | E | 50.1 | Low | 54.7 | Low | 184 Ų | 184 | 114.6 Ų | 114.6 | 86% | 0.86 | 75% | 0.753 | S | S | * | * | P | Polyproline II helix | trans | -51.4 | 131.2 | 179.9 | -65.4 | -172.5 | 135.2 | 0 | 0 | 109 | P214 G218 | P214-E216 PolarHBondContact O-N 3.31Å; E216-G218 PolarHBondContact O-N 3.2Å |
| 217 | P | 64.4 | Low | 54.2 | Low | 129 Ų | 129 | 116.1 Ų | 116.1 | 84% | 0.838 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -51.8 | 117 | -179.9 | -28.8 | 35.8 | 0 | 0 | 0 | 110 | A219 | P217-A219 PolarHBondContact O-N 3.09Š|
| 218 | G | 54.9 | Low | 53.5 | Low | 69 Ų | 69 | 117.5 Ų | 117.5 | 71% | 0.711 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -53.1 | 132.8 | -172.4 | 0 | 0 | 0 | 0 | 0 | 110.8 | E216 I220 | E216-G218 PolarHBondContact O-N 3.2Å; G218-I220 PolarHBondContact O-N 3.19Å |
| 219 | A | 48.2 | Very low | 52.6 | Low | 102 Ų | 102 | 118.5 Ų | 118.5 | 84% | 0.843 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -49.4 | 125 | -175.4 | 0 | 0 | 0 | 0 | 0 | 110.5 | P217 G221 | P217-A219 PolarHBondContact O-N 3.09Å; A219-G221 PolarHBondContact O-N 3.27Å |
| 220 | I | 62.9 | Low | 52 | Low | 165 Ų | 165 | 119.2 Ų | 119.2 | 85% | 0.846 | 78% | 0.776 | S | S | * | * | trans | -59.9 | 111 | -179.9 | -63.8 | 175.3 | 0 | 0 | 0 | 107.4 | G218 | G218-I220 PolarHBondContact O-N 3.19Š| ||
| 221 | G | 56.8 | Low | 51.2 | Low | 48 Ų | 48 | 121.4 Ų | 121.4 | 50% | 0.495 | 78% | 0.776 | S | S | . | * | P | Polyproline II helix | trans | -61 | 144.2 | 176.4 | 0 | 0 | 0 | 0 | 0 | 110.2 | A219 T223 | A219-G221 PolarHBondContact O-N 3.27Å; G221-T223 PolarHBondContact O-N 3.41Å; G221-T223 VanDerWaalsContact O-N 3.15Å |
| 222 | P | 52.2 | Low | 50.3 | Low | 134 Ų | 134 | 119.5 Ų | 119.5 | 87% | 0.87 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -59.9 | 121.5 | 177.6 | 25.4 | -33.5 | 0 | 0 | 0 | 109.6 | G224 | P222-G224 PolarHBondContact O-N 2.75Š|
| 223 | T | 61.6 | Low | 49.9 | Very low | 137 Ų | 137 | 119.7 Ų | 119.7 | 84% | 0.84 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -63 | 118.9 | 172.5 | -57.4 | 0 | 0 | 0 | 0 | 108.4 | G221 | G221-T223 PolarHBondContact O-N 3.41Å; G221-T223 VanDerWaalsContact O-N 3.15Å |
| 224 | G | 56 | Low | 49.4 | Very low | 66 Ų | 66 | 120.1 Ų | 120.1 | 68% | 0.68 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -67.4 | 155.6 | -174 | 0 | 0 | 0 | 0 | 0 | 114.1 | P222 | P222-G224 PolarHBondContact O-N 2.75Š|
| 225 | D | 38.6 | Very low | 48.2 | Very low | 159 Ų | 159 | 126.8 Ų | 126.8 | 85% | 0.85 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -71.1 | 136.5 | -171.2 | -58.1 | -71.4 | 0 | 0 | 0 | 114.5 | ||
| 226 | Q | 44.7 | Very low | 47.7 | Very low | 154 Ų | 154 | 127 Ų | 127 | 72% | 0.72 | 79% | 0.791 | S | S | * | * | trans | 40 | 120.1 | 144 | -166.7 | 165.5 | -8.5 | 0 | 0 | 120.6 | E228 | Q226-E228 HydrophobicContact CG-CG 3.92Å; Q226-E228 PolarHBondContact NE2-OE1 3.09Å | ||
| 227 | G | 46.3 | Very low | 47.3 | Very low | 81 Ų | 81 | 122 Ų | 122 | 84% | 0.835 | 79% | 0.789 | S | S | * | * | trans | -125.8 | 137.6 | 153.3 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 228 | E | 38.7 | Very low | 46.5 | Very low | 150 Ų | 150 | 123.2 Ų | 123.2 | 70% | 0.701 | 79% | 0.794 | S | S | * | * | trans | -105.8 | 145.1 | -164.2 | -65.7 | -163.3 | 129.8 | 0 | 0 | 115.9 | Q226 | Q226-E228 HydrophobicContact CG-CG 3.92Å; Q226-E228 PolarHBondContact NE2-OE1 3.09Å | ||
| 229 | V | 40.8 | Very low | 45.9 | Very low | 136 Ų | 136 | 123 Ų | 123 | 82% | 0.824 | 79% | 0.792 | S | S | * | * | trans | 64 | 133.4 | 145 | 173 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 230 | G | 43 | Very low | 46 | Very low | 77 Ų | 77 | 127.8 Ų | 127.8 | 79% | 0.794 | 80% | 0.797 | S | S | * | * | trans | 178.2 | 111.3 | 163.3 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 231 | E | 35.8 | Very low | 45.7 | Very low | 174 Ų | 174 | 126.1 Ų | 126.1 | 81% | 0.813 | 80% | 0.797 | S | S | * | * | trans | -108.5 | 171.6 | -163.9 | -65.7 | -170.2 | 97.9 | 0 | 0 | 116.4 | ||||
| 232 | V | 44.4 | Very low | 45 | Very low | 138 Ų | 138 | 127.6 Ų | 127.6 | 84% | 0.836 | 81% | 0.812 | S | S | * | * | trans | 78.5 | 130.4 | 159.9 | -163.7 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 233 | G | 41.2 | Very low | 45 | Very low | 63 Ų | 63 | 131.3 Ų | 131.3 | 65% | 0.649 | 81% | 0.814 | S | S | * | * | cis | 164 | 161.8 | -12.8 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 234 | I | 38.5 | Very low | 44.2 | Very low | 172 Ų | 172 | 130.9 Ų | 130.9 | 88% | 0.882 | 81% | 0.814 | S | S | * | * | trans | 59.3 | 148.7 | 152 | 48.9 | 170 | 0 | 0 | 0 | 124.5 | ||||
| 235 | R | 40.3 | Very low | 43.8 | Very low | 254 Ų | 254 | 131 Ų | 131 | 96% | 0.958 | 81% | 0.814 | S | S | * | * | trans | 79.9 | 133.5 | 169.8 | -171.7 | -175.3 | -95.7 | -172.2 | -5.9 | 115.8 | ||||
| 236 | G | 42.1 | Very low | 44.3 | Very low | 74 Ų | 74 | 131.5 Ų | 131.5 | 76% | 0.763 | 82% | 0.817 | S | S | * | * | cis | -180 | 150 | -6 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 237 | G | 42.4 | Very low | 44.2 | Very low | 80 Ų | 80 | 130.3 Ų | 130.3 | 83% | 0.825 | 82% | 0.815 | S | S | * | * | trans | -120.5 | 170.4 | -158.8 | 0 | 0 | 0 | 0 | 0 | 119 | ||||
| 238 | V | 46.2 | Very low | 44.1 | Very low | 155 Ų | 155 | 128.8 Ų | 128.8 | 94% | 0.939 | 80% | 0.799 | S | S | * | * | trans | -156.2 | 150.2 | 172.1 | -178.9 | 0 | 0 | 0 | 0 | 105.8 | ||||
| 239 | G | 42.4 | Very low | 44.6 | Very low | 64 Ų | 64 | 130 Ų | 130 | 66% | 0.66 | 80% | 0.802 | S | S | * | * | cis | 153.5 | 144 | -2.8 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 240 | E | 51.7 | Low | 44.9 | Very low | 203 Ų | 203 | 129.9 Ų | 129.9 | 95% | 0.949 | 80% | 0.804 | S | S | * | * | trans | -84.3 | 143.2 | -175.4 | -71.3 | -162.2 | 142 | 0 | 0 | 114.8 | ||||
| 241 | P | 56.7 | Low | 45.2 | Very low | 130 Ų | 130 | 129.6 Ų | 129.6 | 84% | 0.844 | 80% | 0.802 | S | S | * | * | trans | -119.1 | 146.9 | 149.3 | 2 | 20.5 | 0 | 0 | 0 | 113.3 | ||||
| 242 | G | 41.1 | Very low | 45.9 | Very low | 79 Ų | 79 | 132.8 Ų | 132.8 | 81% | 0.814 | 81% | 0.806 | S | S | * | * | trans | -100.5 | -177.5 | -173.6 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 243 | K | 51.6 | Low | 45.7 | Very low | 211 Ų | 211 | 132.2 Ų | 132.2 | 92% | 0.917 | 81% | 0.805 | S | S | * | * | trans | -74.7 | 155 | -175.6 | -53.1 | 170.6 | -174.9 | 173.1 | 0 | 113.5 | ||||
| 244 | P | 46.1 | Very low | 45.9 | Very low | 129 Ų | 129 | 132.4 Ų | 132.4 | 84% | 0.838 | 81% | 0.807 | S | S | * | * | -150.6 | 173.5 | 111.5 | 37.4 | -20.1 | 0 | 0 | 0 | 117 | |||||
| 245 | G | 48 | Very low | 45.8 | Very low | 67 Ų | 67 | 132.9 Ų | 132.9 | 69% | 0.691 | 81% | 0.806 | S | S | * | * | trans | -109.2 | -160.7 | 162.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 246 | L | 47.5 | Very low | 45.8 | Very low | 171 Ų | 171 | 129 Ų | 129 | 90% | 0.895 | 80% | 0.798 | S | S | * | * | cis | -156.6 | -169.1 | 1.5 | -58.1 | 169.9 | 0 | 0 | 0 | 107.2 | ||||
| 247 | D | 42.4 | Very low | 45.6 | Very low | 128 Ų | 128 | 128.8 Ų | 128.8 | 68% | 0.684 | 80% | 0.796 | S | S | * | * | cis | -137.8 | -134.9 | -11.8 | -165.3 | 26 | 0 | 0 | 0 | 105.6 | K249 | D247-K249 IonicContact OD1-NZ 2.75Å; D247-K249 IonicContact OD2-NZ 2.75Å; D247-K249 PolarHBondContact OD2-NZ 3.35Å | ||
| 248 | G | 45.3 | Very low | 45.4 | Very low | 49 Ų | 49 | 132.5 Ų | 132.5 | 51% | 0.505 | 80% | 0.796 | S | S | . | * | cis | 176.2 | 70.1 | -4.3 | 0 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 249 | K | 49.3 | Very low | 45.2 | Very low | 176 Ų | 176 | 133.8 Ų | 133.8 | 77% | 0.765 | 79% | 0.791 | S | S | * | * | trans | 74.4 | 164.3 | 155 | -51.4 | 137.7 | -170.5 | 142.7 | 0 | 116.5 | D247 | D247-K249 IonicContact OD1-NZ 2.75Å; D247-K249 IonicContact OD2-NZ 2.75Å; D247-K249 PolarHBondContact OD2-NZ 3.35Å | ||
| 250 | P | 46.9 | Very low | 45.6 | Very low | 134 Ų | 134 | 133.8 Ų | 133.8 | 87% | 0.87 | 79% | 0.791 | S | S | * | * | -139.4 | 171.4 | 91.5 | 33.8 | -16.8 | 0 | 0 | 0 | 115.8 | |||||
| 251 | G | 50.3 | Low | 45 | Very low | 71 Ų | 71 | 130 Ų | 130 | 73% | 0.732 | 78% | 0.784 | S | S | * | * | trans | -118.2 | -164.2 | 167.2 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 252 | R | 49.1 | Very low | 44.8 | Very low | 240 Ų | 240 | 130 Ų | 130 | 91% | 0.906 | 78% | 0.784 | S | S | * | * | cis | -143.4 | -166.6 | 2.4 | -65.5 | 179.5 | 169.8 | -174.1 | -3 | 108.8 | ||||
| 253 | P | 41.3 | Very low | 45.1 | Very low | 127 Ų | 127 | 129.6 Ų | 129.6 | 83% | 0.825 | 78% | 0.78 | S | S | * | * | -139.3 | 176.9 | 86.9 | 23.3 | -1.1 | 0 | 0 | 0 | 115.7 | |||||
| 254 | G | 45.1 | Very low | 44.5 | Very low | 66 Ų | 66 | 128.9 Ų | 128.9 | 68% | 0.68 | 78% | 0.777 | S | S | * | * | trans | -83 | -170.7 | 166.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 255 | E | 35.8 | Very low | 44.4 | Very low | 183 Ų | 183 | 130.8 Ų | 130.8 | 86% | 0.855 | 78% | 0.78 | S | S | * | * | cis | -151.4 | 174.2 | 21.9 | -79.2 | -178.4 | 150.1 | 0 | 0 | 109.4 | ||||
| 256 | Q | 40 | Very low | 44.1 | Very low | 172 Ų | 172 | 131.2 Ų | 131.2 | 80% | 0.804 | 79% | 0.785 | S | S | * | * | cis | -170.3 | 128.5 | -25 | 166.1 | 178.6 | -64.4 | 0 | 0 | 109.5 | ||||
| 257 | G | 38.7 | Very low | 43.8 | Very low | 70 Ų | 70 | 131.9 Ų | 131.9 | 72% | 0.722 | 79% | 0.787 | S | S | * | * | trans | 66 | 164.9 | 160.2 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 258 | I | 38.2 | Very low | 44 | Very low | 158 Ų | 158 | 135 Ų | 135 | 81% | 0.81 | 80% | 0.798 | S | S | * | * | cis | -149.8 | 178.7 | -10.2 | 59.2 | 173.3 | 0 | 0 | 0 | 106.4 | ||||
| 259 | Q | 42.6 | Very low | 44.1 | Very low | 182 Ų | 182 | 136.1 Ų | 136.1 | 85% | 0.85 | 81% | 0.81 | S | S | * | * | cis | -159 | 160.2 | 6.8 | -164 | 177 | -9 | 0 | 0 | 109 | ||||
| 260 | G | 49.5 | Very low | 43.7 | Very low | 64 Ų | 64 | 137.2 Ų | 137.2 | 66% | 0.66 | 82% | 0.817 | S | S | * | * | trans | 113.8 | 132.4 | 157 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 261 | P | 38.8 | Very low | 43.9 | Very low | 122 Ų | 122 | 140.8 Ų | 140.8 | 79% | 0.792 | 82% | 0.819 | S | S | * | * | trans | -98 | 143.1 | -173.7 | 36 | -33.3 | 0 | 0 | 0 | 114.6 | ||||
| 262 | P | 52.8 | Low | 43.8 | Very low | 130 Ų | 130 | 140.4 Ų | 140.4 | 84% | 0.844 | 82% | 0.815 | S | S | * | * | trans | -65.1 | 127.9 | 152.2 | -17 | 31.9 | 0 | 0 | 0 | 110 | ||||
| 263 | G | 48.3 | Very low | 43.4 | Very low | 72 Ų | 72 | 137 Ų | 137 | 74% | 0.742 | 82% | 0.815 | S | S | * | * | trans | -94.1 | 111.3 | -175.4 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 264 | K | 38.4 | Very low | 44.1 | Very low | 195 Ų | 195 | 139 Ų | 139 | 85% | 0.848 | 82% | 0.817 | S | S | * | * | trans | 47 | 100.2 | 143.7 | -55.6 | -179.2 | -176.8 | -178.9 | 0 | 118.4 | ||||
| 265 | D | 44.6 | Very low | 44.1 | Very low | 169 Ų | 169 | 139 Ų | 139 | 90% | 0.904 | 82% | 0.816 | S | S | * | * | trans | 44.3 | 113 | 133 | -47.5 | -27.6 | 0 | 0 | 0 | 120.3 | ||||
| 266 | G | 40.4 | Very low | 44.4 | Very low | 77 Ų | 77 | 140.3 Ų | 140.3 | 79% | 0.794 | 82% | 0.82 | S | S | * | * | trans | -148.2 | 109.9 | 160.9 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 267 | I | 42.7 | Very low | 45 | Very low | 184 Ų | 184 | 143.2 Ų | 143.2 | 94% | 0.944 | 82% | 0.824 | S | S | * | * | trans | -69.8 | 132.5 | 175.5 | 45.6 | 168.2 | 0 | 0 | 0 | 111 | ||||
| 268 | Q | 46 | Very low | 45.5 | Very low | 194 Ų | 194 | 142.8 Ų | 142.8 | 91% | 0.907 | 82% | 0.819 | S | S | * | * | trans | -147.1 | 127.4 | 178.7 | -172.4 | 175.4 | 4.1 | 0 | 0 | 113.5 | ||||
| 269 | G | 48.5 | Very low | 45.7 | Very low | 73 Ų | 73 | 139.8 Ų | 139.8 | 75% | 0.753 | 82% | 0.818 | S | S | * | * | trans | 82 | 124 | 152.7 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 270 | Q | 38.9 | Very low | 46.7 | Very low | 198 Ų | 198 | 136.8 Ų | 136.8 | 93% | 0.925 | 81% | 0.814 | S | S | * | * | trans | -70.2 | 145.8 | 158.7 | -72 | 176.3 | -21.3 | 0 | 0 | 109.6 | G272 | Q270-G272 PolarHBondContact O-N 3.26Š| ||
| 271 | K | 51.1 | Low | 47 | Very low | 210 Ų | 210 | 136.7 Ų | 136.7 | 91% | 0.913 | 81% | 0.813 | S | S | * | * | trans | -69.7 | 115.3 | 173.1 | 177.9 | -178.9 | 173.6 | -176.3 | 0 | 109.2 | ||||
| 272 | G | 48.4 | Very low | 47.6 | Very low | 62 Ų | 62 | 137.1 Ų | 137.1 | 64% | 0.639 | 82% | 0.816 | S | S | * | * | trans | -68.5 | 168.2 | 179.8 | 0 | 0 | 0 | 0 | 0 | 114.5 | Q270 | Q270-G272 PolarHBondContact O-N 3.26Š| ||
| 273 | D | 40.6 | Very low | 47.9 | Very low | 168 Ų | 168 | 139.7 Ų | 139.7 | 90% | 0.898 | 82% | 0.816 | S | S | * | * | trans | -65 | 165.3 | -176 | -67.5 | -69 | 0 | 0 | 0 | 114.6 | G275 | D273-G275 PolarHBondContact O-N 2.68Š| ||
| 274 | I | 55.8 | Low | 48 | Very low | 170 Ų | 170 | 139.2 Ų | 139.2 | 87% | 0.872 | 81% | 0.812 | S | S | * | * | trans | -68.2 | 104.1 | -179.4 | -59.3 | 172.5 | 0 | 0 | 0 | 109.3 | F276 | I274-F276 PolarHBondContact O-N 3.4Š| ||
| 275 | G | 47.1 | Very low | 48.3 | Very low | 65 Ų | 65 | 138.5 Ų | 138.5 | 67% | 0.67 | 81% | 0.814 | S | S | * | * | trans | -56.1 | 135.4 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | D273 R277 | D273-G275 PolarHBondContact O-N 2.68Å; G275-R277 PolarHBondContact O-N 3.18Å | ||
| 276 | F | 41.5 | Very low | 49.3 | Very low | 211 Ų | 211 | 136 Ų | 136 | 93% | 0.925 | 81% | 0.807 | S | S | * | * | trans | -57.5 | 127.6 | 177.9 | -76.1 | -90.3 | 0 | 0 | 0 | 110.7 | I274 G278 | I274-F276 PolarHBondContact O-N 3.4Å; F276-G278 PolarHBondContact O-N 2.96Å | ||
| 277 | R | 52.3 | Low | 50 | Low | 234 Ų | 234 | 135.3 Ų | 135.3 | 88% | 0.883 | 80% | 0.8 | S | S | * | * | trans | -58.7 | 110.4 | 172.8 | -175 | -177.2 | -169.4 | 176.3 | 4.4 | 108.6 | G275 A279 | G275-R277 PolarHBondContact O-N 3.18Å; R277-A279 PolarHBondContact O-N 2.75Å | ||
| 278 | G | 48.4 | Very low | 50.4 | Low | 61 Ų | 61 | 132.9 Ų | 132.9 | 63% | 0.629 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -52.2 | 139.1 | 176.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | F276 | F276-G278 PolarHBondContact O-N 2.96Š|
| 279 | A | 42.9 | Very low | 50.5 | Low | 95 Ų | 95 | 134.8 Ų | 134.8 | 79% | 0.785 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -55.8 | 132.4 | 175.6 | 0 | 0 | 0 | 0 | 0 | 109.2 | R277 G281 | R277-A279 PolarHBondContact O-N 2.75Å; A279-G281 PolarHBondContact O-N 3.04Å |
| 280 | P | 63.3 | Low | 50.7 | Low | 119 Ų | 119 | 134.2 Ų | 134.2 | 77% | 0.773 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -52.5 | 132.2 | 169.3 | -24.5 | 34.3 | 0 | 0 | 0 | 109.2 | ||
| 281 | G | 56.6 | Low | 51.1 | Low | 61 Ų | 61 | 129.2 Ų | 129.2 | 63% | 0.629 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -55.9 | 145.6 | 173.5 | 0 | 0 | 0 | 0 | 0 | 109.9 | A279 E283 | A279-G281 PolarHBondContact O-N 3.04Å; G281-E283 PolarHBondContact O-N 2.89Å |
| 282 | P | 51.6 | Low | 51.5 | Low | 132 Ų | 132 | 124.9 Ų | 124.9 | 86% | 0.857 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -54.7 | 126.5 | 179.5 | 23.8 | -33.6 | 0 | 0 | 0 | 109.3 | G284 | P282-G284 PolarHBondContact O-N 2.85Å; P282-G284 VanDerWaalsContact O-N 3.14Å |
| 283 | E | 57.8 | Low | 51.7 | Low | 183 Ų | 183 | 125.3 Ų | 125.3 | 86% | 0.855 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -55.5 | 121.6 | -177.6 | -171.9 | 173.7 | -172.8 | 0 | 0 | 109.1 | G281 M285 | G281-E283 PolarHBondContact O-N 2.89Å; E283-M285 PolarHBondContact O-N 2.96Å |
| 284 | G | 51 | Low | 52.1 | Low | 63 Ų | 63 | 124 Ų | 124 | 65% | 0.649 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -58.6 | 123.3 | -171.8 | 0 | 0 | 0 | 0 | 0 | 110.2 | P282 P286 | P282-G284 PolarHBondContact O-N 2.85Å; P282-G284 VanDerWaalsContact O-N 3.14Å; G284-P286 WeakPolarHBondContact O-CD 3.48Å; G284-P286 VanDerWaalsContact O-N 3.09Å |
| 285 | M | 44.7 | Very low | 51.6 | Low | 179 Ų | 179 | 121.8 Ų | 121.8 | 88% | 0.882 | 78% | 0.777 | S | S | * | * | trans | -45.6 | 119.3 | -176.3 | -70.2 | -175 | 71.8 | 0 | 0 | 110.3 | E283 G287 | E283-M285 PolarHBondContact O-N 2.96Å; M285-G287 PolarHBondContact O-N 2.83Å; M285-G287 VanDerWaalsContact O-N 3.11Å | ||
| 286 | P | 65.6 | Low | 51.5 | Low | 118 Ų | 118 | 122.1 Ų | 122.1 | 77% | 0.766 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -53 | 122.8 | -177.7 | -30.4 | 36.2 | 0 | 0 | 0 | 110.7 | G284 | G284-P286 WeakPolarHBondContact O-CD 3.48Å; G284-P286 VanDerWaalsContact O-N 3.09Å |
| 287 | G | 55.3 | Low | 51.6 | Low | 62 Ų | 62 | 117.6 Ų | 117.6 | 64% | 0.639 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -53.1 | 139.5 | -176.9 | 0 | 0 | 0 | 0 | 0 | 110.7 | M285 R289 | M285-G287 PolarHBondContact O-N 2.83Å; M285-G287 VanDerWaalsContact O-N 3.11Å; G287-R289 PolarHBondContact O-N 3.48Å |
| 288 | P | 50.4 | Low | 51.6 | Low | 132 Ų | 132 | 112.8 Ų | 112.8 | 86% | 0.857 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -54.7 | 117 | -170.9 | 21.4 | -33.2 | 0 | 0 | 0 | 110.2 | G290 | P288-G290 PolarHBondContact O-N 2.86Š|
| 289 | R | 49.7 | Very low | 51.4 | Low | 235 Ų | 235 | 113.5 Ų | 113.5 | 89% | 0.887 | 78% | 0.781 | S | S | * | * | trans | -50 | 115.4 | -173.4 | -178.6 | 178.6 | -178.4 | 172.7 | 1.7 | 109.6 | G287 A291 | G287-R289 PolarHBondContact O-N 3.48Å; R289-A291 PolarHBondContact O-N 2.92Å | ||
| 290 | G | 52.6 | Low | 51.4 | Low | 61 Ų | 61 | 118 Ų | 118 | 63% | 0.629 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -51.5 | 138.5 | 179.3 | 0 | 0 | 0 | 0 | 0 | 111 | P288 | P288-G290 PolarHBondContact O-N 2.86Š|
| 291 | A | 46.7 | Very low | 50.6 | Low | 93 Ų | 93 | 121.4 Ų | 121.4 | 77% | 0.769 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -53.1 | 134.6 | -178.8 | 0 | 0 | 0 | 0 | 0 | 110.1 | R289 G293 | R289-A291 PolarHBondContact O-N 2.92Å; A291-G293 PolarHBondContact O-N 3.47Å |
| 292 | P | 60 | Low | 49.9 | Very low | 118 Ų | 118 | 121.2 Ų | 121.2 | 77% | 0.766 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -52.5 | 126.2 | 179.7 | -27.8 | 35.4 | 0 | 0 | 0 | 111.2 | T294 | P292-T294 PolarHBondContact O-N 3.01Š|
| 293 | G | 50.9 | Low | 49.2 | Very low | 72 Ų | 72 | 121.7 Ų | 121.7 | 74% | 0.742 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -59.9 | 128.4 | -175.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | A291 S295 | A291-G293 PolarHBondContact O-N 3.47Å; G293-S295 PolarHBondContact O-N 2.82Å |
| 294 | T | 49.9 | Very low | 48.3 | Very low | 139 Ų | 139 | 123.1 Ų | 123.1 | 85% | 0.853 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -63.2 | 117 | 173.8 | 48.8 | 0 | 0 | 0 | 0 | 109.6 | P292 G296 | P292-T294 PolarHBondContact O-N 3.01Å; T294-G296 PolarHBondContact O-N 3.48Å |
| 295 | S | 45.3 | Very low | 48 | Very low | 124 Ų | 124 | 123.7 Ų | 123.7 | 87% | 0.867 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -54.6 | 131.3 | 176.1 | -53.3 | 0 | 0 | 0 | 0 | 110.8 | G293 | G293-S295 PolarHBondContact O-N 2.82Š|
| 296 | G | 45.5 | Very low | 47.7 | Very low | 73 Ų | 73 | 120.3 Ų | 120.3 | 75% | 0.753 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -70.8 | 142.3 | -171.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | T294 | T294-G296 PolarHBondContact O-N 3.48Š|
| 297 | S | 43.5 | Very low | 46.7 | Very low | 115 Ų | 115 | 122.9 Ų | 122.9 | 80% | 0.804 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -73.4 | 127.4 | 161.1 | 51.8 | 0 | 0 | 0 | 0 | 109.9 | ||
| 298 | P | 53 | Low | 46 | Very low | 134 Ų | 134 | 123.2 Ų | 123.2 | 87% | 0.87 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -57.6 | 154.7 | 170.8 | -24.5 | 35.2 | 0 | 0 | 0 | 112.5 | ||
| 299 | G | 43.9 | Very low | 45.4 | Very low | 75 Ų | 75 | 123.3 Ų | 123.3 | 77% | 0.773 | 80% | 0.801 | S | S | * | * | trans | -117.6 | 134.9 | -173.7 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 300 | E | 42.3 | Very low | 45.2 | Very low | 191 Ų | 191 | 117.9 Ų | 117.9 | 89% | 0.893 | 80% | 0.799 | S | S | * | * | trans | -148 | 158.1 | 170.3 | -68.7 | -173.1 | 158.6 | 0 | 0 | 107.6 | ||||
| 301 | Q | 45.8 | Very low | 44.7 | Very low | 189 Ų | 189 | 118.3 Ų | 118.3 | 88% | 0.883 | 80% | 0.804 | S | S | * | * | cis | -152 | 162 | -31.6 | -179.3 | 165.9 | -64.2 | 0 | 0 | 106.5 | ||||
| 302 | G | 43 | Very low | 44.5 | Very low | 58 Ų | 58 | 120.2 Ų | 120.2 | 60% | 0.598 | 81% | 0.808 | S | S | * | * | trans | -84.8 | 143.1 | -159 | 0 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 303 | T | 37.2 | Very low | 43.7 | Very low | 141 Ų | 141 | 120.6 Ų | 120.6 | 87% | 0.865 | 81% | 0.813 | S | S | * | * | trans | 81.2 | 148.7 | 133.7 | 70.4 | 0 | 0 | 0 | 0 | 123.1 | ||||
| 304 | K | 39 | Very low | 43.2 | Very low | 213 Ų | 213 | 120.4 Ų | 120.4 | 93% | 0.926 | 81% | 0.812 | S | S | * | * | trans | 78.7 | 139.9 | 156.4 | -142.8 | 172.7 | -174.7 | 178.8 | 0 | 115.8 | ||||
| 305 | G | 44.1 | Very low | 42.4 | Very low | 75 Ų | 75 | 121.8 Ų | 121.8 | 77% | 0.773 | 81% | 0.814 | S | S | * | * | cis | -153.8 | -165 | 1.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 306 | S | 38.5 | Very low | 42.5 | Very low | 109 Ų | 109 | 127.9 Ų | 127.9 | 76% | 0.762 | 82% | 0.818 | S | S | * | * | trans | -111.7 | 179.1 | -162 | 54.3 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 307 | I | 43.3 | Very low | 42.3 | Very low | 171 Ų | 171 | 127.7 Ų | 127.7 | 88% | 0.877 | 82% | 0.816 | S | S | * | * | trans | 86.4 | 133.9 | 179.5 | -51.1 | 157.5 | 0 | 0 | 0 | 112.2 | ||||
| 308 | G | 40.9 | Very low | 42.3 | Very low | 70 Ų | 70 | 128.4 Ų | 128.4 | 72% | 0.722 | 82% | 0.818 | S | S | * | * | cis | -179.7 | -171.2 | -0 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 309 | V | 39.2 | Very low | 42.1 | Very low | 134 Ų | 134 | 131 Ų | 131 | 81% | 0.812 | 82% | 0.818 | S | S | * | * | cis | -154.7 | -171.6 | -4.6 | -165.5 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 310 | S | 43.5 | Very low | 42.3 | Very low | 120 Ų | 120 | 131 Ų | 131 | 84% | 0.839 | 82% | 0.818 | S | S | * | * | trans | -55.1 | 168.1 | 175.3 | -43 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 311 | G | 42.3 | Very low | 42.3 | Very low | 71 Ų | 71 | 129.3 Ų | 129.3 | 73% | 0.732 | 82% | 0.815 | S | S | * | * | cis | 172.5 | -157 | 6.5 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 312 | P | 43.4 | Very low | 42.2 | Very low | 133 Ų | 133 | 125.6 Ų | 125.6 | 86% | 0.864 | 82% | 0.817 | S | S | * | * | cis | -130.8 | -148.2 | -19.9 | 43.2 | -23 | 0 | 0 | 0 | 113.5 | ||||
| 313 | S | 42.7 | Very low | 42.3 | Very low | 125 Ų | 125 | 125.7 Ų | 125.7 | 87% | 0.874 | 82% | 0.818 | S | S | * | * | trans | -59.2 | 164.7 | -175.9 | -50 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 314 | G | 39.8 | Very low | 43 | Very low | 69 Ų | 69 | 125.1 Ų | 125.1 | 71% | 0.711 | 82% | 0.817 | S | S | * | * | cis | 164.5 | -170.4 | -3.3 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 315 | N | 34 | Very low | 43.4 | Very low | 168 Ų | 168 | 121.4 Ų | 121.4 | 90% | 0.898 | 81% | 0.814 | S | S | * | * | trans | 69.9 | 92.9 | 164.5 | -66.9 | -11.8 | 0 | 0 | 0 | 123.3 | ||||
| 316 | R | 46.8 | Very low | 43.3 | Very low | 252 Ų | 252 | 120.9 Ų | 120.9 | 95% | 0.951 | 81% | 0.809 | S | S | * | * | trans | 50 | 112.6 | 133.2 | -162.5 | -178.2 | -165.4 | -175 | 4.5 | 121.7 | ||||
| 317 | G | 41.3 | Very low | 43.7 | Very low | 69 Ų | 69 | 123.3 Ų | 123.3 | 71% | 0.711 | 82% | 0.819 | S | S | * | * | trans | -139.3 | 157.3 | 152.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 318 | P | 43.4 | Very low | 43.9 | Very low | 129 Ų | 129 | 122.8 Ų | 122.8 | 84% | 0.838 | 82% | 0.816 | S | S | * | * | trans | -101.6 | 148.4 | -166.3 | 37.2 | -34.3 | 0 | 0 | 0 | 116.8 | ||||
| 319 | Q | 50.2 | Low | 44.5 | Very low | 189 Ų | 189 | 122.3 Ų | 122.3 | 88% | 0.883 | 81% | 0.811 | S | S | * | * | trans | 51.4 | 114.1 | 152.4 | -169.7 | 170.8 | -14.5 | 0 | 0 | 120.6 | ||||
| 320 | G | 46.8 | Very low | 44.8 | Very low | 74 Ų | 74 | 122.3 Ų | 122.3 | 76% | 0.763 | 81% | 0.814 | S | S | * | * | trans | -153.3 | 146.4 | 155.8 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 321 | N | 44 | Very low | 45.2 | Very low | 157 Ų | 157 | 128.3 Ų | 128.3 | 84% | 0.84 | 82% | 0.818 | S | S | * | * | trans | -105.5 | 159.9 | -178.1 | -88.3 | -14 | 0 | 0 | 0 | 112.2 | ||||
| 322 | A | 41.9 | Very low | 45.7 | Very low | 110 Ų | 110 | 127.9 Ų | 127.9 | 91% | 0.909 | 81% | 0.814 | S | S | * | * | trans | 74.8 | 146.3 | -175.6 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 323 | G | 45.3 | Very low | 45.7 | Very low | 61 Ų | 61 | 129.5 Ų | 129.5 | 63% | 0.629 | 82% | 0.815 | S | S | * | * | cis | -141.6 | 175.1 | 0.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 324 | P | 52.3 | Low | 46.5 | Very low | 129 Ų | 129 | 129.5 Ų | 129.5 | 84% | 0.838 | 81% | 0.811 | S | S | * | * | trans | -65.1 | 157 | 160.9 | 32.6 | -34.8 | 0 | 0 | 0 | 109.5 | ||||
| 325 | P | 47.9 | Very low | 47.1 | Very low | 134 Ų | 134 | 129.1 Ų | 129.1 | 87% | 0.87 | 81% | 0.808 | S | S | * | * | cis | -137 | -173.4 | 31.4 | 41.7 | -24 | 0 | 0 | 0 | 115.1 | ||||
| 326 | G | 42 | Very low | 47.7 | Very low | 65 Ų | 65 | 126.4 Ų | 126.4 | 67% | 0.67 | 80% | 0.799 | S | S | * | * | trans | 159.4 | 94.6 | 167.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | I328 | G326-I328 PolarHBondContact O-N 3.11Š| ||
| 327 | V | 47 | Very low | 48.4 | Very low | 159 Ų | 159 | 120.8 Ų | 120.8 | 96% | 0.964 | 80% | 0.795 | S | S | * | * | trans | -77.1 | 110.9 | 172.8 | -128.3 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 328 | I | 47.9 | Very low | 48.8 | Very low | 160 Ų | 160 | 120.8 Ų | 120.8 | 82% | 0.821 | 80% | 0.796 | S | S | * | * | trans | -113.8 | 130.8 | 173.1 | -63.7 | 179 | 0 | 0 | 0 | 107.7 | G326 | G326-I328 PolarHBondContact O-N 3.11Š| ||
| 329 | G | 52.3 | Low | 48.6 | Very low | 60 Ų | 60 | 124.3 Ų | 124.3 | 62% | 0.619 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -65.5 | 166.3 | -166 | 0 | 0 | 0 | 0 | 0 | 115.3 | R331 | G329-R331 PolarHBondContact O-N 3.25Š|
| 330 | P | 46.7 | Very low | 48.7 | Very low | 134 Ų | 134 | 120.8 Ų | 120.8 | 87% | 0.87 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -59.8 | 123.5 | 177.4 | 26.1 | -34 | 0 | 0 | 0 | 110.6 | G332 | P330-G332 PolarHBondContact O-N 3.4Š|
| 331 | R | 51 | Low | 48.8 | Very low | 246 Ų | 246 | 120.4 Ų | 120.4 | 93% | 0.928 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -56.9 | 120.9 | 172.7 | 178.8 | 178.5 | -179.5 | 165.5 | 1.2 | 109.4 | G329 | G329-R331 PolarHBondContact O-N 3.25Š|
| 332 | G | 52.5 | Low | 48.5 | Very low | 63 Ų | 63 | 123.1 Ų | 123.1 | 65% | 0.649 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -55.3 | 148.2 | 179 | 0 | 0 | 0 | 0 | 0 | 112.8 | P330 | P330-G332 PolarHBondContact O-N 3.4Š|
| 333 | L | 43.7 | Very low | 48.9 | Very low | 167 Ų | 167 | 123.8 Ų | 123.8 | 87% | 0.874 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -65.4 | 143.5 | 174.6 | -66.6 | 172.7 | 0 | 0 | 0 | 110 | G335 | L333-G335 PolarHBondContact O-N 2.77Š|
| 334 | P | 59.1 | Low | 48.8 | Very low | 124 Ų | 124 | 124.2 Ų | 124.2 | 81% | 0.805 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -60 | 131.3 | 167.6 | -19.7 | 32.5 | 0 | 0 | 0 | 110.1 | ||
| 335 | G | 53.6 | Low | 48.3 | Very low | 61 Ų | 61 | 126.6 Ų | 126.6 | 63% | 0.629 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -64.2 | 154.4 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | L333 | L333-G335 PolarHBondContact O-N 2.77Š|
| 336 | P | 47.2 | Very low | 48.5 | Very low | 112 Ų | 112 | 125.9 Ų | 125.9 | 73% | 0.727 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -65.2 | 143.8 | 178.2 | 28.1 | -34.5 | 0 | 0 | 0 | 111.4 | G338 | P336-G338 PolarHBondContact O-N 3.28Š|
| 337 | P | 60.1 | Low | 48.6 | Very low | 133 Ų | 133 | 126.6 Ų | 126.6 | 86% | 0.864 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -60.9 | 130.1 | 168.1 | -21.6 | 33.7 | 0 | 0 | 0 | 111.1 | ||
| 338 | G | 50.6 | Low | 48.3 | Very low | 70 Ų | 70 | 125 Ų | 125 | 72% | 0.722 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -71.6 | 155.8 | -176.6 | 0 | 0 | 0 | 0 | 0 | 114.5 | P336 | P336-G338 PolarHBondContact O-N 3.28Š|
| 339 | E | 38 | Very low | 48.6 | Very low | 202 Ų | 202 | 126.9 Ų | 126.9 | 94% | 0.944 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -69.3 | 141.7 | 178.4 | -61.8 | -162.9 | 138.8 | 0 | 0 | 112.8 | ||
| 340 | V | 52.7 | Low | 48.4 | Very low | 116 Ų | 116 | 126.8 Ų | 126.8 | 70% | 0.703 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -101.8 | 124.4 | 168.8 | 178.7 | 0 | 0 | 0 | 0 | 108.9 | ||
| 341 | G | 50.2 | Low | 48.2 | Very low | 65 Ų | 65 | 126.5 Ų | 126.5 | 67% | 0.67 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -64.9 | 156.7 | -172.4 | 0 | 0 | 0 | 0 | 0 | 115.5 | P343 | G341-P343 WeakPolarHBondContact O-CD 3.38Š|
| 342 | K | 37.4 | Very low | 48.7 | Very low | 214 Ų | 214 | 120.8 Ų | 120.8 | 93% | 0.93 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -83.1 | 124 | -173.8 | -59.1 | 174.6 | -175.6 | 173.4 | 0 | 112.8 | ||
| 343 | P | 50.4 | Low | 48.6 | Very low | 124 Ų | 124 | 121 Ų | 121 | 81% | 0.805 | 79% | 0.794 | S | S | * | * | trans | -105.1 | 120.4 | 169.3 | 6.9 | 15.1 | 0 | 0 | 0 | 112.6 | G341 | G341-P343 WeakPolarHBondContact O-CD 3.38Š| ||
| 344 | G | 41.5 | Very low | 48.4 | Very low | 70 Ų | 70 | 117.4 Ų | 117.4 | 72% | 0.722 | 79% | 0.788 | S | S | * | * | trans | 71.9 | 139 | 153.2 | 0 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 345 | I | 43.6 | Very low | 48.4 | Very low | 179 Ų | 179 | 121.4 Ų | 121.4 | 92% | 0.918 | 79% | 0.792 | S | S | * | * | trans | -119.7 | 110.2 | 164.5 | -53.7 | 174.2 | 0 | 0 | 0 | 108.8 | ||||
| 346 | P | 51 | Low | 48.4 | Very low | 120 Ų | 120 | 120 Ų | 120 | 78% | 0.779 | 78% | 0.778 | S | S | * | * | trans | -122.8 | 133.7 | 169.6 | 14.7 | 7.4 | 0 | 0 | 0 | 113.6 | ||||
| 347 | G | 44.6 | Very low | 48.2 | Very low | 79 Ų | 79 | 120.2 Ų | 120.2 | 81% | 0.814 | 78% | 0.783 | S | S | * | * | trans | 85.4 | 103.1 | 155.4 | 0 | 0 | 0 | 0 | 0 | 117.4 | Q349 | G347-Q349 PolarHBondContact O-N 3.23Š| ||
| 348 | S | 40.8 | Very low | 48 | Very low | 127 Ų | 127 | 118.6 Ų | 118.6 | 89% | 0.888 | 78% | 0.78 | S | S | * | * | trans | -76.4 | 116.3 | 166.9 | 54.6 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 349 | Q | 54.2 | Low | 48.1 | Very low | 198 Ų | 198 | 117.6 Ų | 117.6 | 93% | 0.925 | 77% | 0.77 | S | S | * | * | trans | -107 | 155.6 | 170.6 | -161.3 | 167.4 | 2.4 | 0 | 0 | 110.7 | G347 | G347-Q349 PolarHBondContact O-N 3.23Š| ||
| 350 | G | 48.8 | Very low | 48.4 | Very low | 58 Ų | 58 | 115 Ų | 115 | 60% | 0.598 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -65.3 | 172.9 | -162.1 | 0 | 0 | 0 | 0 | 0 | 117.7 | ||
| 351 | P | 42.4 | Very low | 48.8 | Very low | 129 Ų | 129 | 114 Ų | 114 | 84% | 0.838 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -62.1 | 144.4 | -169.9 | 24.6 | -34.6 | 0 | 0 | 0 | 113.3 | ||
| 352 | P | 60.5 | Low | 49.2 | Very low | 126 Ų | 126 | 114.1 Ų | 114.1 | 82% | 0.818 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -70 | 147.3 | -172.9 | -19.7 | 33 | 0 | 0 | 0 | 114.4 | ||
| 353 | G | 50.2 | Low | 49.5 | Very low | 67 Ų | 67 | 109.2 Ų | 109.2 | 69% | 0.691 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -68.4 | 140.4 | 160.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | K355 | G353-K355 PolarHBondContact O-N 3.38Å; G353-K355 VanDerWaalsContact O-N 3.17Å |
| 354 | A | 40.7 | Very low | 50.3 | Low | 91 Ų | 91 | 109.4 Ų | 109.4 | 75% | 0.752 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -61.7 | 116 | -175.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||
| 355 | K | 57.2 | Low | 51.2 | Low | 208 Ų | 208 | 109.3 Ų | 109.3 | 90% | 0.904 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -85.1 | 129.9 | 171.6 | -172 | 177.2 | -179.6 | -178.3 | 0 | 109 | G353 | G353-K355 PolarHBondContact O-N 3.38Å; G353-K355 VanDerWaalsContact O-N 3.17Å |
| 356 | G | 54.7 | Low | 51.3 | Low | 32 Ų | 32 | 105.2 Ų | 105.2 | 33% | 0.33 | 76% | 0.759 | S | S | . | * | P | Polyproline II helix | trans | -61.9 | 156.6 | -173.3 | 0 | 0 | 0 | 0 | 0 | 115.3 | A358 | G356-A358 PolarHBondContact O-N 2.84Š|
| 357 | S | 42 | Very low | 51.8 | Low | 117 Ų | 117 | 105.7 Ų | 105.7 | 82% | 0.818 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -53.6 | 126.1 | 174.2 | 36.2 | 0 | 0 | 0 | 0 | 111.4 | ||
| 358 | A | 56.2 | Low | 52.3 | Low | 98 Ų | 98 | 105.2 Ų | 105.2 | 81% | 0.81 | 76% | 0.757 | S | S | * | * | P | Polyproline II helix | trans | -68.6 | 134.3 | 169.7 | 0 | 0 | 0 | 0 | 0 | 109.3 | G356 | G356-A358 PolarHBondContact O-N 2.84Š|
| 359 | G | 53.8 | Low | 52.6 | Low | 49 Ų | 49 | 110.8 Ų | 110.8 | 51% | 0.505 | 76% | 0.758 | S | S | . | * | P | Polyproline II helix | trans | -63.6 | 150.3 | 176 | 0 | 0 | 0 | 0 | 0 | 111.9 | A361 | G359-A361 PolarHBondContact O-N 3.02Š|
| 360 | V | 44 | Very low | 52.7 | Low | 149 Ų | 149 | 107.3 Ų | 107.3 | 90% | 0.903 | 75% | 0.753 | S | S | * | * | P | Polyproline II helix | trans | -54.9 | 124.5 | 176.8 | -179.4 | 0 | 0 | 0 | 0 | 109.7 | G362 | V360-G362 PolarHBondContact O-N 2.97Š|
| 361 | A | 60.7 | Low | 52.8 | Low | 93 Ų | 93 | 107.9 Ų | 107.9 | 77% | 0.769 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -66.2 | 119 | 174.7 | 0 | 0 | 0 | 0 | 0 | 109.4 | G359 | G359-A361 PolarHBondContact O-N 3.02Š|
| 362 | G | 58.9 | Low | 53.1 | Low | 69 Ų | 69 | 109.7 Ų | 109.7 | 71% | 0.711 | 76% | 0.76 | S | S | * | * | P | Polyproline II helix | trans | -59.8 | 142.1 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | V360 | V360-G362 PolarHBondContact O-N 2.97Š|
| 363 | S | 44.1 | Very low | 52.5 | Low | 110 Ų | 110 | 111.5 Ų | 111.5 | 77% | 0.769 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -50.9 | 131 | 173.9 | 52.7 | 0 | 0 | 0 | 0 | 110.6 | G365 | S363-G365 PolarHBondContact O-N 3.48Š|
| 364 | P | 67.3 | Low | 52.4 | Low | 129 Ų | 129 | 111.7 Ų | 111.7 | 84% | 0.838 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -52.4 | 125 | 177.6 | -27.9 | 35.3 | 0 | 0 | 0 | 111.2 | ||
| 365 | G | 58.8 | Low | 52.5 | Low | 68 Ų | 68 | 118.8 Ų | 118.8 | 70% | 0.701 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -57.4 | 141 | 179.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | S363 | S363-G365 PolarHBondContact O-N 3.48Š|
| 366 | A | 45.6 | Very low | 52.4 | Low | 93 Ų | 93 | 115 Ų | 115 | 77% | 0.769 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -51.9 | 136.7 | 177.6 | 0 | 0 | 0 | 0 | 0 | 110.4 | G368 | A366-G368 PolarHBondContact O-N 2.89Å; A366-G368 VanDerWaalsContact O-N 3.13Å |
| 367 | P | 62.7 | Low | 52.2 | Low | 129 Ų | 129 | 116.8 Ų | 116.8 | 84% | 0.838 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -52.1 | 123.6 | 178.5 | -27.6 | 35.2 | 0 | 0 | 0 | 110.7 | R369 | P367-R369 PolarHBondContact O-N 2.77Š|
| 368 | G | 54.9 | Low | 52.2 | Low | 70 Ų | 70 | 117.8 Ų | 117.8 | 72% | 0.722 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -55.1 | 136 | 179.4 | 0 | 0 | 0 | 0 | 0 | 110.3 | A366 | A366-G368 PolarHBondContact O-N 2.89Å; A366-G368 VanDerWaalsContact O-N 3.13Å |
| 369 | R | 47.1 | Very low | 52.5 | Low | 243 Ų | 243 | 118.9 Ų | 118.9 | 92% | 0.917 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -51.1 | 137.7 | 172.7 | -71.3 | -173.4 | 176.2 | -162.6 | -0.1 | 108.6 | P367 G371 | P367-R369 PolarHBondContact O-N 2.77Å; R369-G371 PolarHBondContact O-N 2.78Å |
| 370 | P | 56.1 | Low | 52.4 | Low | 125 Ų | 125 | 119.8 Ų | 119.8 | 81% | 0.812 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -47.8 | 130.5 | 174.2 | -28.7 | 35.5 | 0 | 0 | 0 | 110.4 | I372 | P370-I372 PolarHBondContact O-N 2.83Š|
| 371 | G | 51.2 | Low | 52.5 | Low | 71 Ų | 71 | 118.9 Ų | 118.9 | 73% | 0.732 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -59.4 | 129 | -179.2 | 0 | 0 | 0 | 0 | 0 | 109.8 | R369 D373 | R369-G371 PolarHBondContact O-N 2.78Å; G371-D373 PolarHBondContact O-N 2.82Å |
| 372 | I | 48 | Very low | 51.9 | Low | 167 Ų | 167 | 119 Ų | 119 | 86% | 0.856 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -57.4 | 136.2 | 165.8 | 51.7 | 173 | 0 | 0 | 0 | 108.7 | P370 G374 | P370-I372 PolarHBondContact O-N 2.83Å; I372-G374 PolarHBondContact O-N 2.85Å; I372-G374 VanDerWaalsContact O-N 3.11Å |
| 373 | D | 47.7 | Very low | 51.3 | Low | 164 Ų | 164 | 119.7 Ų | 119.7 | 88% | 0.877 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -55.7 | 120.9 | -176.7 | -75.5 | -53.9 | 0 | 0 | 0 | 110.8 | G371 R375 | G371-D373 PolarHBondContact O-N 2.82Å; D373-R375 PolarHBondContact O-N 3.19Å; D373-R375 VanDerWaalsContact O-N 3.15Å |
| 374 | G | 48.2 | Very low | 51.2 | Low | 70 Ų | 70 | 124.1 Ų | 124.1 | 72% | 0.722 | 81% | 0.807 | S | S | * | * | trans | -66.1 | 115 | -175.8 | 0 | 0 | 0 | 0 | 0 | 110.5 | I372 | I372-G374 PolarHBondContact O-N 2.85Å; I372-G374 VanDerWaalsContact O-N 3.11Å | ||
| 375 | R | 44.2 | Very low | 50.1 | Low | 240 Ų | 240 | 124 Ų | 124 | 91% | 0.906 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -51.7 | 130.8 | 165.6 | -74.5 | -175.3 | 173.3 | -170.9 | -3 | 108.5 | D373 G377 | D373-R375 PolarHBondContact O-N 3.19Å; D373-R375 VanDerWaalsContact O-N 3.15Å; R375-G377 PolarHBondContact O-N 2.83Å |
| 376 | P | 54.6 | Low | 49.7 | Very low | 128 Ų | 128 | 124.1 Ų | 124.1 | 83% | 0.831 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -49.5 | 129 | -179 | -31.2 | 36.4 | 0 | 0 | 0 | 112.2 | ||
| 377 | G | 49.9 | Very low | 49.4 | Very low | 70 Ų | 70 | 125 Ų | 125 | 72% | 0.722 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -68.2 | 138.1 | -168.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | R375 | R375-G377 PolarHBondContact O-N 2.83Š|
| 378 | V | 42.6 | Very low | 48.6 | Very low | 138 Ų | 138 | 123.5 Ų | 123.5 | 84% | 0.836 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -66.3 | 128.3 | 166 | -174.4 | 0 | 0 | 0 | 0 | 108.2 | G380 | V378-G380 PolarHBondContact O-N 3.34Š|
| 379 | P | 61.2 | Low | 48.2 | Very low | 121 Ų | 121 | 121 Ų | 121 | 79% | 0.786 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -56.5 | 128 | -179.7 | -27.9 | 36.1 | 0 | 0 | 0 | 112.6 | ||
| 380 | G | 52 | Low | 48.1 | Very low | 68 Ų | 68 | 115.9 Ų | 115.9 | 70% | 0.701 | 75% | 0.75 | S | S | * | * | P | Polyproline II helix | trans | -72.7 | 136.8 | -175.6 | 0 | 0 | 0 | 0 | 0 | 113 | V378 | V378-G380 PolarHBondContact O-N 3.34Š|
| 381 | P | 46.5 | Very low | 47.6 | Very low | 130 Ų | 130 | 116.2 Ų | 116.2 | 84% | 0.844 | 75% | 0.75 | S | S | * | * | P | Polyproline II helix | trans | -66.2 | 140.8 | 172.3 | 28.4 | -34 | 0 | 0 | 0 | 110.9 | G383 | P381-G383 PolarHBondContact O-N 3.27Š|
| 382 | A | 48.1 | Very low | 47.7 | Very low | 97 Ų | 97 | 115.8 Ų | 115.8 | 80% | 0.802 | 75% | 0.745 | S | S | * | * | P | Polyproline II helix | trans | -62.8 | 130.4 | -172.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||
| 383 | G | 47.6 | Very low | 47.5 | Very low | 82 Ų | 82 | 114.1 Ų | 114.1 | 85% | 0.845 | 75% | 0.745 | S | S | * | * | P | Polyproline II helix | trans | -68.8 | 136.6 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | P381 | P381-G383 PolarHBondContact O-N 3.27Š|
| 384 | K | 40.2 | Very low | 47.2 | Very low | 204 Ų | 204 | 118 Ų | 118 | 89% | 0.887 | 75% | 0.747 | S | S | * | * | P | Polyproline II helix | trans | -101.4 | 131.5 | 171.4 | -68 | -174.6 | 177.4 | -177.8 | 0 | 110 | ||
| 385 | S | 45.6 | Very low | 46.9 | Very low | 126 Ų | 126 | 118 Ų | 118 | 88% | 0.881 | 75% | 0.748 | S | S | * | * | P | Polyproline II helix | trans | -64.4 | 134.6 | 174.3 | 37.6 | 0 | 0 | 0 | 0 | 110.9 | ||
| 386 | G | 49.1 | Very low | 46.7 | Very low | 71 Ų | 71 | 115.4 Ų | 115.4 | 73% | 0.732 | 75% | 0.746 | S | S | * | * | P | Polyproline II helix | trans | -99.4 | 151 | -176.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||
| 387 | P | 41.3 | Very low | 46.1 | Very low | 110 Ų | 110 | 115.5 Ų | 115.5 | 71% | 0.714 | 75% | 0.746 | S | S | * | * | P | Polyproline II helix | trans | -92.4 | 119.3 | 169.5 | 33.7 | -28.5 | 0 | 0 | 0 | 111.4 | ||
| 388 | M | 45.8 | Very low | 45.9 | Very low | 99 Ų | 99 | 115.9 Ų | 115.9 | 49% | 0.488 | 75% | 0.75 | S | S | . | * | 65.3 | 136.5 | 118.4 | -112.4 | 167.6 | 67.8 | 0 | 0 | 117.6 | P1033 K1034 G1035 Q1036 | M388-P1033 HydrophobicContact CG-CB 4.4Å; M388-P1033 HydrophobicContact CG-CG 4.19Å; M388-P1033 WeakPolarHBondContact CG-O 3.37Å; M388-P1033 HydrophobicContact SD-CB 4.38Å; M388-P1033 HydrophobicContact SD-CG 3.76Å; M388-K1034 VanDerWaalsContact CG-CA 3.42Å; M388-K1034 VanDerWaalsContact CG-N 3.33Å; M388-G1035 VanDerWaalsContact C-C 3.43Å; M388-G1035 VanDerWaalsContact C-CA 3.47Å; M388-G1035 WeakPolarHBondContact CB-O 3.39Å; M388-G1035 VanDerWaalsContact CG-N 3.31Å; M388-G1035 CarbonylContact O-C 2.9Å; M388-G1035 WeakPolarHBondContact O-CA 3.42Å; M388-G1035 PolarHBondContact O-N 2.71Å; M388-Q1036 PolarHBondContact O-N 2.91Å | |||
| 389 | G | 46.3 | Very low | 45.7 | Very low | 18 Ų | 18 | 118.7 Ų | 118.7 | 19% | 0.186 | 76% | 0.755 | C | S | . | * | trans | -135.5 | 126.6 | 164.5 | 0 | 0 | 0 | 0 | 0 | 120 | K1034 G1035 | G389-K1034 CarbonylContact C-O 3.57Å; G389-K1034 VanDerWaalsContact N-C 3.25Å; G389-K1034 VanDerWaalsContact N-CA 3.28Å; G389-K1034 CarbonylContact O-C 3.57Å; G389-K1034 WeakPolarHBondContact O-CB 3.39Å; G389-K1034 WeakPolarHBondContact O-CD 3.38Å; G389-K1034 WeakPolarHBondContact O-CE 3.44Å; G389-K1034 WeakPolarHBondContact O-CG 3.43Å; G389-K1034 PolarHBondContact O-NZ 2.73Å; G389-K1034 VanDerWaalsContact O-NZ 3.15Å; G389-G1035 VanDerWaalsContact C-CA 3.44Å; G389-G1035 VanDerWaalsContact C-N 3.29Å | ||
| 390 | K | 44 | Very low | 44.6 | Very low | 134 Ų | 134 | 117.9 Ų | 117.9 | 58% | 0.583 | 76% | 0.758 | S | S | * | * | P | Polyproline II helix | trans | -61.5 | 160.7 | -150.8 | -72.8 | -172.7 | -176.5 | 157.6 | 0 | 119 | K1034 G1035 Q1036 | K390-K1034 VanDerWaalsContact CA-O 3.26Å; K390-K1034 WeakPolarHBondContact CA-O 3.48Å; K390-G1035 VanDerWaalsContact N-CA 3.27Å; K390-Q1036 HydrophobicContact CD-CB 4.27Å; K390-Q1036 HydrophobicContact CD-CG 4.26Å; K390-Q1036 VanDerWaalsContact CD-OE1 3.31Å; K390-Q1036 HydrophobicContact CG-CB 4.06Å; K390-Q1036 HydrophobicContact CG-CG 4.19Å |
| 391 | T | 46.8 | Very low | 44.4 | Very low | 133 Ų | 133 | 118.2 Ų | 118.2 | 82% | 0.816 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -59.7 | 145.2 | 168.4 | -47.3 | 0 | 0 | 0 | 0 | 112 | ||
| 392 | G | 51.3 | Low | 44.2 | Very low | 61 Ų | 61 | 121.2 Ų | 121.2 | 63% | 0.629 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -85.8 | 145.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||
| 393 | P | 45.3 | Very low | 43.8 | Very low | 133 Ų | 133 | 124.5 Ų | 124.5 | 86% | 0.864 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -76.7 | 162 | 177.2 | 32.5 | -35.3 | 0 | 0 | 0 | 113.1 | ||
| 394 | R | 41.6 | Very low | 43.6 | Very low | 244 Ų | 244 | 124.1 Ų | 124.1 | 92% | 0.921 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -69.7 | 140.3 | 172 | 179.1 | 178 | 178 | 173.2 | -2 | 109.9 | ||
| 395 | G | 41.4 | Very low | 43.4 | Very low | 71 Ų | 71 | 124 Ų | 124 | 73% | 0.732 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -75.2 | 155.6 | -179.6 | 0 | 0 | 0 | 0 | 0 | 114 | ||
| 396 | E | 39.3 | Very low | 43.4 | Very low | 186 Ų | 186 | 124.5 Ų | 124.5 | 87% | 0.869 | 76% | 0.764 | S | S | * | * | trans | -104.3 | 159.6 | 174.9 | -64.3 | -168.8 | 133.4 | 0 | 0 | 111.7 | ||||
| 397 | P | 43 | Very low | 43 | Very low | 129 Ų | 129 | 124.7 Ų | 124.7 | 84% | 0.838 | 77% | 0.765 | S | S | * | * | trans | -77.8 | 156 | -173.4 | -12.3 | 30.2 | 0 | 0 | 0 | 113.5 | ||||
| 398 | G | 44.2 | Very low | 42.9 | Very low | 78 Ų | 78 | 131.6 Ų | 131.6 | 80% | 0.804 | 78% | 0.777 | S | S | * | * | trans | -79.1 | 158.5 | 177.9 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 399 | Q | 39.6 | Very low | 43.2 | Very low | 198 Ų | 198 | 134.3 Ų | 134.3 | 93% | 0.925 | 79% | 0.792 | S | S | * | * | trans | -128.4 | 162.7 | 165.4 | -74.3 | -169.8 | -17.8 | 0 | 0 | 110.5 | ||||
| 400 | A | 37.8 | Very low | 43.5 | Very low | 104 Ų | 104 | 135.8 Ų | 135.8 | 86% | 0.86 | 81% | 0.807 | S | S | * | * | trans | -76.1 | 159.9 | -171.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 401 | G | 48.8 | Very low | 43.2 | Very low | 74 Ų | 74 | 135.2 Ų | 135.2 | 76% | 0.763 | 82% | 0.817 | S | S | * | * | trans | -93.8 | -178.6 | -174.1 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 402 | Q | 40.8 | Very low | 43.7 | Very low | 194 Ų | 194 | 134.1 Ų | 134.1 | 91% | 0.907 | 81% | 0.812 | S | S | * | * | trans | -142.1 | 157.2 | 167.2 | -70.7 | -171.7 | -18.7 | 0 | 0 | 109.2 | ||||
| 403 | D | 40 | Very low | 43.7 | Very low | 166 Ų | 166 | 134 Ų | 134 | 89% | 0.888 | 81% | 0.811 | S | S | * | * | trans | -84.5 | 151.5 | -164.2 | -61 | -71.3 | 0 | 0 | 0 | 116 | ||||
| 404 | G | 42.8 | Very low | 43.4 | Very low | 73 Ų | 73 | 133.4 Ų | 133.4 | 75% | 0.753 | 81% | 0.807 | S | S | * | * | trans | 74.8 | 112.7 | 135 | 0 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 405 | K | 36.9 | Very low | 44.1 | Very low | 203 Ų | 203 | 128 Ų | 128 | 88% | 0.883 | 80% | 0.804 | S | S | * | * | trans | -127.5 | 134.2 | 135 | -75.9 | -164.6 | 174.3 | -174.2 | 0 | 109.6 | ||||
| 406 | P | 44.7 | Very low | 44.4 | Very low | 136 Ų | 136 | 127.8 Ų | 127.8 | 88% | 0.883 | 80% | 0.802 | S | S | * | * | trans | -59.9 | 151.9 | 179.6 | -25.7 | 35.8 | 0 | 0 | 0 | 113.5 | ||||
| 407 | G | 41.3 | Very low | 44.4 | Very low | 74 Ų | 74 | 128.2 Ų | 128.2 | 76% | 0.763 | 80% | 0.804 | S | S | * | * | trans | -86.7 | 179.5 | -169.8 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 408 | R | 40 | Very low | 44.3 | Very low | 256 Ų | 256 | 129.7 Ų | 129.7 | 97% | 0.966 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -76.6 | 123.9 | 161.8 | -85.5 | -173.5 | 166.4 | -164.9 | -5.7 | 109.4 | G410 | R408-G410 PolarHBondContact O-N 3.4Š|
| 409 | I | 51.7 | Low | 44.3 | Very low | 156 Ų | 156 | 129.4 Ų | 129.4 | 80% | 0.8 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -67.1 | 122.5 | 166.6 | -68.3 | 166.6 | 0 | 0 | 0 | 107.6 | ||
| 410 | G | 51.9 | Low | 44.4 | Very low | 49 Ų | 49 | 131.4 Ų | 131.4 | 51% | 0.505 | 80% | 0.801 | S | S | . | * | P | Polyproline II helix | trans | -72.2 | 161.8 | 165.4 | 0 | 0 | 0 | 0 | 0 | 110.5 | R408 | R408-G410 PolarHBondContact O-N 3.4Š|
| 411 | P | 38 | Very low | 45 | Very low | 122 Ų | 122 | 134 Ų | 134 | 79% | 0.792 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -55.2 | 144.3 | 176.2 | 25.8 | -34.6 | 0 | 0 | 0 | 110.3 | G413 | P411-G413 PolarHBondContact O-N 3.21Š|
| 412 | P | 56.7 | Low | 44.7 | Very low | 109 Ų | 109 | 133.8 Ų | 133.8 | 71% | 0.708 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -50.9 | 134.6 | 172.4 | -25.7 | 34.5 | 0 | 0 | 0 | 110.3 | ||
| 413 | G | 51 | Low | 44.7 | Very low | 60 Ų | 60 | 132.2 Ų | 132.2 | 62% | 0.619 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -59.5 | 157 | 168.1 | 0 | 0 | 0 | 0 | 0 | 110.2 | P411 | P411-G413 PolarHBondContact O-N 3.21Š|
| 414 | P | 40.4 | Very low | 45.4 | Very low | 120 Ų | 120 | 129.9 Ų | 129.9 | 78% | 0.779 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -53.5 | 148.4 | 166.9 | 26.7 | -34.6 | 0 | 0 | 0 | 109.2 | G416 | P414-G416 PolarHBondContact O-N 3.34Å; P414-G416 VanDerWaalsContact O-N 3.13Å |
| 415 | P | 55.3 | Low | 45.7 | Very low | 130 Ų | 130 | 129.8 Ų | 129.8 | 84% | 0.844 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -49.4 | 124.9 | 174.8 | -26.5 | 34.8 | 0 | 0 | 0 | 109.7 | E417 | P415-E417 PolarHBondContact O-N 3.34Š|
| 416 | G | 47.5 | Very low | 46 | Very low | 67 Ų | 67 | 125 Ų | 125 | 69% | 0.691 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -59.5 | 132 | 178.3 | 0 | 0 | 0 | 0 | 0 | 109.2 | P414 N418 | P414-G416 PolarHBondContact O-N 3.34Å; P414-G416 VanDerWaalsContact O-N 3.13Å; G416-N418 PolarHBondContact O-N 3.23Å |
| 417 | E | 39.8 | Very low | 46.5 | Very low | 195 Ų | 195 | 124.2 Ų | 124.2 | 91% | 0.911 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -53.7 | 135.4 | 164.9 | -68.2 | -169.7 | 112 | 0 | 0 | 108.3 | P415 G419 | P415-E417 PolarHBondContact O-N 3.34Å; E417-G419 PolarHBondContact O-N 2.94Å |
| 418 | N | 41.6 | Very low | 47.1 | Very low | 159 Ų | 159 | 123.5 Ų | 123.5 | 85% | 0.85 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -52.4 | 120 | -178.9 | -77.7 | -27.4 | 0 | 0 | 0 | 109.4 | G416 R420 | G416-N418 PolarHBondContact O-N 3.23Å; N418-R420 PolarHBondContact O-N 3.36Å; N418-R420 VanDerWaalsContact O-N 3.08Å |
| 419 | G | 44.4 | Very low | 47.2 | Very low | 72 Ų | 72 | 117.2 Ų | 117.2 | 74% | 0.742 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -55.8 | 119.2 | 180 | 0 | 0 | 0 | 0 | 0 | 109.4 | E417 D421 | E417-G419 PolarHBondContact O-N 2.94Å; G419-D421 PolarHBondContact O-N 3.12Å |
| 420 | R | 40.5 | Very low | 47.3 | Very low | 241 Ų | 241 | 115.8 Ų | 115.8 | 91% | 0.909 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -60.1 | 135.1 | 168.1 | -70.2 | -177.7 | 175.3 | -178.3 | -1.6 | 107.9 | N418 G422 | N418-R420 PolarHBondContact O-N 3.36Å; N418-R420 VanDerWaalsContact O-N 3.08Å; R420-G422 PolarHBondContact O-N 3.09Å |
| 421 | D | 50.6 | Low | 47.4 | Very low | 157 Ų | 157 | 116.2 Ų | 116.2 | 84% | 0.84 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -51.6 | 139.5 | -179.1 | -65.1 | -75 | 0 | 0 | 0 | 111.5 | G419 I423 | G419-D421 PolarHBondContact O-N 3.12Å; D421-I423 PolarHBondContact O-N 3.41Å |
| 422 | G | 43.9 | Very low | 47.6 | Very low | 70 Ų | 70 | 116.1 Ų | 116.1 | 72% | 0.722 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 125.5 | -171 | 0 | 0 | 0 | 0 | 0 | 111.7 | R420 P424 | R420-G422 PolarHBondContact O-N 3.09Å; G422-P424 WeakPolarHBondContact O-CD 3.4Å |
| 423 | I | 40.8 | Very low | 47.4 | Very low | 162 Ų | 162 | 117 Ų | 117 | 83% | 0.831 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -55.5 | 122.2 | 171.7 | -51.1 | 173.7 | 0 | 0 | 0 | 107.6 | D421 G425 | D421-I423 PolarHBondContact O-N 3.41Å; I423-G425 PolarHBondContact O-N 2.93Å |
| 424 | P | 54.2 | Low | 47.4 | Very low | 117 Ų | 117 | 117.4 Ų | 117.4 | 76% | 0.76 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -55.2 | 134.6 | 175.6 | -26.9 | 36.1 | 0 | 0 | 0 | 110.6 | G422 | G422-P424 WeakPolarHBondContact O-CD 3.4Š|
| 425 | G | 49.4 | Very low | 47.4 | Very low | 70 Ų | 70 | 120.6 Ų | 120.6 | 72% | 0.722 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -56.1 | 140 | -173.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | I423 S427 | I423-G425 PolarHBondContact O-N 2.93Å; G425-S427 PolarHBondContact O-N 2.84Å; G425-S427 VanDerWaalsContact O-N 3.13Å |
| 426 | A | 42.6 | Very low | 47.1 | Very low | 103 Ų | 103 | 120.3 Ų | 120.3 | 85% | 0.851 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -55 | 120.5 | 178.5 | 0 | 0 | 0 | 0 | 0 | 110.2 | G428 | A426-G428 PolarHBondContact O-N 3.47Š|
| 427 | S | 54 | Low | 47.4 | Very low | 120 Ų | 120 | 120.5 Ų | 120.5 | 84% | 0.839 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -65.6 | 125.8 | 173.9 | -66.1 | 0 | 0 | 0 | 0 | 108.8 | G425 | G425-S427 PolarHBondContact O-N 2.84Å; G425-S427 VanDerWaalsContact O-N 3.13Å |
| 428 | G | 54.2 | Low | 47.3 | Very low | 59 Ų | 59 | 121.3 Ų | 121.3 | 61% | 0.608 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -56.9 | 152.2 | -178.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | A426 | A426-G428 PolarHBondContact O-N 3.47Š|
| 429 | P | 41.8 | Very low | 47.4 | Very low | 123 Ų | 123 | 118.6 Ų | 118.6 | 80% | 0.799 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -57.6 | 132.2 | -178.3 | 24.3 | -34 | 0 | 0 | 0 | 110.4 | G431 | P429-G431 PolarHBondContact O-N 3.16Š|
| 430 | P | 55.5 | Low | 47.7 | Very low | 127 Ų | 127 | 118.6 Ų | 118.6 | 83% | 0.825 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -52.4 | 131.3 | 174.9 | -28.3 | 35.5 | 0 | 0 | 0 | 111.1 | ||
| 431 | G | 52.6 | Low | 47.6 | Very low | 58 Ų | 58 | 112.9 Ų | 112.9 | 60% | 0.598 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -56.2 | 147.7 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | P429 | P429-G431 PolarHBondContact O-N 3.16Š|
| 432 | P | 42.3 | Very low | 47.2 | Very low | 120 Ų | 120 | 111.5 Ų | 111.5 | 78% | 0.779 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -57 | 133.3 | -177.7 | 24.1 | -34 | 0 | 0 | 0 | 110.3 | G434 | P432-G434 PolarHBondContact O-N 3.01Š|
| 433 | P | 53.4 | Low | 47.1 | Very low | 126 Ų | 126 | 111.4 Ų | 111.4 | 82% | 0.818 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -51.2 | 130.7 | 177.6 | -29.2 | 35.6 | 0 | 0 | 0 | 111.5 | Q435 | P433-Q435 PolarHBondContact O-N 2.84Š|
| 434 | G | 50.5 | Low | 46.8 | Very low | 69 Ų | 69 | 111.5 Ų | 111.5 | 71% | 0.711 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -55.9 | 139.2 | 179.6 | 0 | 0 | 0 | 0 | 0 | 111.1 | P432 | P432-G434 PolarHBondContact O-N 3.01Š|
| 435 | Q | 39.6 | Very low | 46.2 | Very low | 187 Ų | 187 | 111.7 Ų | 111.7 | 87% | 0.874 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -53.4 | 130.1 | 178.9 | -69.3 | -175.9 | -2.6 | 0 | 0 | 110.2 | P433 G437 | P433-Q435 PolarHBondContact O-N 2.84Å; Q435-G437 PolarHBondContact O-N 2.97Å |
| 436 | P | 50.7 | Low | 46.1 | Very low | 124 Ų | 124 | 112.2 Ų | 112.2 | 81% | 0.805 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -51.6 | 126.2 | 175.8 | -29.3 | 35.9 | 0 | 0 | 0 | 111.2 | K438 | P436-K438 PolarHBondContact O-N 2.93Š|
| 437 | G | 52.4 | Low | 45.9 | Very low | 72 Ų | 72 | 113.9 Ų | 113.9 | 74% | 0.742 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -56.3 | 136 | 177.6 | 0 | 0 | 0 | 0 | 0 | 110.5 | Q435 A439 | Q435-G437 PolarHBondContact O-N 2.97Å; G437-A439 PolarHBondContact O-N 3.05Å |
| 438 | K | 38.2 | Very low | 45 | Very low | 211 Ų | 211 | 115.3 Ų | 115.3 | 92% | 0.917 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -55 | 131.1 | 178.2 | -67 | -173.1 | 178.7 | -174.7 | 0 | 109.6 | P436 G440 | P436-K438 PolarHBondContact O-N 2.93Å; K438-G440 PolarHBondContact O-N 2.99Å |
| 439 | A | 44.6 | Very low | 44.2 | Very low | 102 Ų | 102 | 115.9 Ų | 115.9 | 84% | 0.843 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -49.2 | 128 | -176.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | G437 S441 | G437-A439 PolarHBondContact O-N 3.05Å; A439-S441 PolarHBondContact O-N 2.88Å |
| 440 | G | 49.3 | Very low | 43.9 | Very low | 73 Ų | 73 | 115 Ų | 115 | 75% | 0.753 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -66.4 | 130 | 175 | 0 | 0 | 0 | 0 | 0 | 110.5 | K438 S442 | K438-G440 PolarHBondContact O-N 2.99Å; G440-S442 PolarHBondContact O-N 3.14Å |
| 441 | S | 38.8 | Very low | 43.2 | Very low | 120 Ų | 120 | 115 Ų | 115 | 84% | 0.839 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -62 | 128.6 | 171.5 | 53.3 | 0 | 0 | 0 | 0 | 110.4 | A439 | A439-S441 PolarHBondContact O-N 2.88Š|
| 442 | S | 41.9 | Very low | 42.9 | Very low | 129 Ų | 129 | 115.5 Ų | 115.5 | 90% | 0.902 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -51.1 | 140 | -174.9 | -48.2 | 0 | 0 | 0 | 0 | 113.7 | G440 | G440-S442 PolarHBondContact O-N 3.14Š|
| 443 | G | 42.2 | Very low | 42.5 | Very low | 68 Ų | 68 | 116 Ų | 116 | 70% | 0.701 | 82% | 0.817 | S | S | * | * | trans | -137.4 | 59.9 | -168.1 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 444 | I | 35.4 | Very low | 42.1 | Very low | 164 Ų | 164 | 116.5 Ų | 116.5 | 84% | 0.841 | 82% | 0.82 | S | S | * | * | trans | 67.3 | 137.3 | 161.3 | -32.5 | -179.5 | 0 | 0 | 0 | 116 | ||||
| 445 | P | 40.5 | Very low | 41.5 | Very low | 121 Ų | 121 | 116.4 Ų | 116.4 | 79% | 0.786 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -70.6 | 150.1 | -174.8 | -20.9 | 34.2 | 0 | 0 | 0 | 115.5 | ||
| 446 | G | 46.8 | Very low | 41.1 | Very low | 80 Ų | 80 | 115.7 Ų | 115.7 | 83% | 0.825 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -84.6 | 146.7 | 161.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||
| 447 | T | 38.3 | Very low | 40.4 | Very low | 139 Ų | 139 | 118.8 Ų | 118.8 | 85% | 0.853 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -92.7 | 155.7 | -175.2 | 49.6 | 0 | 0 | 0 | 0 | 113.8 | ||
| 448 | T | 35.9 | Very low | 39.9 | Very low | 150 Ų | 150 | 118.2 Ų | 118.2 | 92% | 0.92 | 82% | 0.818 | S | S | * | * | trans | -45.3 | 151.7 | 171.2 | -13.9 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 449 | G | 37.4 | Very low | 39.8 | Very low | 70 Ų | 70 | 116.3 Ų | 116.3 | 72% | 0.722 | 82% | 0.818 | S | S | * | * | cis | -152.4 | -161.6 | 2.6 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 450 | A | 36.2 | Very low | 39.6 | Very low | 104 Ų | 104 | 119.5 Ų | 119.5 | 86% | 0.86 | 82% | 0.819 | S | S | * | * | cis | -158.2 | 172.8 | 29 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 451 | S | 40.1 | Very low | 39.3 | Very low | 128 Ų | 128 | 119.2 Ų | 119.2 | 90% | 0.895 | 82% | 0.816 | S | S | * | * | trans | -67.1 | 160 | 166.3 | -9.9 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 452 | G | 45.7 | Very low | 39.1 | Very low | 68 Ų | 68 | 123.2 Ų | 123.2 | 70% | 0.701 | 82% | 0.822 | S | S | * | * | cis | 150.3 | 157.7 | 0.6 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 453 | P | 34.1 | Very low | 39.2 | Very low | 131 Ų | 131 | 126.2 Ų | 126.2 | 85% | 0.851 | 82% | 0.822 | S | S | * | * | trans | -139 | 160.7 | 139.9 | 38 | -26.5 | 0 | 0 | 0 | 114 | ||||
| 454 | P | 46.7 | Very low | 39.5 | Very low | 137 Ų | 137 | 125.7 Ų | 125.7 | 89% | 0.89 | 82% | 0.817 | S | S | * | * | trans | -104.1 | 156.5 | -170.5 | 8.1 | 14.7 | 0 | 0 | 0 | 114.8 | ||||
| 455 | G | 37.3 | Very low | 39.6 | Very low | 67 Ų | 67 | 124.3 Ų | 124.3 | 69% | 0.691 | 82% | 0.818 | S | S | * | * | trans | 128.1 | 137.3 | 170.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 456 | L | 31 | Very low | 40 | Very low | 171 Ų | 171 | 127.7 Ų | 127.7 | 90% | 0.895 | 82% | 0.824 | S | S | * | * | cis | -139.9 | 164.5 | 3.6 | -74.6 | 170 | 0 | 0 | 0 | 112 | ||||
| 457 | Q | 36.3 | Very low | 40 | Very low | 189 Ų | 189 | 127 Ų | 127 | 88% | 0.883 | 82% | 0.817 | S | S | * | * | trans | -21.9 | 137.8 | 155.3 | 174.3 | -175.8 | -3 | 0 | 0 | 115.9 | ||||
| 458 | G | 41.5 | Very low | 39.8 | Very low | 60 Ų | 60 | 130.1 Ų | 130.1 | 62% | 0.619 | 82% | 0.821 | S | S | * | * | cis | 139.8 | 103.3 | -6.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 459 | D | 35.9 | Very low | 40.4 | Very low | 172 Ų | 172 | 134.3 Ų | 134.3 | 92% | 0.92 | 82% | 0.82 | S | S | * | * | trans | -108.7 | 153.8 | -170.1 | -72.1 | -59.9 | 0 | 0 | 0 | 115.5 | ||||
| 460 | I | 39.9 | Very low | 40.7 | Very low | 168 Ų | 168 | 133.9 Ų | 133.9 | 86% | 0.862 | 82% | 0.816 | S | S | * | * | trans | -112.5 | 133.5 | -170.4 | -66.3 | 171.8 | 0 | 0 | 0 | 111.1 | ||||
| 461 | G | 43.1 | Very low | 40.7 | Very low | 67 Ų | 67 | 136.9 Ų | 136.9 | 69% | 0.691 | 82% | 0.817 | S | S | * | * | trans | 65.8 | 95.7 | 148.5 | 0 | 0 | 0 | 0 | 0 | 117.9 | Q463 | G461-Q463 PolarHBondContact O-N 3.09Š| ||
| 462 | Q | 35.2 | Very low | 41.1 | Very low | 205 Ų | 205 | 136.7 Ų | 136.7 | 96% | 0.958 | 81% | 0.812 | S | S | * | * | trans | -65.2 | 113.4 | 162.3 | -71 | -177.7 | -11.8 | 0 | 0 | 110.6 | ||||
| 463 | Q | 44.4 | Very low | 41.3 | Very low | 191 Ų | 191 | 136.8 Ų | 136.8 | 89% | 0.893 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -78 | 150.3 | 168.6 | -173 | 167.4 | -15 | 0 | 0 | 110.7 | G461 | G461-Q463 PolarHBondContact O-N 3.09Š|
| 464 | G | 48.2 | Very low | 41.5 | Very low | 58 Ų | 58 | 136.4 Ų | 136.4 | 60% | 0.598 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -65.3 | 168 | -175.7 | 0 | 0 | 0 | 0 | 0 | 115.2 | Q466 | G464-Q466 PolarHBondContact O-N 2.88Š|
| 465 | P | 37.6 | Very low | 41.3 | Very low | 135 Ų | 135 | 136.9 Ų | 136.9 | 88% | 0.877 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -63.9 | 129.3 | -167.1 | 25.3 | -34.9 | 0 | 0 | 0 | 113.5 | ||
| 466 | Q | 47.7 | Very low | 41.7 | Very low | 192 Ų | 192 | 136.8 Ų | 136.8 | 90% | 0.897 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -68.9 | 145.8 | 171.9 | -175.8 | 173.6 | -11.4 | 0 | 0 | 111.2 | G464 | G464-Q466 PolarHBondContact O-N 2.88Š|
| 467 | G | 47.3 | Very low | 42 | Very low | 66 Ų | 66 | 136.6 Ų | 136.6 | 68% | 0.68 | 81% | 0.812 | S | S | * | * | trans | -68 | 174.1 | -178.1 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 468 | E | 34.4 | Very low | 42.7 | Very low | 203 Ų | 203 | 133.6 Ų | 133.6 | 95% | 0.949 | 81% | 0.809 | S | S | * | * | trans | -60 | 146.8 | -171.2 | -63.9 | -170.6 | 126.2 | 0 | 0 | 114.2 | G470 | E468-G470 PolarHBondContact O-N 2.9Š| ||
| 469 | R | 47.5 | Very low | 43 | Very low | 238 Ų | 238 | 133.8 Ų | 133.8 | 90% | 0.898 | 81% | 0.811 | S | S | * | * | trans | -71 | 111.3 | -171.3 | -179.4 | -179 | -65.2 | -177.1 | -1.4 | 111.5 | ||||
| 470 | G | 45.2 | Very low | 43.4 | Very low | 61 Ų | 61 | 131.9 Ų | 131.9 | 63% | 0.629 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -59.1 | 149.9 | 163.9 | 0 | 0 | 0 | 0 | 0 | 112 | E468 | E468-G470 PolarHBondContact O-N 2.9Š|
| 471 | L | 35.5 | Very low | 43.7 | Very low | 167 Ų | 167 | 133.7 Ų | 133.7 | 87% | 0.874 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -61.1 | 145.7 | -179 | -68.8 | 169.3 | 0 | 0 | 0 | 111.6 | G473 | L471-G473 PolarHBondContact O-N 2.81Š|
| 472 | P | 47.5 | Very low | 44 | Very low | 124 Ų | 124 | 133.8 Ų | 133.8 | 81% | 0.805 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -57.1 | 127 | 178.7 | -25 | 34.7 | 0 | 0 | 0 | 112.3 | ||
| 473 | G | 50.3 | Low | 44.3 | Very low | 71 Ų | 71 | 133.3 Ų | 133.3 | 73% | 0.732 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -67.8 | 145.7 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | L471 | L471-G473 PolarHBondContact O-N 2.81Š|
| 474 | S | 38.7 | Very low | 44.4 | Very low | 123 Ų | 123 | 134 Ų | 134 | 86% | 0.86 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -64.1 | 136.8 | 171.8 | 41.8 | 0 | 0 | 0 | 0 | 111.1 | G476 | S474-G476 PolarHBondContact O-N 2.83Š|
| 475 | V | 42.1 | Very low | 44.5 | Very low | 147 Ų | 147 | 134.6 Ų | 134.6 | 89% | 0.891 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -61.7 | 121.2 | 177.6 | 178.7 | 0 | 0 | 0 | 0 | 109.6 | ||
| 476 | G | 45.2 | Very low | 44.6 | Very low | 65 Ų | 65 | 137.6 Ų | 137.6 | 67% | 0.67 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -70.4 | 140.6 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | S474 | S474-G476 PolarHBondContact O-N 2.83Š|
| 477 | L | 38.8 | Very low | 44.5 | Very low | 167 Ų | 167 | 138.3 Ų | 138.3 | 87% | 0.874 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -68.5 | 143 | 171.7 | -69.7 | 170.9 | 0 | 0 | 0 | 110.6 | G479 | L477-G479 PolarHBondContact O-N 3.13Š|
| 478 | P | 50.7 | Low | 44.7 | Very low | 125 Ų | 125 | 137.7 Ų | 137.7 | 81% | 0.812 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -56.3 | 128.7 | 173.8 | -25.7 | 35 | 0 | 0 | 0 | 111.9 | ||
| 479 | G | 48.4 | Very low | 45.2 | Very low | 65 Ų | 65 | 134.3 Ų | 134.3 | 67% | 0.67 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -66.4 | 151.6 | -177.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | L477 | L477-G479 PolarHBondContact O-N 3.13Š|
| 480 | P | 43.2 | Very low | 45.3 | Very low | 131 Ų | 131 | 131.1 Ų | 131.1 | 85% | 0.851 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -64.1 | 140 | 177.6 | 27.8 | -34.5 | 0 | 0 | 0 | 111.1 | G482 | P480-G482 PolarHBondContact O-N 2.03Å; P480-G482 VanDerWaalsContact O-N 3.14Å |
| 481 | K | 47.2 | Very low | 45.5 | Very low | 206 Ų | 206 | 131.3 Ų | 131.3 | 90% | 0.896 | 81% | 0.808 | S | S | * | * | trans | -61.1 | 114.3 | 175.6 | -178.5 | -179.4 | 180 | 179.8 | 0 | 109.7 | ||||
| 482 | G | 48.2 | Very low | 45.7 | Very low | 69 Ų | 69 | 132.7 Ų | 132.7 | 71% | 0.711 | 81% | 0.81 | S | S | * | * | trans | -57.5 | 140.7 | -174.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | P480 | P480-G482 PolarHBondContact O-N 2.03Å; P480-G482 VanDerWaalsContact O-N 3.14Å | ||
| 483 | E | 41.5 | Very low | 45.3 | Very low | 195 Ų | 195 | 131.7 Ų | 131.7 | 91% | 0.911 | 81% | 0.813 | S | S | * | * | trans | -70.3 | 147.6 | 176.1 | -64.8 | -168.1 | 125.5 | 0 | 0 | 111.6 | G485 | E483-G485 PolarHBondContact O-N 2.85Å; E483-G485 VanDerWaalsContact O-N 3.1Å | ||
| 484 | K | 47.1 | Very low | 45.1 | Very low | 207 Ų | 207 | 131.7 Ų | 131.7 | 90% | 0.9 | 81% | 0.812 | S | S | * | * | trans | -74.6 | 101 | -178.1 | 178.9 | -174.4 | 174.7 | -173.7 | 0 | 109.2 | ||||
| 485 | G | 49.4 | Very low | 45.4 | Very low | 70 Ų | 70 | 130.6 Ų | 130.6 | 72% | 0.722 | 81% | 0.811 | S | S | * | * | trans | -51.2 | 139.7 | -178.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | E483 | E483-G485 PolarHBondContact O-N 2.85Å; E483-G485 VanDerWaalsContact O-N 3.1Å | ||
| 486 | E | 41.2 | Very low | 45.5 | Very low | 197 Ų | 197 | 130.5 Ų | 130.5 | 92% | 0.921 | 81% | 0.81 | S | S | * | * | trans | -65.4 | 144.7 | 177.6 | -65 | -163.4 | 121.2 | 0 | 0 | 111.4 | G488 | E486-G488 PolarHBondContact O-N 2.85Å; E486-G488 VanDerWaalsContact O-N 3.1Å | ||
| 487 | K | 45.5 | Very low | 45.8 | Very low | 207 Ų | 207 | 130.4 Ų | 130.4 | 90% | 0.9 | 81% | 0.809 | S | S | * | * | trans | -74.2 | 104 | -179.3 | -175.6 | -175.6 | 178.7 | -174.2 | 0 | 109 | ||||
| 488 | G | 51.3 | Low | 46.1 | Very low | 54 Ų | 54 | 130.5 Ų | 130.5 | 56% | 0.557 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -53.2 | 151.4 | 175 | 0 | 0 | 0 | 0 | 0 | 112.8 | E486 | E486-G488 PolarHBondContact O-N 2.85Å; E486-G488 VanDerWaalsContact O-N 3.1Å |
| 489 | P | 44.2 | Very low | 46 | Very low | 131 Ų | 131 | 129.3 Ų | 129.3 | 85% | 0.851 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 147 | 179.2 | 25.8 | -34.2 | 0 | 0 | 0 | 111 | G491 | P489-G491 PolarHBondContact O-N 2.96Š|
| 490 | L | 51 | Low | 46.3 | Very low | 172 Ų | 172 | 129.1 Ų | 129.1 | 90% | 0.901 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -60.9 | 118.9 | 178.9 | -179.3 | 66 | 0 | 0 | 0 | 109.6 | ||
| 491 | G | 47.7 | Very low | 46.9 | Very low | 65 Ų | 65 | 128.8 Ų | 128.8 | 67% | 0.67 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -64.2 | 137 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | P489 | P489-G491 PolarHBondContact O-N 2.96Š|
| 492 | E | 39.7 | Very low | 47.5 | Very low | 195 Ų | 195 | 125.2 Ų | 125.2 | 91% | 0.911 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -63 | 149.3 | 172.3 | -64.1 | -174.2 | 128.7 | 0 | 0 | 110.6 | G494 | E492-G494 PolarHBondContact O-N 2.84Š|
| 493 | A | 40.3 | Very low | 47.6 | Very low | 104 Ų | 104 | 125.1 Ų | 125.1 | 86% | 0.86 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -66.5 | 121.7 | -171.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | A495 | A493-A495 PolarHBondContact O-N 3.18Š|
| 494 | G | 45.9 | Very low | 48.1 | Very low | 70 Ų | 70 | 122 Ų | 122 | 72% | 0.722 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -59.5 | 127.8 | 167.1 | 0 | 0 | 0 | 0 | 0 | 110 | E492 V496 | E492-G494 PolarHBondContact O-N 2.84Å; G494-V496 PolarHBondContact O-N 2.96Å |
| 495 | A | 43.7 | Very low | 48.3 | Very low | 100 Ų | 100 | 121.5 Ų | 121.5 | 83% | 0.826 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -58.8 | 129.6 | 179.9 | 0 | 0 | 0 | 0 | 0 | 110.6 | A493 G497 | A493-A495 PolarHBondContact O-N 3.18Å; A495-G497 PolarHBondContact O-N 3.08Å |
| 496 | V | 46.2 | Very low | 48.1 | Very low | 145 Ų | 145 | 121.5 Ų | 121.5 | 88% | 0.879 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -64.7 | 118.2 | 171 | 177.1 | 0 | 0 | 0 | 0 | 107.5 | G494 | G494-V496 PolarHBondContact O-N 2.96Š|
| 497 | G | 50.6 | Low | 48 | Very low | 63 Ų | 63 | 122.3 Ų | 122.3 | 65% | 0.649 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -64.4 | 146 | -178.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | A495 A499 | A495-G497 PolarHBondContact O-N 3.08Å; G497-A499 PolarHBondContact O-N 3.28Å |
| 498 | D | 44.1 | Very low | 47.8 | Very low | 170 Ų | 170 | 121.8 Ų | 121.8 | 91% | 0.909 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -54.5 | 132 | 179 | -69.2 | -63.1 | 0 | 0 | 0 | 111.8 | G500 | D498-G500 PolarHBondContact O-N 3.14Š|
| 499 | A | 49.3 | Very low | 47.7 | Very low | 99 Ų | 99 | 122.3 Ų | 122.3 | 82% | 0.818 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -66.9 | 119.1 | -179.3 | 0 | 0 | 0 | 0 | 0 | 110.6 | G497 | G497-A499 PolarHBondContact O-N 3.28Š|
| 500 | G | 54 | Low | 47.6 | Very low | 62 Ų | 62 | 121.8 Ų | 121.8 | 64% | 0.639 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -58.2 | 138.9 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | D498 | D498-G500 PolarHBondContact O-N 3.14Š|
| 501 | P | 57.2 | Low | 47.1 | Very low | 123 Ų | 123 | 122 Ų | 122 | 80% | 0.799 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -62 | 135.9 | -177.4 | 24.7 | -33.8 | 0 | 0 | 0 | 111.1 | G503 | P501-G503 PolarHBondContact O-N 3Š|
| 502 | P | 60 | Low | 46.6 | Very low | 131 Ų | 131 | 122.5 Ų | 122.5 | 85% | 0.851 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -55.9 | 129.7 | -179.1 | -28.2 | 35.7 | 0 | 0 | 0 | 113.1 | ||
| 503 | G | 49.7 | Very low | 46.4 | Very low | 67 Ų | 67 | 121.2 Ų | 121.2 | 69% | 0.691 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -68.4 | 141 | -178.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | P501 Q505 | P501-G503 PolarHBondContact O-N 3Å; G503-Q505 PolarHBondContact O-N 3.44Å |
| 504 | P | 52.6 | Low | 46.3 | Very low | 131 Ų | 131 | 124.9 Ų | 124.9 | 85% | 0.851 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -66.4 | 127 | 177.3 | 27 | -33.8 | 0 | 0 | 0 | 111.3 | G506 | P504-G506 PolarHBondContact O-N 3.3Š|
| 505 | Q | 51.2 | Low | 46 | Very low | 195 Ų | 195 | 125.2 Ų | 125.2 | 91% | 0.911 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -63 | 131.4 | -179.8 | -172.5 | 174 | -10.7 | 0 | 0 | 111.4 | G503 | G503-Q505 PolarHBondContact O-N 3.44Š|
| 506 | G | 45.4 | Very low | 45.5 | Very low | 71 Ų | 71 | 129.6 Ų | 129.6 | 73% | 0.732 | 81% | 0.805 | S | S | * | * | trans | -77.7 | 177.3 | -167.9 | 0 | 0 | 0 | 0 | 0 | 116 | P504 | P504-G506 PolarHBondContact O-N 3.3Š| ||
| 507 | K | 37.9 | Very low | 45 | Very low | 213 Ų | 213 | 131.1 Ų | 131.1 | 93% | 0.926 | 80% | 0.803 | S | S | * | * | trans | -115.9 | 135.6 | 167 | -69.6 | -173.8 | 177.5 | -178.4 | 0 | 110 | ||||
| 508 | Q | 42.3 | Very low | 44.6 | Very low | 196 Ų | 196 | 131.3 Ų | 131.3 | 92% | 0.916 | 80% | 0.804 | S | S | * | * | trans | -77.7 | 143.6 | -179.6 | -165.7 | 170 | 3 | 0 | 0 | 110.6 | ||||
| 509 | G | 48.4 | Very low | 44.5 | Very low | 65 Ų | 65 | 129.9 Ų | 129.9 | 67% | 0.67 | 80% | 0.796 | S | S | * | * | trans | -78.7 | 174.4 | -178.9 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 510 | P | 42.2 | Very low | 44 | Very low | 120 Ų | 120 | 132.6 Ų | 132.6 | 78% | 0.779 | 80% | 0.795 | S | S | * | * | -140.9 | 149.2 | 118.3 | 38.1 | -26.5 | 0 | 0 | 0 | 116 | |||||
| 511 | I | 40.1 | Very low | 43.4 | Very low | 177 Ų | 177 | 132.8 Ų | 132.8 | 91% | 0.908 | 80% | 0.797 | S | S | * | * | trans | 14.6 | 129.6 | 138.7 | -51.3 | 168.9 | 0 | 0 | 0 | 118.4 | ||||
| 512 | G | 38 | Very low | 42.5 | Very low | 75 Ų | 75 | 134.3 Ų | 134.3 | 77% | 0.773 | 80% | 0.799 | S | S | * | * | trans | 160.2 | 128.9 | 155.6 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 513 | E | 35.8 | Very low | 41.9 | Very low | 169 Ų | 169 | 135.3 Ų | 135.3 | 79% | 0.79 | 80% | 0.802 | S | S | * | * | trans | -78.1 | 154.8 | -174.3 | -63.9 | -168.9 | 100.7 | 0 | 0 | 116.9 | ||||
| 514 | K | 38.3 | Very low | 41.8 | Very low | 180 Ų | 180 | 135.3 Ų | 135.3 | 78% | 0.783 | 80% | 0.802 | S | S | * | * | trans | 50.9 | 130.4 | 144.6 | -77.7 | 173.5 | 178 | 158 | 0 | 122.3 | ||||
| 515 | G | 39.5 | Very low | 40.9 | Very low | 77 Ų | 77 | 134.9 Ų | 134.9 | 79% | 0.794 | 80% | 0.802 | S | S | * | * | trans | -159.1 | 150.4 | 153.9 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 516 | F | 33.8 | Very low | 41.3 | Very low | 192 Ų | 192 | 131.7 Ų | 131.7 | 84% | 0.842 | 80% | 0.798 | S | S | * | * | trans | -126.8 | 146.8 | -172 | -102.2 | -97 | 0 | 0 | 0 | 113.2 | ||||
| 517 | Q | 35.1 | Very low | 41.4 | Very low | 178 Ų | 178 | 131.7 Ų | 131.7 | 83% | 0.832 | 80% | 0.799 | S | S | * | * | trans | 70.4 | 137.9 | 145.4 | -165.1 | 171.7 | 8.8 | 0 | 0 | 121 | ||||
| 518 | G | 42.8 | Very low | 41.5 | Very low | 66 Ų | 66 | 130.3 Ų | 130.3 | 68% | 0.68 | 80% | 0.8 | S | S | * | * | trans | 142.7 | 87.3 | 171.4 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 519 | L | 40.1 | Very low | 42 | Very low | 141 Ų | 141 | 132.9 Ų | 132.9 | 74% | 0.738 | 80% | 0.802 | S | S | * | * | 88.2 | 101.8 | 72.4 | -77.6 | 167.7 | 0 | 0 | 0 | 115 | |||||
| 520 | I | 40.5 | Very low | 42.4 | Very low | 155 Ų | 155 | 132.3 Ų | 132.3 | 80% | 0.795 | 80% | 0.796 | S | S | * | * | trans | 62.4 | 129.7 | 144.5 | -56.3 | 173.1 | 0 | 0 | 0 | 118.3 | ||||
| 521 | G | 40.8 | Very low | 43 | Very low | 66 Ų | 66 | 133 Ų | 133 | 68% | 0.68 | 80% | 0.8 | S | S | * | * | cis | 164.3 | -171.6 | -4.9 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 522 | N | 38.7 | Very low | 43.9 | Very low | 155 Ų | 155 | 135.9 Ų | 135.9 | 83% | 0.829 | 80% | 0.8 | S | S | * | * | trans | 69.6 | 85.8 | 158.4 | -56.5 | -4.4 | 0 | 0 | 0 | 121 | ||||
| 523 | V | 46.2 | Very low | 44.7 | Very low | 153 Ų | 153 | 135.2 Ų | 135.2 | 93% | 0.927 | 79% | 0.793 | S | S | * | * | trans | -135.7 | 147.7 | 135.9 | 179.6 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 524 | G | 48.1 | Very low | 45.2 | Very low | 67 Ų | 67 | 134.5 Ų | 134.5 | 69% | 0.691 | 79% | 0.794 | S | S | * | * | trans | -68.9 | 161.8 | -163.3 | 0 | 0 | 0 | 0 | 0 | 117.6 | P526 | G524-P526 WeakPolarHBondContact O-CD 3.45Š| ||
| 525 | S | 34.2 | Very low | 46.6 | Very low | 122 Ų | 122 | 131.5 Ų | 131.5 | 85% | 0.853 | 79% | 0.793 | S | S | * | * | trans | -87.3 | 115.3 | -178.1 | 37.8 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 526 | P | 58.5 | Low | 47.4 | Very low | 127 Ų | 127 | 130.9 Ų | 130.9 | 83% | 0.825 | 79% | 0.787 | S | S | * | * | trans | -83.9 | 121.9 | 175.5 | -6.5 | 25.3 | 0 | 0 | 0 | 111.6 | G524 | G524-P526 WeakPolarHBondContact O-CD 3.45Š| ||
| 527 | G | 48.1 | Very low | 48.5 | Very low | 72 Ų | 72 | 127.8 Ų | 127.8 | 74% | 0.742 | 79% | 0.786 | S | S | * | * | trans | 55.5 | 117.5 | 153.3 | 0 | 0 | 0 | 0 | 0 | 119.3 | R529 | G527-R529 PolarHBondContact O-N 3.01Š| ||
| 528 | L | 39.6 | Very low | 49.5 | Very low | 183 Ų | 183 | 125.1 Ų | 125.1 | 96% | 0.958 | 79% | 0.787 | S | S | * | * | trans | -59.8 | 104.3 | 158.3 | -74.4 | 170.6 | 0 | 0 | 0 | 109.4 | G530 | L528-G530 PolarHBondContact O-N 3.38Š| ||
| 529 | R | 54.1 | Low | 49.8 | Very low | 251 Ų | 251 | 125.2 Ų | 125.2 | 95% | 0.947 | 79% | 0.788 | S | S | * | * | trans | -65.8 | 115.8 | 170.1 | -171.9 | 174.4 | -175.8 | 171.9 | 2 | 107.7 | G527 | G527-R529 PolarHBondContact O-N 3.01Š| ||
| 530 | G | 56.1 | Low | 50 | Low | 53 Ų | 53 | 125.8 Ų | 125.8 | 55% | 0.546 | 79% | 0.792 | S | S | . | * | trans | -56.9 | 161.9 | -173.5 | 0 | 0 | 0 | 0 | 0 | 113.9 | L528 R532 | L528-G530 PolarHBondContact O-N 3.38Å; G530-R532 PolarHBondContact O-N 3.43Å | ||
| 531 | P | 55.3 | Low | 51 | Low | 133 Ų | 133 | 124.1 Ų | 124.1 | 86% | 0.864 | 79% | 0.791 | S | S | * | * | trans | -54.3 | 138.8 | -178.8 | 24 | -34.1 | 0 | 0 | 0 | 110.8 | G533 | P531-G533 PolarHBondContact O-N 3.05Š| ||
| 532 | R | 57.9 | Low | 51.4 | Low | 239 Ų | 239 | 124.4 Ų | 124.4 | 90% | 0.902 | 79% | 0.794 | S | S | * | * | trans | -61.6 | 109.5 | 170.9 | 177.2 | -178 | -178.2 | 173.7 | 1 | 107.3 | G530 | G530-R532 PolarHBondContact O-N 3.43Š| ||
| 533 | G | 54.4 | Low | 51.6 | Low | 61 Ų | 61 | 126.5 Ų | 126.5 | 63% | 0.629 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -54.3 | 143.4 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | P531 | P531-G533 PolarHBondContact O-N 3.05Š|
| 534 | D | 48 | Very low | 51.7 | Low | 154 Ų | 154 | 127.1 Ų | 127.1 | 82% | 0.824 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -57.4 | 140.6 | -176.9 | -61.6 | -69.8 | 0 | 0 | 0 | 111.2 | G536 | D534-G536 PolarHBondContact O-N 3.21Å; D534-G536 VanDerWaalsContact O-N 3.15Å |
| 535 | P | 67.6 | Low | 51.6 | Low | 116 Ų | 116 | 127.4 Ų | 127.4 | 75% | 0.753 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -56.2 | 121.6 | 168.8 | -22 | 33.4 | 0 | 0 | 0 | 109.4 | ||
| 536 | G | 55.2 | Low | 51.9 | Low | 64 Ų | 64 | 127.9 Ų | 127.9 | 66% | 0.66 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -55.5 | 144.3 | 176.5 | 0 | 0 | 0 | 0 | 0 | 110.8 | D534 S538 | D534-G536 PolarHBondContact O-N 3.21Å; D534-G536 VanDerWaalsContact O-N 3.15Å; G536-S538 PolarHBondContact O-N 3.3Å |
| 537 | P | 57.9 | Low | 51.5 | Low | 128 Ų | 128 | 128.2 Ų | 128.2 | 83% | 0.831 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -58.8 | 132.8 | -175.5 | 24.5 | -34.2 | 0 | 0 | 0 | 110.6 | G539 | P537-G539 PolarHBondContact O-N 3.28Š|
| 538 | S | 54.8 | Low | 51.1 | Low | 122 Ų | 122 | 128.1 Ų | 128.1 | 85% | 0.853 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -54 | 122 | 170.8 | -62 | 0 | 0 | 0 | 0 | 109.3 | G536 | G536-S538 PolarHBondContact O-N 3.3Š|
| 539 | G | 48.8 | Very low | 50.9 | Low | 68 Ų | 68 | 125.6 Ų | 125.6 | 70% | 0.701 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -59.7 | 145.3 | 179 | 0 | 0 | 0 | 0 | 0 | 111.8 | P537 | P537-G539 PolarHBondContact O-N 3.28Š|
| 540 | D | 45.1 | Very low | 50.5 | Low | 153 Ų | 153 | 120.9 Ų | 120.9 | 82% | 0.818 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -51.6 | 130.7 | 177.2 | -74.3 | -48.2 | 0 | 0 | 0 | 110.8 | G542 | D540-G542 PolarHBondContact O-N 2.88Š|
| 541 | P | 62 | Low | 49.5 | Very low | 120 Ų | 120 | 122.9 Ų | 122.9 | 78% | 0.779 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -52.6 | 132.9 | 170.3 | -27.8 | 36 | 0 | 0 | 0 | 111.2 | K543 | P541-K543 PolarHBondContact O-N 2.84Š|
| 542 | G | 49 | Very low | 49.1 | Very low | 71 Ų | 71 | 121.8 Ų | 121.8 | 73% | 0.732 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -54.5 | 133.4 | -177.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | D540 D544 | D540-G542 PolarHBondContact O-N 2.88Å; G542-D544 PolarHBondContact O-N 3.24Å |
| 543 | K | 43.4 | Very low | 48.3 | Very low | 199 Ų | 199 | 118.1 Ų | 118.1 | 87% | 0.865 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -73.8 | 118.1 | 177 | -61.5 | 167.1 | -170.4 | 166.5 | 0 | 108.1 | P541 G545 | P541-K543 PolarHBondContact O-N 2.84Å; K543-G545 PolarHBondContact O-N 2.04Å |
| 544 | D | 47.9 | Very low | 47.6 | Very low | 166 Ų | 166 | 118.6 Ų | 118.6 | 89% | 0.888 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -54.1 | 131.5 | 177.2 | -73.8 | -50.9 | 0 | 0 | 0 | 111.1 | G542 | G542-D544 PolarHBondContact O-N 3.24Š|
| 545 | G | 45.1 | Very low | 47.3 | Very low | 73 Ų | 73 | 120.9 Ų | 120.9 | 75% | 0.753 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -75.5 | 140.1 | -166.8 | 0 | 0 | 0 | 0 | 0 | 113.9 | K543 P547 | K543-G545 PolarHBondContact O-N 2.04Å; G545-P547 WeakPolarHBondContact O-CD 3.18Å |
| 546 | T | 41.3 | Very low | 46.1 | Very low | 133 Ų | 133 | 122.7 Ų | 122.7 | 82% | 0.816 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -77.7 | 124.7 | 169.8 | 49.6 | 0 | 0 | 0 | 0 | 111.5 | ||
| 547 | P | 49.8 | Very low | 45.4 | Very low | 134 Ų | 134 | 123.2 Ų | 123.2 | 87% | 0.87 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -70.2 | 141.9 | 156.2 | -8.8 | 26.1 | 0 | 0 | 0 | 109.3 | G545 | G545-P547 WeakPolarHBondContact O-CD 3.18Š|
| 548 | G | 38.9 | Very low | 44.6 | Very low | 69 Ų | 69 | 122 Ų | 122 | 71% | 0.711 | 81% | 0.809 | S | S | * | * | cis | 162.3 | 77.3 | -3.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 549 | V | 36.8 | Very low | 44.2 | Very low | 130 Ų | 130 | 123.4 Ų | 123.4 | 79% | 0.788 | 81% | 0.813 | S | S | * | * | trans | -159 | 139.9 | 173.5 | -91.4 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 550 | D | 45.5 | Very low | 44.2 | Very low | 153 Ų | 153 | 123 Ų | 123 | 82% | 0.818 | 81% | 0.808 | S | S | * | * | cis | -130 | 165.6 | 3.6 | -71.4 | -61 | 0 | 0 | 0 | 111.2 | ||||
| 551 | A | 35.2 | Very low | 44.1 | Very low | 95 Ų | 95 | 122.3 Ų | 122.3 | 79% | 0.785 | 81% | 0.812 | S | S | * | * | trans | -101.4 | 139.8 | 163.9 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 552 | P | 46 | Very low | 43.3 | Very low | 110 Ų | 110 | 125.5 Ų | 125.5 | 71% | 0.714 | 82% | 0.817 | S | S | * | * | -139.9 | -169.4 | 75.5 | 45.1 | -30.7 | 0 | 0 | 0 | 111.6 | |||||
| 553 | D | 42.2 | Very low | 43.2 | Very low | 161 Ų | 161 | 125.2 Ų | 125.2 | 86% | 0.861 | 81% | 0.813 | S | S | * | * | cis | -128.9 | 175.7 | 2.5 | -90.6 | -65.8 | 0 | 0 | 0 | 109.3 | ||||
| 554 | G | 39.3 | Very low | 43.2 | Very low | 71 Ų | 71 | 122.1 Ų | 122.1 | 73% | 0.732 | 81% | 0.813 | S | S | * | * | trans | -107.5 | 155.4 | -177.8 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 555 | E | 41 | Very low | 43 | Very low | 202 Ų | 202 | 122.1 Ų | 122.1 | 94% | 0.944 | 81% | 0.808 | S | S | * | * | trans | -163.2 | 173.3 | 136.2 | -114.7 | 177.7 | -163.3 | 0 | 0 | 111.1 | ||||
| 556 | V | 42.1 | Very low | 43.1 | Very low | 154 Ų | 154 | 121.6 Ų | 121.6 | 93% | 0.933 | 80% | 0.803 | S | S | * | * | trans | -122.6 | 130.6 | -163.1 | 175.6 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 557 | G | 42.2 | Very low | 43.2 | Very low | 75 Ų | 75 | 121.7 Ų | 121.7 | 77% | 0.773 | 81% | 0.806 | S | S | * | * | trans | 161 | 147.7 | 165.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 558 | A | 41.4 | Very low | 43.3 | Very low | 104 Ų | 104 | 121.3 Ų | 121.3 | 86% | 0.86 | 80% | 0.801 | S | S | * | * | cis | -152 | 162.9 | -8.9 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 559 | T | 44.4 | Very low | 43.5 | Very low | 151 Ų | 151 | 121.1 Ų | 121.1 | 93% | 0.926 | 80% | 0.799 | S | S | * | * | trans | -75 | 138.3 | -169.4 | -50.3 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 560 | G | 49 | Very low | 43.8 | Very low | 58 Ų | 58 | 121 Ų | 121 | 60% | 0.598 | 80% | 0.801 | S | S | * | * | trans | -109.4 | 163.6 | 168.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 561 | P | 43.7 | Very low | 43.6 | Very low | 140 Ų | 140 | 118.6 Ų | 118.6 | 91% | 0.909 | 80% | 0.802 | S | S | * | * | trans | -78 | 153 | -154.1 | 29.4 | -36.5 | 0 | 0 | 0 | 116.5 | ||||
| 562 | E | 44.7 | Very low | 44 | Very low | 187 Ų | 187 | 117.2 Ų | 117.2 | 87% | 0.874 | 80% | 0.798 | S | S | * | * | trans | -91.6 | 149.6 | -176.8 | 177 | 178.2 | -153.6 | 0 | 0 | 113.5 | ||||
| 563 | G | 48.1 | Very low | 43.9 | Very low | 64 Ų | 64 | 121.1 Ų | 121.1 | 66% | 0.66 | 81% | 0.806 | S | S | * | * | trans | 148.8 | 167.1 | 153.3 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 564 | P | 42.9 | Very low | 44.2 | Very low | 134 Ų | 134 | 119.7 Ų | 119.7 | 87% | 0.87 | 81% | 0.806 | S | S | * | * | cis | -99.6 | 146.1 | -17.6 | 36.4 | -28.2 | 0 | 0 | 0 | 111.8 | ||||
| 565 | Q | 43.3 | Very low | 44.8 | Very low | 166 Ų | 166 | 119.5 Ų | 119.5 | 78% | 0.776 | 80% | 0.803 | S | S | * | * | trans | -82 | 137.7 | -178.4 | -172 | -173.4 | 34.1 | 0 | 0 | 113 | ||||
| 566 | G | 48.4 | Very low | 45.2 | Very low | 63 Ų | 63 | 116.4 Ų | 116.4 | 65% | 0.649 | 80% | 0.801 | S | S | * | * | trans | 160.2 | 159.7 | 151.5 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 567 | P | 41.9 | Very low | 45.5 | Very low | 134 Ų | 134 | 119.8 Ų | 119.8 | 87% | 0.87 | 80% | 0.797 | S | S | * | * | cis | -92.1 | 164.2 | -21.4 | 37.1 | -31.1 | 0 | 0 | 0 | 111.5 | ||||
| 568 | V | 51.5 | Low | 45.9 | Very low | 126 Ų | 126 | 119.5 Ų | 119.5 | 76% | 0.764 | 79% | 0.794 | S | S | * | * | trans | -101.4 | 130.7 | 179.3 | 174 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 569 | G | 43.5 | Very low | 45.6 | Very low | 66 Ų | 66 | 121.6 Ų | 121.6 | 68% | 0.68 | 79% | 0.79 | S | S | * | * | trans | 140.6 | 162.1 | 148.2 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 570 | P | 43.4 | Very low | 45.6 | Very low | 127 Ų | 127 | 120.4 Ų | 120.4 | 83% | 0.825 | 79% | 0.785 | S | S | * | * | cis | -109.5 | 158.9 | -5.3 | 39.1 | -30 | 0 | 0 | 0 | 113.3 | ||||
| 571 | A | 41.8 | Very low | 45.4 | Very low | 102 Ų | 102 | 120.9 Ų | 120.9 | 84% | 0.843 | 79% | 0.789 | S | S | * | * | trans | -74.6 | 146.4 | 152 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 572 | G | 44.2 | Very low | 45.8 | Very low | 67 Ų | 67 | 121.2 Ų | 121.2 | 69% | 0.691 | 79% | 0.789 | S | S | * | * | cis | 118.4 | 140.8 | 19 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 573 | Q | 42.8 | Very low | 45.2 | Very low | 192 Ų | 192 | 122.7 Ų | 122.7 | 90% | 0.897 | 79% | 0.792 | S | S | * | * | trans | -135.5 | 123.5 | 177.8 | -71.1 | -163.1 | -0.6 | 0 | 0 | 112.4 | ||||
| 574 | P | 48.2 | Very low | 44.8 | Very low | 131 Ų | 131 | 122.6 Ų | 122.6 | 85% | 0.851 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -66.8 | 140 | 170.5 | -21 | 33.9 | 0 | 0 | 0 | 112.6 | ||
| 575 | G | 53.1 | Low | 45.1 | Very low | 66 Ų | 66 | 125.9 Ų | 125.9 | 68% | 0.68 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -82.7 | 171.8 | -177.6 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||
| 576 | P | 49.3 | Very low | 44.9 | Very low | 138 Ų | 138 | 124.1 Ų | 124.1 | 90% | 0.896 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -78.4 | 128.3 | -178.2 | 30.7 | -33.8 | 0 | 0 | 0 | 113.5 | ||
| 577 | R | 48.7 | Very low | 44.4 | Very low | 225 Ų | 225 | 124.2 Ų | 124.2 | 85% | 0.849 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -59 | 125.8 | 174.7 | 176.9 | -173.7 | -172.9 | 172.9 | 2.5 | 113.2 | ||
| 578 | G | 48.9 | Very low | 44.1 | Very low | 68 Ų | 68 | 124.1 Ų | 124.1 | 70% | 0.701 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -90.5 | 150.9 | 174.5 | 0 | 0 | 0 | 0 | 0 | 115 | ||
| 579 | L | 36 | Very low | 43.7 | Very low | 149 Ų | 149 | 125.5 Ų | 125.5 | 78% | 0.78 | 80% | 0.804 | S | S | * | * | trans | -162.5 | 167.4 | 174 | -70.2 | -179.1 | 0 | 0 | 0 | 108.6 | ||||
| 580 | P | 44.5 | Very low | 43.4 | Very low | 126 Ų | 126 | 124.7 Ų | 124.7 | 82% | 0.818 | 80% | 0.795 | S | S | * | * | cis | -123.6 | -175.3 | -42.4 | 37.1 | -21.1 | 0 | 0 | 0 | 111.5 | ||||
| 581 | G | 45.5 | Very low | 43.1 | Very low | 67 Ų | 67 | 125.3 Ų | 125.3 | 69% | 0.691 | 80% | 0.799 | S | S | * | * | trans | -97.4 | 145.3 | -164.7 | 0 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 582 | T | 50.6 | Low | 43 | Very low | 147 Ų | 147 | 128.2 Ų | 128.2 | 90% | 0.902 | 80% | 0.799 | S | S | * | * | trans | 56.5 | 114.2 | 143.3 | 60.2 | 0 | 0 | 0 | 0 | 122.7 | ||||
| 583 | K | 33.9 | Very low | 42.5 | Very low | 218 Ų | 218 | 127.8 Ų | 127.8 | 95% | 0.948 | 79% | 0.794 | S | S | * | * | trans | -170.2 | 135.7 | 132.5 | -167.9 | 173.6 | -175.1 | 178.1 | 0 | 108.5 | ||||
| 584 | G | 37.8 | Very low | 42.2 | Very low | 63 Ų | 63 | 126.2 Ų | 126.2 | 65% | 0.649 | 79% | 0.791 | S | S | * | * | cis | -175.3 | 167.6 | -8.5 | 0 | 0 | 0 | 0 | 0 | 108.6 | P586 | G584-P586 WeakPolarHBondContact O-CD 3.33Š| ||
| 585 | E | 50.3 | Low | 41.9 | Very low | 203 Ų | 203 | 122.9 Ų | 122.9 | 95% | 0.949 | 77% | 0.769 | S | S | * | * | trans | -67.1 | 132.5 | 178.9 | -64 | -173.5 | 129.3 | 0 | 0 | 112.1 | ||||
| 586 | P | 38.9 | Very low | 41.3 | Very low | 129 Ų | 129 | 120.5 Ų | 120.5 | 84% | 0.838 | 74% | 0.744 | S | S | * | * | -148.3 | 149.2 | 118.8 | 36.9 | -22 | 0 | 0 | 0 | 114.6 | G584 | G584-P586 WeakPolarHBondContact O-CD 3.33Š| |||
| 587 | G | 38.7 | Very low | 41.1 | Very low | 65 Ų | 65 | 125.8 Ų | 125.8 | 67% | 0.67 | 75% | 0.746 | S | S | * | * | trans | 138.3 | 81.1 | 162.1 | 0 | 0 | 0 | 0 | 0 | 115.6 | I589 | G587-I589 VanDerWaalsContact C-N 3.34Å; G587-I589 PolarHBondContact O-N 2.79Å | ||
| 588 | S | 35 | Very low | 40.5 | Very low | 132 Ų | 132 | 123.3 Ų | 123.3 | 92% | 0.923 | 75% | 0.746 | S | S | * | * | trans | -72.7 | 84.1 | 170.6 | 57.4 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 589 | I | 42.3 | Very low | 40.2 | Very low | 155 Ų | 155 | 123.6 Ų | 123.6 | 80% | 0.795 | 75% | 0.749 | S | S | * | * | trans | -80.1 | 138.7 | 170.1 | -62.6 | 177.5 | 0 | 0 | 0 | 108.6 | G587 | G587-I589 VanDerWaalsContact C-N 3.34Å; G587-I589 PolarHBondContact O-N 2.79Å | ||
| 590 | G | 37.4 | Very low | 40.3 | Very low | 49 Ų | 49 | 123.1 Ų | 123.1 | 51% | 0.505 | 75% | 0.753 | S | S | . | * | trans | -65.1 | 162.8 | -163.7 | 0 | 0 | 0 | 0 | 0 | 115.8 | I592 | G590-I592 PolarHBondContact O-N 2.8Š| ||
| 591 | P | 38.2 | Very low | 40 | Very low | 140 Ų | 140 | 125.5 Ų | 125.5 | 91% | 0.909 | 76% | 0.755 | S | S | * | * | trans | -68.6 | 100.7 | -175.6 | 28.5 | -35.2 | 0 | 0 | 0 | 111.8 | G593 | P591-G593 PolarHBondContact O-N 2.9Å; P591-G593 VanDerWaalsContact O-N 3.09Å | ||
| 592 | I | 38.7 | Very low | 39.7 | Very low | 162 Ų | 162 | 125.3 Ų | 125.3 | 83% | 0.831 | 75% | 0.753 | S | S | * | * | trans | -75.4 | 99.1 | 173.1 | -62.7 | 179.3 | 0 | 0 | 0 | 108.9 | G590 | G590-I592 PolarHBondContact O-N 2.8Š| ||
| 593 | G | 34.9 | Very low | 39 | Very low | 58 Ų | 58 | 124.2 Ų | 124.2 | 60% | 0.598 | 74% | 0.74 | S | S | * | * | trans | 41 | 100 | 157.5 | 0 | 0 | 0 | 0 | 0 | 118 | P591 P595 | P591-G593 PolarHBondContact O-N 2.9Å; P591-G593 VanDerWaalsContact O-N 3.09Å; G593-P595 WeakPolarHBondContact O-CD 3.09Å | ||
| 594 | I | 36.2 | Very low | 39.3 | Very low | 160 Ų | 160 | 119.4 Ų | 119.4 | 82% | 0.821 | 73% | 0.731 | S | S | * | * | P | Polyproline II helix | trans | -61.1 | 120.1 | 160.7 | -53.2 | 171.7 | 0 | 0 | 0 | 108 | ||
| 595 | P | 41.9 | Very low | 39.4 | Very low | 61 Ų | 61 | 119.8 Ų | 119.8 | 40% | 0.396 | 74% | 0.736 | S | S | . | * | P | Polyproline II helix | trans | -89.3 | 128.9 | 176.1 | 33.3 | -24.2 | 0 | 0 | 0 | 109.7 | P75 P76 G77 G593 | P75-P595 CarbonylContact O-C 3.48Å; P75-P595 VanDerWaalsContact O-C 3.25Å; P75-P595 WeakPolarHBondContact O-CA 3.04Å; P75-P595 WeakPolarHBondContact O-CB 3.41Å; P76-P595 WeakPolarHBondContact O-CB 3.31Å; G77-P595 WeakPolarHBondContact CA-O 3.47Å; G593-P595 WeakPolarHBondContact O-CD 3.09Å |
| 596 | G | 40.5 | Very low | 38.7 | Very low | 16 Ų | 16 | 114.5 Ų | 114.5 | 17% | 0.165 | 73% | 0.727 | C | S | . | * | B | Isolated β-bridge | trans | -73.3 | 153.6 | -159.8 | 0 | 0 | 0 | 0 | 0 | 116.2 | P75 P76 G77 | P75-G596 PolarHBondContact O-N 3.46Å; P76-G596 CarbonylContact C-O 2.81Å; G77-G596 PolarHBondContact N-O 3.22Å |
| 597 | R | 43.5 | Very low | 38.9 | Very low | 248 Ų | 248 | 114.5 Ų | 114.5 | 94% | 0.936 | 73% | 0.727 | S | S | * | * | P | Polyproline II helix | trans | -74.1 | 137.4 | 179.8 | -67.3 | -178.2 | 172 | -163.4 | -2.6 | 111.6 | ||
| 598 | M | 37.9 | Very low | 39.3 | Very low | 173 Ų | 173 | 114.2 Ų | 114.2 | 85% | 0.852 | 72% | 0.723 | S | S | * | * | P | Polyproline II helix | trans | -59.6 | 143.8 | 157 | -78.8 | -175.8 | -78.4 | 0 | 0 | 110 | ||
| 599 | G | 40.7 | Very low | 39.5 | Very low | 74 Ų | 74 | 114.1 Ų | 114.1 | 76% | 0.763 | 72% | 0.72 | S | S | * | * | P | Polyproline II helix | trans | -64.8 | 142.4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112 | M601 | G599-M601 PolarHBondContact O-N 2.86Š|
| 600 | V | 38.5 | Very low | 39.6 | Very low | 140 Ų | 140 | 112.7 Ų | 112.7 | 85% | 0.848 | 72% | 0.723 | S | S | * | * | P | Polyproline II helix | trans | -69.6 | 128.2 | 170.8 | -175.3 | 0 | 0 | 0 | 0 | 108.1 | G602 | V600-G602 PolarHBondContact O-N 3.08Š|
| 601 | M | 37.9 | Very low | 40 | Very low | 175 Ų | 175 | 112.9 Ų | 112.9 | 86% | 0.862 | 73% | 0.726 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 121.8 | 171.2 | 179.8 | 169 | 63.3 | 0 | 0 | 108.7 | G599 I603 | G599-M601 PolarHBondContact O-N 2.86Å; M601-I603 PolarHBondContact O-N 2.9Å |
| 602 | G | 40.3 | Very low | 40 | Very low | 63 Ų | 63 | 112.5 Ų | 112.5 | 65% | 0.649 | 72% | 0.723 | S | S | * | * | P | Polyproline II helix | trans | -58.8 | 126.3 | -173.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | V600 | V600-G602 PolarHBondContact O-N 3.08Š|
| 603 | I | 34.7 | Very low | 40.3 | Very low | 125 Ų | 125 | 112.6 Ų | 112.6 | 64% | 0.641 | 73% | 0.725 | S | S | * | * | P | Polyproline II helix | trans | -56.8 | 126.5 | 170.7 | -54.2 | 173.1 | 0 | 0 | 0 | 107.3 | M601 G605 | M601-I603 PolarHBondContact O-N 2.9Å; I603-G605 PolarHBondContact O-N 3.48Å; I603-G605 VanDerWaalsContact O-N 3.16Å |
| 604 | P | 40.2 | Very low | 40.8 | Very low | 116 Ų | 116 | 112.7 Ų | 112.7 | 75% | 0.753 | 73% | 0.726 | S | S | * | * | P | Polyproline II helix | trans | -54.7 | 123.4 | 174.4 | -26 | 35.2 | 0 | 0 | 0 | 109.9 | A606 | P604-A606 PolarHBondContact O-N 2.89Š|
| 605 | G | 41 | Very low | 40.8 | Very low | 72 Ų | 72 | 111 Ų | 111 | 74% | 0.742 | 73% | 0.726 | S | S | * | * | P | Polyproline II helix | trans | -55.4 | 128.7 | -175.6 | 0 | 0 | 0 | 0 | 0 | 111 | I603 | I603-G605 PolarHBondContact O-N 3.48Å; I603-G605 VanDerWaalsContact O-N 3.16Å |
| 606 | A | 35.5 | Very low | 41.1 | Very low | 92 Ų | 92 | 114.1 Ų | 114.1 | 76% | 0.76 | 75% | 0.746 | S | S | * | * | P | Polyproline II helix | trans | -51.3 | 131.6 | 179.3 | 0 | 0 | 0 | 0 | 0 | 110 | P604 G608 | P604-A606 PolarHBondContact O-N 2.89Å; A606-G608 PolarHBondContact O-N 2.83Å; A606-G608 VanDerWaalsContact O-N 3.11Å |
| 607 | P | 44 | Very low | 41.4 | Very low | 129 Ų | 129 | 116.8 Ų | 116.8 | 84% | 0.838 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -52.3 | 122.4 | 178.9 | -28.1 | 35.3 | 0 | 0 | 0 | 110.5 | ||
| 608 | G | 46 | Very low | 40.9 | Very low | 58 Ų | 58 | 115.2 Ų | 115.2 | 60% | 0.598 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -56 | 142.7 | -179.2 | 0 | 0 | 0 | 0 | 0 | 110.6 | A606 S610 | A606-G608 PolarHBondContact O-N 2.83Å; A606-G608 VanDerWaalsContact O-N 3.11Å; G608-S610 PolarHBondContact O-N 3.34Å; G608-S610 VanDerWaalsContact O-N 3.15Å |
| 609 | P | 38.5 | Very low | 40.8 | Very low | 131 Ų | 131 | 115.9 Ų | 115.9 | 85% | 0.851 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -55.4 | 125.7 | -179.4 | 23.9 | -33.9 | 0 | 0 | 0 | 109.1 | G611 | P609-G611 PolarHBondContact O-N 2.78Å; P609-G611 VanDerWaalsContact O-N 3.17Å |
| 610 | S | 44.7 | Very low | 41.1 | Very low | 124 Ų | 124 | 115.5 Ų | 115.5 | 87% | 0.867 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -53.7 | 124.9 | -176.5 | -51.7 | 0 | 0 | 0 | 0 | 109.7 | G608 | G608-S610 PolarHBondContact O-N 3.34Å; G608-S610 VanDerWaalsContact O-N 3.15Å |
| 611 | G | 46.5 | Very low | 40.9 | Very low | 54 Ų | 54 | 116 Ų | 116 | 56% | 0.557 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -54.6 | 147.2 | -178.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | P609 N613 | P609-G611 PolarHBondContact O-N 2.78Å; P609-G611 VanDerWaalsContact O-N 3.17Å; G611-N613 PolarHBondContact O-N 2.85Å; G611-N613 VanDerWaalsContact O-N 3.15Å |
| 612 | P | 37.5 | Very low | 41.1 | Very low | 132 Ų | 132 | 119.3 Ų | 119.3 | 86% | 0.857 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -55.9 | 125.1 | -178.3 | 24.1 | -33.9 | 0 | 0 | 0 | 109.7 | G614 | P612-G614 PolarHBondContact O-N 3.49Š|
| 613 | N | 45 | Very low | 41.2 | Very low | 164 Ų | 164 | 119.1 Ų | 119.1 | 88% | 0.877 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -49.8 | 128.7 | -178.9 | -78.9 | -38.4 | 0 | 0 | 0 | 110.4 | G611 | G611-N613 PolarHBondContact O-N 2.85Å; G611-N613 VanDerWaalsContact O-N 3.15Å |
| 614 | G | 45.7 | Very low | 41.2 | Very low | 60 Ų | 60 | 121.8 Ų | 121.8 | 62% | 0.619 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -55.3 | 149 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | P612 | P612-G614 PolarHBondContact O-N 3.49Š|
| 615 | P | 36.8 | Very low | 41.2 | Very low | 125 Ų | 125 | 122.1 Ų | 122.1 | 81% | 0.812 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -56 | 137 | -176.5 | 23.3 | -33.8 | 0 | 0 | 0 | 110.6 | G617 | P615-G617 PolarHBondContact O-N 3.46Š|
| 616 | P | 47.9 | Very low | 40.8 | Very low | 126 Ų | 126 | 122.6 Ų | 122.6 | 82% | 0.818 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -51.9 | 128.1 | -175.7 | -29.9 | 35.5 | 0 | 0 | 0 | 113 | ||
| 617 | G | 45.7 | Very low | 40.7 | Very low | 72 Ų | 72 | 123 Ų | 123 | 74% | 0.742 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -59 | 138.7 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | P615 K619 | P615-G617 PolarHBondContact O-N 3.46Å; G617-K619 PolarHBondContact O-N 3.12Å |
| 618 | F | 33.2 | Very low | 40.4 | Very low | 214 Ų | 214 | 126.3 Ų | 126.3 | 94% | 0.939 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -58.4 | 132.4 | -179.4 | -78.8 | -87.2 | 0 | 0 | 0 | 111.4 | G620 | F618-G620 PolarHBondContact O-N 3.4Å; F618-G620 VanDerWaalsContact O-N 3.1Å |
| 619 | K | 37.4 | Very low | 40.1 | Very low | 187 Ų | 187 | 127 Ų | 127 | 81% | 0.813 | 81% | 0.805 | S | S | * | * | trans | -56.8 | 110.5 | 176.4 | 178.5 | -171.2 | 174.8 | -168.7 | 0 | 110.4 | G617 | G617-K619 PolarHBondContact O-N 3.12Š| ||
| 620 | G | 45.6 | Very low | 40.2 | Very low | 67 Ų | 67 | 128.4 Ų | 128.4 | 69% | 0.691 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -75.8 | 140.9 | 167.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | F618 | F618-G620 PolarHBondContact O-N 3.4Å; F618-G620 VanDerWaalsContact O-N 3.1Å |
| 621 | D | 34.6 | Very low | 40 | Very low | 151 Ų | 151 | 128.1 Ų | 128.1 | 81% | 0.807 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -76.6 | 134.9 | -177 | -73.2 | -50.7 | 0 | 0 | 0 | 113.4 | ||
| 622 | R | 41.7 | Very low | 40 | Very low | 243 Ų | 243 | 129.1 Ų | 129.1 | 92% | 0.917 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -100.9 | 124.9 | 168.7 | -179 | -173.2 | -171.3 | -179.2 | 4.4 | 106.7 | ||
| 623 | G | 43.1 | Very low | 40.1 | Very low | 60 Ų | 60 | 132.7 Ų | 132.7 | 62% | 0.619 | 81% | 0.812 | S | S | * | * | cis | 136.8 | 149.6 | 7.2 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 624 | I | 34 | Very low | 39.8 | Very low | 181 Ų | 181 | 132.7 Ų | 132.7 | 93% | 0.928 | 81% | 0.811 | S | S | * | * | trans | -118.2 | 147.4 | 171.3 | 58.9 | 170.9 | 0 | 0 | 0 | 110.7 | ||||
| 625 | S | 40.1 | Very low | 39.9 | Very low | 122 Ų | 122 | 133.3 Ų | 133.3 | 85% | 0.853 | 82% | 0.818 | S | S | * | * | trans | -115.1 | 143.1 | -143.8 | -58.4 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 626 | G | 32.8 | Very low | 40 | Very low | 83 Ų | 83 | 136.4 Ų | 136.4 | 86% | 0.856 | 82% | 0.822 | S | S | * | * | trans | 148.3 | 119.2 | 170.3 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 627 | A | 33 | Very low | 39.9 | Very low | 100 Ų | 100 | 136.5 Ų | 136.5 | 83% | 0.826 | 82% | 0.822 | S | S | * | * | cis | -122.2 | -176.3 | 3 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 628 | H | 38.3 | Very low | 40 | Very low | 198 Ų | 198 | 136.8 Ų | 136.8 | 92% | 0.917 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -68.3 | 131.3 | -175.4 | -66.5 | -13.7 | 0 | 0 | 0 | 113.5 | ||
| 629 | G | 40.7 | Very low | 40.1 | Very low | 72 Ų | 72 | 132 Ų | 132 | 74% | 0.742 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -97.7 | 148.5 | 160.8 | 0 | 0 | 0 | 0 | 0 | 111 | ||
| 630 | I | 39.9 | Very low | 40.6 | Very low | 161 Ų | 161 | 129.2 Ų | 129.2 | 83% | 0.826 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -77 | 147.5 | -178.8 | -56.9 | 166.4 | 0 | 0 | 0 | 109.1 | ||
| 631 | P | 39.6 | Very low | 40.5 | Very low | 118 Ų | 118 | 129 Ų | 129 | 77% | 0.766 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -52.2 | 142.3 | 175.3 | -28.8 | 36.6 | 0 | 0 | 0 | 113.5 | ||
| 632 | G | 48.3 | Very low | 40.7 | Very low | 75 Ų | 75 | 128.4 Ų | 128.4 | 77% | 0.773 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -66.6 | 154.1 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||
| 633 | K | 38.3 | Very low | 40.6 | Very low | 208 Ų | 208 | 125 Ų | 125 | 90% | 0.904 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -91.1 | 143.1 | 172.8 | -55.8 | 177.3 | -175.6 | 179 | 0 | 109 | ||
| 634 | D | 39.6 | Very low | 40.5 | Very low | 163 Ų | 163 | 125.6 Ų | 125.6 | 87% | 0.872 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -65 | 147.5 | 177.9 | -60 | -65.4 | 0 | 0 | 0 | 112.3 | ||
| 635 | G | 46.3 | Very low | 40.6 | Very low | 74 Ų | 74 | 122.3 Ų | 122.3 | 76% | 0.763 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -81.4 | 141.8 | -176.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||
| 636 | Q | 40.2 | Very low | 40.4 | Very low | 189 Ų | 189 | 124.4 Ų | 124.4 | 88% | 0.883 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -70.2 | 141.9 | 174.4 | -70.8 | -179.9 | -45.7 | 0 | 0 | 111.7 | ||
| 637 | P | 45.6 | Very low | 40.8 | Very low | 128 Ų | 128 | 122.3 Ų | 122.3 | 83% | 0.831 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -62.1 | 146.3 | 168 | -21.9 | 33.9 | 0 | 0 | 0 | 112.4 | ||
| 638 | G | 47.1 | Very low | 40.9 | Very low | 78 Ų | 78 | 123 Ų | 123 | 80% | 0.804 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -73 | 150.1 | 178.9 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||
| 639 | S | 35.8 | Very low | 40.7 | Very low | 115 Ų | 115 | 117.1 Ų | 117.1 | 80% | 0.804 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -72.9 | 141.5 | 179.1 | 54.9 | 0 | 0 | 0 | 0 | 113.3 | ||
| 640 | P | 48.3 | Very low | 40.5 | Very low | 127 Ų | 127 | 117.2 Ų | 117.2 | 83% | 0.825 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -60.1 | 152.3 | 172 | -23.6 | 34.5 | 0 | 0 | 0 | 114.1 | ||
| 641 | G | 43.2 | Very low | 40.2 | Very low | 63 Ų | 63 | 114.7 Ų | 114.7 | 65% | 0.649 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -77.5 | 164.8 | 177 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||
| 642 | P | 38.2 | Very low | 39.7 | Very low | 138 Ų | 138 | 116.2 Ų | 116.2 | 90% | 0.896 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -75.4 | 153.9 | -174.9 | 31.5 | -36.2 | 0 | 0 | 0 | 113.8 | ||
| 643 | I | 39.8 | Very low | 38.9 | Very low | 171 Ų | 171 | 122 Ų | 122 | 88% | 0.877 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -92.2 | 137 | -179.6 | -58.9 | 173 | 0 | 0 | 0 | 110.4 | ||
| 644 | G | 42.1 | Very low | 38.4 | Very low | 73 Ų | 73 | 118.5 Ų | 118.5 | 75% | 0.753 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -78.4 | 158.5 | 179.3 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||
| 645 | A | 34.9 | Very low | 38 | Very low | 113 Ų | 113 | 114.4 Ų | 114.4 | 93% | 0.934 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -85.9 | 160 | -172.3 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||
| 646 | R | 37.5 | Very low | 37.3 | Very low | 165 Ų | 165 | 114.9 Ų | 114.9 | 62% | 0.623 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -102.3 | 139.5 | -176.1 | 167.8 | 179.4 | 174.7 | -178.7 | 2.6 | 111.8 | P70 | P70-R646 PolarHBondContact O-NH2 3.03Š|
| 647 | G | 41.2 | Very low | 36.8 | Very low | 39 Ų | 39 | 115.3 Ų | 115.3 | 40% | 0.402 | 77% | 0.77 | S | S | . | * | trans | -87.1 | 176.8 | 171.3 | 0 | 0 | 0 | 0 | 0 | 114.7 | P69 | P69-G647 VanDerWaalsContact CB-C 3.49Å; P69-G647 WeakPolarHBondContact CB-O 3.45Å; P69-G647 VanDerWaalsContact CG-C 3.42Å | ||
| 648 | P | 34 | Very low | 36.3 | Very low | 114 Ų | 114 | 114 Ų | 114 | 74% | 0.74 | 77% | 0.765 | S | S | * | * | trans | -108.5 | 141.3 | -178.7 | 38 | -29.9 | 0 | 0 | 0 | 115.5 | P69 | P69-P648 VanDerWaalsContact CG-C 3.43Å; P69-P648 WeakPolarHBondContact CG-O 2.91Å | ||
| 649 | P | 35.2 | Very low | 35.5 | Very low | 75 Ų | 75 | 118.4 Ų | 118.4 | 49% | 0.487 | 77% | 0.769 | S | S | . | * | trans | -95 | 161.4 | 173.2 | 36.6 | -29.4 | 0 | 0 | 0 | 112.2 | P69 | P69-P649 HydrophobicContact CB-CB 4.36Å; P69-P649 HydrophobicContact CB-CG 4.45Å | ||
| 650 | G | 35.3 | Very low | 35.5 | Very low | 75 Ų | 75 | 116.8 Ų | 116.8 | 77% | 0.773 | 77% | 0.77 | S | S | * | * | cis | 161.1 | 153.6 | -2.7 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 651 | A | 32.7 | Very low | 34.7 | Very low | 107 Ų | 107 | 118.3 Ų | 118.3 | 88% | 0.884 | 77% | 0.769 | S | S | * | * | trans | -154.1 | 146.7 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 652 | I | 29.2 | Very low | 34.3 | Very low | 150 Ų | 150 | 124.3 Ų | 124.3 | 77% | 0.769 | 78% | 0.783 | S | S | * | * | trans | -110.2 | 144.4 | 173.8 | -59.9 | 164.4 | 0 | 0 | 0 | 108.1 | ||||
| 653 | H | 31.8 | Very low | 34.5 | Very low | 196 Ų | 196 | 120.6 Ų | 120.6 | 91% | 0.907 | 77% | 0.77 | S | S | * | * | trans | -152.5 | 169.2 | 147.5 | -112.6 | 71.9 | 0 | 0 | 0 | 111.7 | ||||
| 654 | V | 28.6 | Very low | 34.4 | Very low | 136 Ų | 136 | 118.7 Ų | 118.7 | 82% | 0.824 | 77% | 0.769 | S | S | * | * | trans | -119 | 139.9 | -154.8 | 176.2 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 655 | G | 30.4 | Very low | 34.6 | Very low | 77 Ų | 77 | 121.4 Ų | 121.4 | 79% | 0.794 | 77% | 0.773 | S | S | * | * | trans | 114.1 | 162.7 | 148.1 | 0 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 656 | G | 33 | Very low | 35.1 | Very low | 83 Ų | 83 | 119.5 Ų | 119.5 | 86% | 0.856 | 77% | 0.765 | S | S | * | * | trans | 109.9 | 97.2 | 167.2 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 657 | R | 29.5 | Very low | 35.2 | Very low | 198 Ų | 198 | 117.3 Ų | 117.3 | 75% | 0.747 | 77% | 0.772 | S | S | * | * | trans | -83.7 | 133.3 | 154 | -78 | 176.1 | 163.8 | -170.2 | -6.6 | 108.3 | ||||
| 658 | S | 33.4 | Very low | 35.7 | Very low | 102 Ų | 102 | 121.4 Ų | 121.4 | 71% | 0.713 | 79% | 0.789 | S | S | * | * | 149.4 | 128.4 | 111.2 | 67.1 | 0 | 0 | 0 | 0 | 115.4 | |||||
| 659 | L | 30.5 | Very low | 35.9 | Very low | 170 Ų | 170 | 119.6 Ų | 119.6 | 89% | 0.89 | 79% | 0.791 | S | S | * | * | trans | 56 | 118.1 | 139.7 | -63 | 167.8 | 0 | 0 | 0 | 120.6 | ||||
| 660 | G | 36.6 | Very low | 36 | Very low | 80 Ų | 80 | 122.3 Ų | 122.3 | 83% | 0.825 | 80% | 0.802 | S | S | * | * | trans | -174.2 | 97.1 | 164 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 661 | I | 31.3 | Very low | 36.1 | Very low | 159 Ų | 159 | 126.6 Ų | 126.6 | 82% | 0.815 | 81% | 0.807 | S | S | * | * | trans | -103.9 | 155.7 | -173.5 | -57 | 171.9 | 0 | 0 | 0 | 109.7 | ||||
| 662 | M | 35.7 | Very low | 36.4 | Very low | 189 Ų | 189 | 124.5 Ų | 124.5 | 93% | 0.931 | 80% | 0.796 | S | S | * | * | trans | 97.9 | 120.8 | 173.4 | -166.8 | 172 | 69.3 | 0 | 0 | 114 | ||||
| 663 | G | 41.4 | Very low | 36.7 | Very low | 61 Ų | 61 | 124.5 Ų | 124.5 | 63% | 0.629 | 80% | 0.802 | S | S | * | * | cis | -161.4 | 174.2 | -3.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 664 | P | 37.2 | Very low | 36.9 | Very low | 130 Ų | 130 | 124 Ų | 124 | 84% | 0.844 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -76.6 | 159.7 | -170 | 30.5 | -35.7 | 0 | 0 | 0 | 114.8 | ||
| 665 | P | 46.2 | Very low | 37.5 | Very low | 130 Ų | 130 | 120.4 Ų | 120.4 | 84% | 0.844 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -93.4 | 162.7 | -161.6 | -3.7 | 24.9 | 0 | 0 | 0 | 115.4 | ||
| 666 | G | 45.6 | Very low | 37.7 | Very low | 74 Ų | 74 | 123.5 Ų | 123.5 | 76% | 0.763 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -102.7 | 137.1 | 169.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||
| 667 | P | 41.3 | Very low | 38.1 | Very low | 119 Ų | 119 | 125.8 Ų | 125.8 | 77% | 0.773 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -99.2 | 129.8 | -173.5 | 35 | -33.1 | 0 | 0 | 0 | 116.2 | ||
| 668 | V | 49.9 | Very low | 38.5 | Very low | 124 Ų | 124 | 119.3 Ų | 119.3 | 75% | 0.752 | 78% | 0.781 | S | S | * | * | trans | 60.4 | 134.8 | 138.4 | -172.5 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 669 | G | 38.9 | Very low | 39.2 | Very low | 77 Ų | 77 | 120.8 Ų | 120.8 | 79% | 0.794 | 79% | 0.786 | S | S | * | * | trans | -153.5 | 130.5 | 151.2 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 670 | D | 36.6 | Very low | 39.9 | Very low | 132 Ų | 132 | 118.4 Ų | 118.4 | 71% | 0.706 | 78% | 0.78 | S | S | * | * | trans | -107.7 | 158.9 | -166.7 | -75.5 | -53.7 | 0 | 0 | 0 | 115.8 | ||||
| 671 | N | 38.2 | Very low | 40 | Very low | 165 Ų | 165 | 118.2 Ų | 118.2 | 88% | 0.882 | 78% | 0.778 | S | S | * | * | trans | 81.1 | 136.9 | 167.8 | -51.7 | -78.9 | 0 | 0 | 0 | 118.1 | ||||
| 672 | G | 38.6 | Very low | 40.6 | Very low | 63 Ų | 63 | 119.3 Ų | 119.3 | 65% | 0.649 | 78% | 0.782 | S | S | * | * | cis | 165.5 | 172.3 | -11.1 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 673 | V | 35.1 | Very low | 41 | Very low | 150 Ų | 150 | 116.2 Ų | 116.2 | 91% | 0.909 | 78% | 0.776 | S | S | * | * | trans | 57.1 | 120.9 | 155.4 | -68.6 | 0 | 0 | 0 | 0 | 123.6 | ||||
| 674 | Q | 37.4 | Very low | 40.9 | Very low | 185 Ų | 185 | 116.7 Ų | 116.7 | 86% | 0.864 | 78% | 0.781 | S | S | * | * | -157.2 | 164.4 | 115.1 | -170.1 | 156.4 | -41.8 | 0 | 0 | 110.8 | |||||
| 675 | G | 40 | Very low | 40.9 | Very low | 61 Ų | 61 | 120.1 Ų | 120.1 | 63% | 0.629 | 79% | 0.786 | S | S | * | * | trans | -82.2 | -163.3 | -176.7 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 676 | D | 34.5 | Very low | 40.7 | Very low | 142 Ų | 142 | 119.7 Ų | 119.7 | 76% | 0.759 | 79% | 0.786 | S | S | * | * | cis | -162.7 | 164.6 | 41 | -88.7 | -37.2 | 0 | 0 | 0 | 116.4 | ||||
| 677 | V | 43.2 | Very low | 40.7 | Very low | 131 Ų | 131 | 118.9 Ų | 118.9 | 79% | 0.794 | 78% | 0.778 | S | S | * | * | trans | 68.3 | 114 | 151.1 | 171.6 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 678 | G | 37.3 | Very low | 40.7 | Very low | 62 Ų | 62 | 119.8 Ų | 119.8 | 64% | 0.639 | 78% | 0.783 | S | S | * | * | 81.9 | 129.5 | 108.8 | 0 | 0 | 0 | 0 | 0 | 121.4 | |||||
| 679 | V | 47.6 | Very low | 40.3 | Very low | 133 Ų | 133 | 120.9 Ų | 120.9 | 81% | 0.806 | 79% | 0.79 | S | S | * | * | trans | -123.2 | 129.5 | -179.2 | -168.7 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 680 | P | 45.4 | Very low | 40.4 | Very low | 120 Ų | 120 | 120.4 Ų | 120.4 | 78% | 0.779 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -87.2 | 148 | 162 | -10.9 | 29.3 | 0 | 0 | 0 | 112.8 | ||
| 681 | G | 38.1 | Very low | 40.3 | Very low | 75 Ų | 75 | 122.9 Ų | 122.9 | 77% | 0.773 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -72 | 161.1 | -175.7 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||
| 682 | M | 43.8 | Very low | 40.4 | Very low | 182 Ų | 182 | 123.9 Ų | 123.9 | 90% | 0.897 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -79.1 | 138 | -175.1 | -62 | 172.7 | 67.1 | 0 | 0 | 113.8 | ||
| 683 | P | 45.7 | Very low | 40.6 | Very low | 124 Ų | 124 | 123.6 Ų | 123.6 | 81% | 0.805 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -73.8 | 126.1 | 152.2 | -10.4 | 27.6 | 0 | 0 | 0 | 109.7 | ||
| 684 | G | 37.7 | Very low | 40.8 | Very low | 72 Ų | 72 | 122.7 Ų | 122.7 | 74% | 0.742 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -77.9 | 155 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||
| 685 | Q | 37.8 | Very low | 40.9 | Very low | 202 Ų | 202 | 119.5 Ų | 119.5 | 94% | 0.944 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -96.4 | 138.9 | 164.6 | -73.7 | -169.8 | -8.1 | 0 | 0 | 110.6 | ||
| 686 | S | 41.6 | Very low | 40.9 | Very low | 120 Ų | 120 | 120 Ų | 120 | 84% | 0.839 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -77.1 | 142.1 | -166.6 | -46.6 | 0 | 0 | 0 | 0 | 113.6 | ||
| 687 | G | 45.6 | Very low | 41 | Very low | 58 Ų | 58 | 118.4 Ų | 118.4 | 60% | 0.598 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -71.4 | 164.7 | 160.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||
| 688 | P | 42.3 | Very low | 40.6 | Very low | 137 Ų | 137 | 121.7 Ų | 121.7 | 89% | 0.89 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -64.7 | 134.3 | 175.2 | 27.7 | -34.1 | 0 | 0 | 0 | 111.2 | ||
| 689 | V | 41.8 | Very low | 40.6 | Very low | 148 Ų | 148 | 122.1 Ų | 122.1 | 90% | 0.897 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -72.8 | 132.7 | 177.5 | 178.7 | 0 | 0 | 0 | 0 | 109.7 | ||
| 690 | G | 39.8 | Very low | 39.9 | Very low | 67 Ų | 67 | 126.1 Ų | 126.1 | 69% | 0.691 | 82% | 0.818 | S | S | * | * | trans | -87.6 | -174.6 | -174 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 691 | L | 35.6 | Very low | 39.4 | Very low | 183 Ų | 183 | 132.1 Ų | 132.1 | 96% | 0.958 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -88.1 | 151.9 | 169.8 | -76.9 | 171.1 | 0 | 0 | 0 | 111.9 | ||
| 692 | Q | 39.1 | Very low | 39.9 | Very low | 186 Ų | 186 | 131.8 Ų | 131.8 | 87% | 0.869 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -80.1 | 127.5 | -166.1 | -175.3 | 174.9 | 8.4 | 0 | 0 | 112.6 | ||
| 693 | G | 43.5 | Very low | 39.5 | Very low | 58 Ų | 58 | 129.2 Ų | 129.2 | 60% | 0.598 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -74.7 | 147.2 | 168.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||
| 694 | P | 39.5 | Very low | 39 | Very low | 131 Ų | 131 | 129.3 Ų | 129.3 | 85% | 0.851 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -68.9 | 149.1 | 177 | 29.3 | -34.6 | 0 | 0 | 0 | 112.1 | ||
| 695 | S | 39.5 | Very low | 39.3 | Very low | 117 Ų | 117 | 129.3 Ų | 129.3 | 82% | 0.818 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -64.6 | 136 | -170.7 | -53.6 | 0 | 0 | 0 | 0 | 114.6 | ||
| 696 | G | 38.6 | Very low | 39.1 | Very low | 71 Ų | 71 | 124.3 Ų | 124.3 | 73% | 0.732 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -67.4 | 139.2 | 161.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||
| 697 | A | 36.6 | Very low | 39.2 | Very low | 109 Ų | 109 | 125 Ų | 125 | 90% | 0.901 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -72.7 | 158.4 | -178.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||
| 698 | H | 35.5 | Very low | 39.4 | Very low | 200 Ų | 200 | 125.6 Ų | 125.6 | 93% | 0.926 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -103.2 | 140.2 | -173.7 | -110.5 | 58.2 | 0 | 0 | 0 | 113 | ||
| 699 | G | 38.1 | Very low | 39.1 | Very low | 71 Ų | 71 | 125.3 Ų | 125.3 | 73% | 0.732 | 82% | 0.822 | S | S | * | * | trans | 134.1 | 138.2 | 157.1 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 700 | K | 31.6 | Very low | 39.3 | Very low | 218 Ų | 218 | 124.5 Ų | 124.5 | 95% | 0.948 | 82% | 0.819 | S | S | * | * | cis | -133.2 | 170.2 | 4.7 | -74.4 | -178.2 | -179.8 | 172.1 | 0 | 112.3 | ||||
| 701 | R | 36 | Very low | 39.2 | Very low | 246 Ų | 246 | 125.4 Ų | 125.4 | 93% | 0.928 | 83% | 0.828 | S | S | * | * | trans | -121.4 | 137.9 | -171.3 | 167.2 | -166.6 | -72.6 | -133.2 | -0.9 | 111.2 | ||||
| 702 | G | 49 | Very low | 39.4 | Very low | 67 Ų | 67 | 122.2 Ų | 122.2 | 69% | 0.691 | 82% | 0.821 | S | S | * | * | trans | 86.8 | 171.9 | 155.5 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 703 | P | 34.8 | Very low | 39.8 | Very low | 128 Ų | 128 | 119.2 Ų | 119.2 | 83% | 0.831 | 82% | 0.818 | S | S | * | * | cis | -114.9 | 143.1 | 18.4 | 37.9 | -28.6 | 0 | 0 | 0 | 116.2 | ||||
| 704 | S | 34 | Very low | 39.4 | Very low | 126 Ų | 126 | 120.1 Ų | 120.1 | 88% | 0.881 | 83% | 0.827 | S | S | * | * | trans | -81.2 | 150.3 | 137.1 | -43.1 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 705 | G | 44 | Very low | 39.1 | Very low | 72 Ų | 72 | 118.2 Ų | 118.2 | 74% | 0.742 | 82% | 0.822 | S | S | * | * | cis | 167 | -179.4 | 2.2 | 0 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 706 | A | 34.7 | Very low | 38.9 | Very low | 98 Ų | 98 | 120.6 Ų | 120.6 | 81% | 0.81 | 83% | 0.826 | S | S | * | * | trans | -145.1 | 109.8 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 707 | P | 43.1 | Very low | 38.7 | Very low | 135 Ų | 135 | 121 Ų | 121 | 88% | 0.877 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -67.4 | 137.3 | 168.1 | -18.5 | 32.7 | 0 | 0 | 0 | 111.3 | ||
| 708 | G | 50.9 | Low | 38.5 | Very low | 70 Ų | 70 | 127.5 Ų | 127.5 | 72% | 0.722 | 83% | 0.831 | S | S | * | * | P | Polyproline II helix | trans | -89.8 | 153 | 179.3 | 0 | 0 | 0 | 0 | 0 | 114 | ||
| 709 | P | 35.7 | Very low | 38.4 | Very low | 131 Ų | 131 | 123 Ų | 123 | 85% | 0.851 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -87.1 | 163.2 | 171.5 | 35.5 | -34.1 | 0 | 0 | 0 | 112.9 | ||
| 710 | P | 44.9 | Very low | 38.2 | Very low | 131 Ų | 131 | 122.9 Ų | 122.9 | 85% | 0.851 | 83% | 0.828 | S | S | * | * | trans | -117 | 168.7 | -163 | 26.9 | -6.7 | 0 | 0 | 0 | 115.5 | ||||
| 711 | G | 37.7 | Very low | 38.6 | Very low | 85 Ų | 85 | 119.4 Ų | 119.4 | 88% | 0.876 | 83% | 0.825 | S | S | * | * | trans | 104.5 | 126.8 | 157.4 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 712 | S | 40.8 | Very low | 38.6 | Very low | 116 Ų | 116 | 119.6 Ų | 119.6 | 81% | 0.811 | 83% | 0.826 | S | S | * | * | trans | -119.1 | -172.2 | 171 | 65.9 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 713 | P | 47.4 | Very low | 38.3 | Very low | 123 Ų | 123 | 120 Ų | 120 | 80% | 0.799 | 83% | 0.83 | S | S | * | * | cis | -140.2 | 177.3 | -2.2 | 41.6 | -23.6 | 0 | 0 | 0 | 116.8 | ||||
| 714 | G | 35.7 | Very low | 38.5 | Very low | 77 Ų | 77 | 125.2 Ų | 125.2 | 79% | 0.794 | 83% | 0.833 | S | S | * | * | trans | 97.2 | 156.1 | 153.6 | 0 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 715 | A | 32.1 | Very low | 38.5 | Very low | 91 Ų | 91 | 123.9 Ų | 123.9 | 75% | 0.752 | 83% | 0.83 | S | S | * | * | cis | -161.7 | 158.3 | -10.4 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 716 | N | 34.8 | Very low | 38.5 | Very low | 168 Ų | 168 | 124.2 Ų | 124.2 | 90% | 0.898 | 83% | 0.833 | S | S | * | * | trans | 56.7 | 117.7 | 156.6 | -68 | -16.8 | 0 | 0 | 0 | 123 | ||||
| 717 | G | 35.4 | Very low | 38.8 | Very low | 79 Ų | 79 | 124.9 Ų | 124.9 | 81% | 0.814 | 83% | 0.832 | S | S | * | * | trans | 107 | 159.7 | 144.7 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 718 | R | 31.4 | Very low | 38.6 | Very low | 245 Ų | 245 | 123.6 Ų | 123.6 | 93% | 0.925 | 83% | 0.833 | S | S | * | * | cis | -167.2 | 115.8 | -16 | -177.9 | -173.6 | -172.2 | -173.2 | 4.1 | 111 | ||||
| 719 | A | 33.5 | Very low | 38.3 | Very low | 105 Ų | 105 | 123.9 Ų | 123.9 | 87% | 0.868 | 84% | 0.835 | S | S | * | * | trans | 60.2 | 164.8 | 170.2 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 720 | G | 34.2 | Very low | 38.3 | Very low | 70 Ų | 70 | 126.3 Ų | 126.3 | 72% | 0.722 | 84% | 0.835 | S | S | * | * | cis | 144.2 | 126.4 | -17.1 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 721 | T | 40.7 | Very low | 37.8 | Very low | 145 Ų | 145 | 128.2 Ų | 128.2 | 89% | 0.89 | 84% | 0.838 | S | S | * | * | trans | -149.3 | 122.4 | 165.1 | 32.8 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 722 | R | 34.9 | Very low | 37.7 | Very low | 250 Ų | 250 | 128 Ų | 128 | 94% | 0.943 | 84% | 0.835 | S | S | * | * | cis | 101.5 | 104.1 | 20.1 | -168.5 | -172.6 | -175.2 | -178.1 | 3.2 | 114.1 | ||||
| 723 | G | 44.2 | Very low | 37.7 | Very low | 75 Ų | 75 | 126.3 Ų | 126.3 | 77% | 0.773 | 84% | 0.836 | S | S | * | * | trans | 144.3 | 144.9 | 151.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 724 | R | 38.1 | Very low | 37 | Very low | 238 Ų | 238 | 130.2 Ų | 130.2 | 90% | 0.898 | 84% | 0.843 | S | S | * | * | cis | -166 | 114.7 | -17.4 | -176.4 | -177.2 | 176.1 | -178.4 | -1.2 | 105.2 | ||||
| 725 | A | 34.9 | Very low | 37.5 | Very low | 98 Ų | 98 | 129.7 Ų | 129.7 | 81% | 0.81 | 84% | 0.838 | S | S | * | * | 75.6 | 119.6 | 61.6 | 0 | 0 | 0 | 0 | 0 | 115.4 | |||||
| 726 | G | 43.6 | Very low | 37.7 | Very low | 78 Ų | 78 | 131.5 Ų | 131.5 | 80% | 0.804 | 84% | 0.842 | S | S | * | * | trans | 152.4 | 136.6 | 173.5 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 727 | S | 40.8 | Very low | 38.2 | Very low | 113 Ų | 113 | 129.3 Ų | 129.3 | 79% | 0.79 | 84% | 0.837 | S | S | * | * | cis | -157.8 | 124.7 | -4.1 | 46.7 | 0 | 0 | 0 | 0 | 109 | ||||
| 728 | A | 38.8 | Very low | 38.3 | Very low | 108 Ų | 108 | 129 Ų | 129 | 89% | 0.893 | 83% | 0.834 | S | S | * | * | 76.9 | 140 | 101.6 | 0 | 0 | 0 | 0 | 0 | 114.8 | |||||
| 729 | G | 44.8 | Very low | 38.6 | Very low | 76 Ų | 76 | 124.9 Ų | 124.9 | 78% | 0.784 | 84% | 0.836 | S | S | * | * | cis | -153.2 | -153.8 | -4 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 730 | Q | 35.7 | Very low | 38.6 | Very low | 181 Ų | 181 | 129 Ų | 129 | 85% | 0.846 | 84% | 0.837 | S | S | * | * | cis | -165.6 | 110.6 | -4.4 | -174 | 167.1 | -1.1 | 0 | 0 | 106.9 | ||||
| 731 | L | 34 | Very low | 39.3 | Very low | 172 Ų | 172 | 128.4 Ų | 128.4 | 90% | 0.901 | 83% | 0.831 | S | S | * | * | 63.4 | 123.8 | 103.8 | -159.6 | 81.6 | 0 | 0 | 0 | 117.9 | |||||
| 732 | G | 36.7 | Very low | 39.2 | Very low | 80 Ų | 80 | 128.2 Ų | 128.2 | 83% | 0.825 | 83% | 0.832 | S | S | * | * | trans | 105.1 | 142.9 | 166 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 733 | G | 38.9 | Very low | 39.3 | Very low | 80 Ų | 80 | 120.8 Ų | 120.8 | 83% | 0.825 | 83% | 0.825 | S | S | * | * | cis | -162.5 | -173.2 | -0.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 734 | Q | 33.2 | Very low | 39.1 | Very low | 205 Ų | 205 | 121 Ų | 121 | 96% | 0.958 | 83% | 0.827 | S | S | * | * | trans | -81.5 | 159 | -177.4 | -120.6 | 168.2 | -16.2 | 0 | 0 | 113.1 | ||||
| 735 | G | 46.1 | Very low | 38.9 | Very low | 66 Ų | 66 | 117 Ų | 117 | 68% | 0.68 | 82% | 0.822 | S | S | * | * | trans | -73 | -169.1 | 178.1 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 736 | P | 37.3 | Very low | 39.1 | Very low | 130 Ų | 130 | 117.7 Ų | 117.7 | 84% | 0.844 | 82% | 0.817 | S | S | * | * | -145.5 | -140.8 | 71.3 | 47.3 | -27.8 | 0 | 0 | 0 | 112.6 | |||||
| 737 | P | 45.1 | Very low | 38.7 | Very low | 121 Ų | 121 | 117.8 Ų | 117.8 | 79% | 0.786 | 82% | 0.818 | S | S | * | * | trans | -131 | 143.5 | -131.1 | 32.7 | -8.1 | 0 | 0 | 0 | 119 | ||||
| 738 | G | 38.3 | Very low | 38.3 | Very low | 73 Ų | 73 | 118.3 Ų | 118.3 | 75% | 0.753 | 82% | 0.817 | S | S | * | * | trans | 84.2 | 134.3 | 136.5 | 0 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 739 | V | 37.6 | Very low | 38.3 | Very low | 159 Ų | 159 | 119.6 Ų | 119.6 | 96% | 0.964 | 80% | 0.798 | S | S | * | * | trans | -150.3 | 164.1 | 149.2 | -107.6 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 740 | Q | 33.6 | Very low | 38.2 | Very low | 190 Ų | 190 | 118.4 Ų | 118.4 | 89% | 0.888 | 79% | 0.787 | S | S | * | * | trans | -96.4 | 148.5 | -166.7 | 178.7 | 178.2 | -17.4 | 0 | 0 | 112.4 | ||||
| 741 | G | 48.1 | Very low | 38.7 | Very low | 58 Ų | 58 | 113.8 Ų | 113.8 | 60% | 0.598 | 77% | 0.772 | S | S | * | * | trans | -100.4 | 176.7 | 172 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 742 | P | 38.6 | Very low | 39.1 | Very low | 141 Ų | 141 | 111.7 Ų | 111.7 | 92% | 0.916 | 76% | 0.758 | S | S | * | * | trans | -105.4 | 172.4 | 165.8 | 37 | -28.5 | 0 | 0 | 0 | 112.8 | ||||
| 743 | A | 36.5 | Very low | 39.4 | Very low | 95 Ų | 95 | 110.6 Ų | 110.6 | 79% | 0.785 | 75% | 0.747 | S | S | * | * | trans | -105.3 | 163.6 | -163.3 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 744 | G | 40.9 | Very low | 39.6 | Very low | 79 Ų | 79 | 112.5 Ų | 112.5 | 81% | 0.814 | 74% | 0.744 | S | S | * | * | trans | -141.4 | 126.2 | 161.7 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 745 | I | 34.5 | Very low | 40.1 | Very low | 155 Ų | 155 | 114.9 Ų | 114.9 | 80% | 0.795 | 75% | 0.745 | S | S | * | * | trans | -145 | 174.5 | -169.6 | 18.4 | 170.6 | 0 | 0 | 0 | 108.6 | ||||
| 746 | P | 38.5 | Very low | 39.7 | Very low | 111 Ų | 111 | 114.9 Ų | 114.9 | 72% | 0.721 | 74% | 0.744 | S | S | * | * | cis | -135.7 | 156.1 | -26 | 33.6 | -16 | 0 | 0 | 0 | 115.1 | ||||
| 747 | G | 34.9 | Very low | 39.6 | Very low | 80 Ų | 80 | 117 Ų | 117 | 83% | 0.825 | 75% | 0.747 | S | S | * | * | trans | 65.1 | -167.7 | 154.1 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 748 | V | 33 | Very low | 39.7 | Very low | 125 Ų | 125 | 116.8 Ų | 116.8 | 76% | 0.758 | 75% | 0.746 | S | S | * | * | cis | -144.6 | 112 | -4.8 | -175.1 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 749 | R | 38.2 | Very low | 39.7 | Very low | 134 Ų | 134 | 116.9 Ų | 116.9 | 51% | 0.506 | 75% | 0.747 | S | S | . | * | trans | 67 | 147.7 | 140.9 | -169.3 | 174.6 | 168.2 | -140.1 | -7.6 | 121.6 | P1024 I1025 | R749-P1024 VanDerWaalsContact CZ-CG 3.47Å; R749-P1024 PolarHBondContact NH1-O 3.06Å; R749-P1024 VanDerWaalsContact NH2-CG 3.34Å; R749-P1024 PolarHBondContact NH2-O 3.5Å; R749-I1025 VanDerWaalsContact NH2-N 3.2Å | ||
| 750 | G | 42.6 | Very low | 39.7 | Very low | 52 Ų | 52 | 121.5 Ų | 121.5 | 54% | 0.536 | 75% | 0.747 | S | S | . | * | trans | -85.5 | 160.6 | 177.4 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 751 | P | 47.1 | Very low | 40.2 | Very low | 83 Ų | 83 | 121.9 Ų | 121.9 | 54% | 0.539 | 75% | 0.749 | S | S | . | * | trans | -80.8 | 167.6 | -176.2 | 33.8 | -37.1 | 0 | 0 | 0 | 114.6 | D1021 S1022 | P751-D1021 HydrophobicContact CB-CB 3.95Å; P751-D1021 HydrophobicContact CG-CB 4.45Å; P751-S1022 WeakPolarHBondContact CB-OG 3.39Å | ||
| 752 | Q | 42.3 | Very low | 40.3 | Very low | 129 Ų | 129 | 121.9 Ų | 121.9 | 60% | 0.603 | 75% | 0.75 | S | S | * | * | trans | -110.4 | 134.2 | 177.7 | 172.9 | 178.9 | -12.7 | 0 | 0 | 108.7 | P1024 | Q752-P1024 HydrophobicContact CB-CB 4.38Š| ||
| 753 | G | 41.8 | Very low | 40.3 | Very low | 57 Ų | 57 | 121.8 Ų | 121.8 | 59% | 0.588 | 75% | 0.749 | S | S | * | * | trans | -66.4 | 157.7 | -170.5 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 754 | P | 43.9 | Very low | 40.7 | Very low | 119 Ų | 119 | 125.6 Ų | 125.6 | 77% | 0.773 | 75% | 0.75 | S | S | * | * | trans | -73.1 | 161.3 | -172.6 | 29.1 | -36.1 | 0 | 0 | 0 | 114.5 | ||||
| 755 | R | 44.1 | Very low | 40.9 | Very low | 256 Ų | 256 | 125.3 Ų | 125.3 | 97% | 0.966 | 75% | 0.747 | S | S | * | * | trans | -141.6 | 130.3 | -171.7 | 171.4 | -173 | 173.9 | -169 | -0.9 | 111.2 | ||||
| 756 | G | 37.6 | Very low | 41.2 | Very low | 65 Ų | 65 | 125.5 Ų | 125.5 | 67% | 0.67 | 75% | 0.749 | S | S | * | * | trans | 144.2 | 157.3 | 175.6 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 757 | L | 35.5 | Very low | 41.4 | Very low | 175 Ų | 175 | 125.8 Ų | 125.8 | 92% | 0.916 | 75% | 0.75 | S | S | * | * | cis | -127.3 | 167.9 | 8.8 | -79.2 | 173.6 | 0 | 0 | 0 | 112.1 | ||||
| 758 | P | 46.6 | Very low | 41.7 | Very low | 116 Ų | 116 | 125.4 Ų | 125.4 | 75% | 0.753 | 75% | 0.747 | S | S | * | * | trans | -119.7 | 154.8 | -143.7 | 38.3 | -27.2 | 0 | 0 | 0 | 117 | ||||
| 759 | G | 38.8 | Very low | 41.9 | Very low | 76 Ų | 76 | 129.8 Ų | 129.8 | 78% | 0.784 | 76% | 0.755 | S | S | * | * | 71.6 | 122.4 | 129.7 | 0 | 0 | 0 | 0 | 0 | 119.9 | |||||
| 760 | R | 37 | Very low | 42 | Very low | 255 Ų | 255 | 128.2 Ų | 128.2 | 96% | 0.962 | 77% | 0.771 | S | S | * | * | trans | -109.7 | 141.5 | 138.7 | -90.8 | -167.3 | 168.4 | -149 | -4.4 | 110.4 | ||||
| 761 | Q | 44.9 | Very low | 41.9 | Very low | 198 Ų | 198 | 129.2 Ų | 129.2 | 93% | 0.925 | 78% | 0.781 | S | S | * | * | trans | -80.1 | 135.6 | -171.3 | -170.3 | 173.4 | 1.2 | 0 | 0 | 110.7 | ||||
| 762 | G | 49.5 | Very low | 41.4 | Very low | 59 Ų | 59 | 132.6 Ų | 132.6 | 61% | 0.608 | 79% | 0.794 | S | S | * | * | trans | -96.3 | 175.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 763 | P | 38.3 | Very low | 41.3 | Very low | 138 Ų | 138 | 132.3 Ų | 132.3 | 90% | 0.896 | 81% | 0.806 | S | S | * | * | trans | -75.9 | 142 | 168.5 | 32 | -32.5 | 0 | 0 | 0 | 111.4 | ||||
| 764 | Q | 45.8 | Very low | 41.3 | Very low | 175 Ų | 175 | 132.8 Ų | 132.8 | 82% | 0.818 | 81% | 0.811 | S | S | * | * | trans | -80.2 | 144.6 | -167.6 | 176.2 | -178.3 | -5.4 | 0 | 0 | 114.2 | ||||
| 765 | G | 43.4 | Very low | 41.2 | Very low | 73 Ų | 73 | 133.2 Ų | 133.2 | 75% | 0.753 | 81% | 0.814 | S | S | * | * | trans | -128.6 | 84.2 | 173.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 766 | I | 41.3 | Very low | 41.1 | Very low | 160 Ų | 160 | 130.3 Ų | 130.3 | 82% | 0.821 | 81% | 0.811 | S | S | * | * | trans | 35.3 | 111 | 158.8 | -36.1 | 178.3 | 0 | 0 | 0 | 118.9 | ||||
| 767 | P | 42.8 | Very low | 41.4 | Very low | 116 Ų | 116 | 130.2 Ų | 130.2 | 75% | 0.753 | 81% | 0.81 | S | S | * | * | trans | -93.5 | 160.8 | 178.3 | -4.8 | 24.3 | 0 | 0 | 0 | 117.2 | ||||
| 768 | G | 41.5 | Very low | 41.6 | Very low | 73 Ų | 73 | 131.2 Ų | 131.2 | 75% | 0.753 | 81% | 0.81 | S | S | * | * | trans | 117.9 | 146.8 | 155.3 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 769 | K | 38 | Very low | 41.3 | Very low | 217 Ų | 217 | 132 Ų | 132 | 94% | 0.943 | 81% | 0.813 | S | S | * | * | cis | -147 | 166.7 | 5.2 | -65.8 | -175.6 | -176.7 | -179.2 | 0 | 112.3 | ||||
| 770 | A | 39.4 | Very low | 41.7 | Very low | 101 Ų | 101 | 131.9 Ų | 131.9 | 84% | 0.835 | 81% | 0.811 | S | S | * | * | trans | -82.5 | -179.5 | 171 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 771 | G | 40.5 | Very low | 41.8 | Very low | 72 Ų | 72 | 127.6 Ų | 127.6 | 74% | 0.742 | 81% | 0.807 | S | S | * | * | cis | -164.8 | -147.6 | 8.5 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 772 | L | 35.4 | Very low | 42.2 | Very low | 155 Ų | 155 | 124 Ų | 124 | 81% | 0.812 | 80% | 0.801 | S | S | * | * | cis | -173.9 | 141.9 | -6.3 | -120.4 | 173 | 0 | 0 | 0 | 109.9 | ||||
| 773 | S | 41 | Very low | 42.2 | Very low | 122 Ų | 122 | 125 Ų | 125 | 85% | 0.853 | 81% | 0.81 | S | S | * | * | trans | 56.6 | 158.1 | 162.7 | 50.9 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 774 | G | 42.6 | Very low | 42.2 | Very low | 68 Ų | 68 | 128 Ų | 128 | 70% | 0.701 | 81% | 0.81 | S | S | * | * | cis | -160.9 | -146.2 | 6.7 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 775 | P | 42 | Very low | 42.5 | Very low | 127 Ų | 127 | 125.9 Ų | 125.9 | 83% | 0.825 | 81% | 0.811 | S | S | * | * | -137.5 | 160.6 | -105.7 | 40.7 | -25.1 | 0 | 0 | 0 | 120.3 | |||||
| 776 | Q | 41.8 | Very low | 42.9 | Very low | 196 Ų | 196 | 126.1 Ų | 126.1 | 92% | 0.916 | 81% | 0.813 | S | S | * | * | trans | 58.9 | 139.8 | 140.2 | -171.9 | 168.8 | -23.7 | 0 | 0 | 124.5 | ||||
| 777 | G | 43.9 | Very low | 42.8 | Very low | 63 Ų | 63 | 128.5 Ų | 128.5 | 65% | 0.649 | 82% | 0.818 | S | S | * | * | trans | 127.5 | 141.8 | 153.7 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 778 | E | 38 | Very low | 43.1 | Very low | 195 Ų | 195 | 132.1 Ų | 132.1 | 91% | 0.911 | 82% | 0.824 | S | S | * | * | cis | -150.3 | -171.3 | -8.6 | -78.6 | -149.9 | 121.4 | 0 | 0 | 111.5 | ||||
| 779 | T | 42.2 | Very low | 43.8 | Very low | 134 Ų | 134 | 131.2 Ų | 131.2 | 82% | 0.822 | 82% | 0.815 | S | S | * | * | trans | -103.9 | 154.5 | -161.4 | -56.2 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 780 | G | 45.6 | Very low | 43.9 | Very low | 72 Ų | 72 | 127.2 Ų | 127.2 | 74% | 0.742 | 81% | 0.811 | S | S | * | * | trans | -139.1 | 147.8 | 165.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 781 | L | 39.1 | Very low | 44.2 | Very low | 165 Ų | 165 | 128.9 Ų | 128.9 | 86% | 0.864 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -99.6 | 160.6 | -159.4 | -67.7 | 171.4 | 0 | 0 | 0 | 116.1 | ||
| 782 | P | 54.5 | Low | 44.5 | Very low | 124 Ų | 124 | 128.2 Ų | 128.2 | 81% | 0.805 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -82.1 | 148.1 | -171.3 | -12.2 | 30.2 | 0 | 0 | 0 | 116 | ||
| 783 | G | 49.7 | Very low | 44.7 | Very low | 78 Ų | 78 | 127 Ų | 127 | 80% | 0.804 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -85.4 | 155.4 | 169.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||
| 784 | K | 38.1 | Very low | 45.4 | Very low | 202 Ų | 202 | 127.7 Ų | 127.7 | 88% | 0.878 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -88.7 | 154.2 | -171 | -60.1 | 177.1 | -176.3 | 176.7 | 0 | 113 | ||
| 785 | P | 51.5 | Low | 45.2 | Very low | 131 Ų | 131 | 127.9 Ų | 127.9 | 85% | 0.851 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -60.8 | 137.8 | 178.4 | -24 | 34.6 | 0 | 0 | 0 | 114.2 | ||
| 786 | G | 52.6 | Low | 45 | Very low | 77 Ų | 77 | 128.2 Ų | 128.2 | 79% | 0.794 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -78.8 | 150.5 | 171.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||
| 787 | K | 38.7 | Very low | 45.3 | Very low | 211 Ų | 211 | 123.6 Ų | 123.6 | 92% | 0.917 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -80.1 | 149.1 | 178.7 | -61.9 | 179.8 | -178.8 | 179.4 | 0 | 111.2 | ||
| 788 | Q | 48.9 | Very low | 45.2 | Very low | 191 Ų | 191 | 124.5 Ų | 124.5 | 89% | 0.893 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -63.9 | 135 | 177.8 | -175 | 175.9 | 1.4 | 0 | 0 | 111.9 | ||
| 789 | G | 56.1 | Low | 45.1 | Very low | 54 Ų | 54 | 124 Ų | 124 | 56% | 0.557 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -80.8 | 158.3 | 173.1 | 0 | 0 | 0 | 0 | 0 | 113 | ||
| 790 | P | 39.6 | Very low | 44.9 | Very low | 134 Ų | 134 | 125.2 Ų | 125.2 | 87% | 0.87 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -72.1 | 153.4 | -175.5 | 30.8 | -36 | 0 | 0 | 0 | 113 | ||
| 791 | T | 46.5 | Very low | 44.7 | Very low | 135 Ų | 135 | 125.2 Ų | 125.2 | 83% | 0.828 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -78.2 | 126.4 | 173.5 | -56.8 | 0 | 0 | 0 | 0 | 110.5 | ||
| 792 | G | 47.5 | Very low | 44.5 | Very low | 58 Ų | 58 | 124.7 Ų | 124.7 | 60% | 0.598 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -81.9 | 153.9 | 170.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||
| 793 | P | 38.7 | Very low | 44.5 | Very low | 130 Ų | 130 | 124.7 Ų | 124.7 | 84% | 0.844 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -77.1 | 156.9 | -173.5 | 31.8 | -36.1 | 0 | 0 | 0 | 113.5 | ||
| 794 | P | 56.9 | Low | 44.4 | Very low | 137 Ų | 137 | 124.3 Ų | 124.3 | 89% | 0.89 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -103.6 | 163.1 | -173.4 | 16.7 | 3.8 | 0 | 0 | 0 | 114.8 | ||
| 795 | G | 37.1 | Very low | 44.3 | Very low | 71 Ų | 71 | 123.4 Ų | 123.4 | 73% | 0.732 | 81% | 0.805 | S | S | * | * | trans | 136.9 | 170.8 | 155.9 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 796 | P | 39.1 | Very low | 44.6 | Very low | 134 Ų | 134 | 123.3 Ų | 123.3 | 87% | 0.87 | 80% | 0.804 | S | S | * | * | cis | -107.2 | 178.3 | -15 | 38.5 | -27.5 | 0 | 0 | 0 | 112.2 | ||||
| 797 | A | 47.7 | Very low | 44.4 | Very low | 100 Ų | 100 | 122.5 Ų | 122.5 | 83% | 0.826 | 80% | 0.796 | S | S | * | * | trans | -78.5 | 134.7 | -172.2 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 798 | G | 41.1 | Very low | 44.7 | Very low | 81 Ų | 81 | 118.1 Ų | 118.1 | 84% | 0.835 | 79% | 0.789 | S | S | * | * | trans | -84.3 | 147.3 | 145.9 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 799 | K | 36.1 | Very low | 45.2 | Very low | 186 Ų | 186 | 115.2 Ų | 115.2 | 81% | 0.809 | 79% | 0.787 | S | S | * | * | trans | -117.6 | 132 | -168.2 | 34.9 | 172.8 | 172.3 | 170.1 | 0 | 112 | ||||
| 800 | D | 37.6 | Very low | 44.9 | Very low | 159 Ų | 159 | 115.9 Ų | 115.9 | 85% | 0.85 | 79% | 0.794 | S | S | * | * | trans | 53.3 | 120.9 | 153.5 | -43.4 | -34.9 | 0 | 0 | 0 | 119.6 | ||||
| 801 | G | 41.7 | Very low | 45 | Very low | 72 Ų | 72 | 116.2 Ų | 116.2 | 74% | 0.742 | 79% | 0.793 | S | S | * | * | trans | -148.5 | 115.1 | 148.3 | 0 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 802 | D | 35.8 | Very low | 45.1 | Very low | 153 Ų | 153 | 116.5 Ų | 116.5 | 82% | 0.818 | 80% | 0.795 | S | S | * | * | trans | -58.3 | 143.3 | -178.4 | -70.4 | -70.7 | 0 | 0 | 0 | 110.9 | G804 | D802-G804 PolarHBondContact O-N 3.22Š| ||
| 803 | P | 54 | Low | 45 | Very low | 125 Ų | 125 | 116.5 Ų | 116.5 | 81% | 0.812 | 80% | 0.795 | S | S | * | * | trans | -60.2 | 104.2 | 172.1 | -21.2 | 33.2 | 0 | 0 | 0 | 109.8 | E805 | P803-E805 PolarHBondContact O-N 3.35Š| ||
| 804 | G | 46.5 | Very low | 44.8 | Very low | 69 Ų | 69 | 119.3 Ų | 119.3 | 71% | 0.711 | 80% | 0.797 | S | S | * | * | trans | -53.9 | 136.3 | 179.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | D802 | D802-G804 PolarHBondContact O-N 3.22Š| ||
| 805 | E | 36.5 | Very low | 45.1 | Very low | 184 Ų | 184 | 118.8 Ų | 118.8 | 86% | 0.86 | 79% | 0.793 | S | S | * | * | trans | -54.6 | 134.8 | -175.9 | -64 | -169.2 | 130.1 | 0 | 0 | 110.8 | P803 G807 | P803-E805 PolarHBondContact O-N 3.35Å; E805-G807 PolarHBondContact O-N 3.34Å | ||
| 806 | P | 58 | Low | 45.6 | Very low | 129 Ų | 129 | 118.8 Ų | 118.8 | 84% | 0.838 | 79% | 0.793 | S | S | * | * | trans | -57.3 | 111.9 | 176 | -25.5 | 34.9 | 0 | 0 | 0 | 110.6 | ||||
| 807 | G | 48.1 | Very low | 45.5 | Very low | 60 Ų | 60 | 120.6 Ų | 120.6 | 62% | 0.619 | 80% | 0.796 | S | S | * | * | trans | -54.8 | 141.8 | -178.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | E805 | E805-G807 PolarHBondContact O-N 3.34Š| ||
| 808 | P | 45 | Very low | 45.4 | Very low | 119 Ų | 119 | 123 Ų | 123 | 77% | 0.773 | 80% | 0.8 | S | S | * | * | trans | -58.1 | 136.9 | -176.6 | 23.9 | -33.9 | 0 | 0 | 0 | 110.5 | G810 | P808-G810 PolarHBondContact O-N 2.98Š| ||
| 809 | P | 59.1 | Low | 45.6 | Very low | 130 Ų | 130 | 122.1 Ų | 122.1 | 84% | 0.844 | 79% | 0.79 | S | S | * | * | trans | -55.6 | 115.3 | 178.8 | -27.3 | 35.5 | 0 | 0 | 0 | 111.5 | T811 | P809-T811 PolarHBondContact O-N 3.25Š| ||
| 810 | G | 49.9 | Very low | 45.9 | Very low | 68 Ų | 68 | 119.7 Ų | 119.7 | 70% | 0.701 | 80% | 0.797 | S | S | * | * | trans | -60.9 | 130.6 | -179.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | P808 V812 | P808-G810 PolarHBondContact O-N 2.98Å; G810-V812 PolarHBondContact O-N 3.37Å | ||
| 811 | T | 41.3 | Very low | 46.3 | Very low | 140 Ų | 140 | 118.1 Ų | 118.1 | 86% | 0.859 | 80% | 0.796 | S | S | * | * | trans | -61.8 | 118.8 | 173.3 | 47.9 | 0 | 0 | 0 | 0 | 109.9 | P809 G813 | P809-T811 PolarHBondContact O-N 3.25Å; T811-G813 PolarHBondContact O-N 3.2Å; T811-G813 VanDerWaalsContact O-N 3.14Å | ||
| 812 | V | 49.1 | Very low | 46.4 | Very low | 141 Ų | 141 | 118.2 Ų | 118.2 | 86% | 0.855 | 80% | 0.796 | S | S | * | * | trans | -67.9 | 110.5 | 171.2 | 176.6 | 0 | 0 | 0 | 0 | 108.1 | G810 | G810-V812 PolarHBondContact O-N 3.37Š| ||
| 813 | G | 46.6 | Very low | 46.5 | Very low | 59 Ų | 59 | 115.7 Ų | 115.7 | 61% | 0.608 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -69.1 | 152.6 | 170.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | T811 | T811-G813 PolarHBondContact O-N 3.2Å; T811-G813 VanDerWaalsContact O-N 3.14Å |
| 814 | E | 33.7 | Very low | 46.4 | Very low | 189 Ų | 189 | 114.6 Ų | 114.6 | 88% | 0.883 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -67.6 | 129.3 | -176.9 | -62.3 | -176.1 | 121.1 | 0 | 0 | 111.8 | G816 | E814-G816 PolarHBondContact O-N 3.34Š|
| 815 | P | 62.8 | Low | 46.4 | Very low | 125 Ų | 125 | 114.4 Ų | 114.4 | 81% | 0.812 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -67.2 | 120.2 | 165.9 | -17.7 | 32.1 | 0 | 0 | 0 | 110 | ||
| 816 | G | 47.3 | Very low | 46.6 | Very low | 71 Ų | 71 | 112.6 Ų | 112.6 | 73% | 0.732 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -75.5 | 154.7 | -173.7 | 0 | 0 | 0 | 0 | 0 | 115.6 | E814 V818 | E814-G816 PolarHBondContact O-N 3.34Å; G816-V818 PolarHBondContact O-N 2.81Å |
| 817 | D | 37.5 | Very low | 46.4 | Very low | 173 Ų | 173 | 109.7 Ų | 109.7 | 93% | 0.925 | 75% | 0.751 | S | S | * | * | trans | -72.7 | 101.4 | -176.5 | -73.8 | -57.9 | 0 | 0 | 0 | 114.3 | ||||
| 818 | V | 45.5 | Very low | 46.2 | Very low | 150 Ų | 150 | 109 Ų | 109 | 91% | 0.909 | 74% | 0.744 | S | S | * | * | trans | -147.2 | 129.9 | 160.1 | -175.1 | 0 | 0 | 0 | 0 | 108 | G816 | G816-V818 PolarHBondContact O-N 2.81Š| ||
| 819 | G | 44.9 | Very low | 46.1 | Very low | 62 Ų | 62 | 108.3 Ų | 108.3 | 64% | 0.639 | 74% | 0.739 | S | S | * | * | cis | -174.1 | 155.2 | -6.7 | 0 | 0 | 0 | 0 | 0 | 108.1 | P821 | G819-P821 WeakPolarHBondContact O-CD 3.39Š| ||
| 820 | S | 43.6 | Very low | 45.8 | Very low | 135 Ų | 135 | 107.2 Ų | 107.2 | 94% | 0.944 | 73% | 0.725 | S | S | * | * | trans | -106.1 | 94 | -159.6 | 44.7 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 821 | P | 45.6 | Very low | 45.4 | Very low | 127 Ų | 127 | 106.4 Ų | 106.4 | 83% | 0.825 | 72% | 0.716 | S | S | * | * | trans | -132.4 | 146.4 | 148.4 | 35.9 | -22.9 | 0 | 0 | 0 | 112.4 | G819 | G819-P821 WeakPolarHBondContact O-CD 3.39Š| ||
| 822 | G | 43.7 | Very low | 45.4 | Very low | 73 Ų | 73 | 106.9 Ų | 106.9 | 75% | 0.753 | 71% | 0.711 | S | S | * | * | cis | -162.5 | 176.7 | -3.7 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 823 | A | 37.8 | Very low | 45.2 | Very low | 101 Ų | 101 | 106.9 Ų | 106.9 | 84% | 0.835 | 71% | 0.705 | S | S | * | * | P | Polyproline II helix | trans | -74.9 | 150.7 | -174.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||
| 824 | P | 51.5 | Low | 45 | Very low | 101 Ų | 101 | 106.1 Ų | 106.1 | 66% | 0.656 | 70% | 0.696 | S | S | * | * | P | Polyproline II helix | trans | -76.2 | 147.1 | -168.9 | -15.8 | 31.7 | 0 | 0 | 0 | 115 | ||
| 825 | G | 47.3 | Very low | 45.2 | Very low | 66 Ų | 66 | 104.2 Ų | 104.2 | 68% | 0.68 | 69% | 0.689 | S | S | * | * | P | Polyproline II helix | trans | -74.8 | 150.9 | 163.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||
| 826 | R | 41.1 | Very low | 44.2 | Very low | 146 Ų | 146 | 107.3 Ų | 107.3 | 55% | 0.551 | 69% | 0.685 | S | S | * | * | trans | -108.8 | 110.7 | -175.4 | -64.9 | 170.7 | 83.1 | 148.2 | 18.1 | 111 | D1052 | R826-D1052 VanDerWaalsContact CZ-CG 3.47Å; R826-D1052 IonicContact CZ-OD1 3.19Å; R826-D1052 IonicContact CZ-OD2 3.05Å; R826-D1052 IonicContact NE-OD1 3.75Å; R826-D1052 IonicContact NH1-OD1 2.77Å; R826-D1052 PolarHBondContact NH1-OD1 2.88Å; R826-D1052 IonicContact NH1-OD2 2.77Å; R826-D1052 PolarHBondContact NH1-OD2 2.7Å; R826-D1052 IonicContact NH2-OD1 3.65Å; R826-D1052 IonicContact NH2-OD2 2.74Å; R826-D1052 PolarHBondContact NH2-OD2 2.93Å | ||
| 827 | D | 53 | Low | 44 | Very low | 68 Ų | 68 | 105.5 Ų | 105.5 | 36% | 0.364 | 67% | 0.666 | S | S | . | * | trans | -68.7 | 169.4 | -176.8 | 33.8 | -55.5 | 0 | 0 | 0 | 116.2 | G1047 S1049 G1050 | D827-G1047 WeakPolarHBondContact CB-O 3.41Å; D827-S1049 VanDerWaalsContact CG-CA 3.48Å; D827-S1049 VanDerWaalsContact CG-N 3.31Å; D827-S1049 WeakPolarHBondContact O-CA 3.26Å; D827-S1049 WeakPolarHBondContact O-CB 3.41Å; D827-S1049 PolarHBondContact O-N 3.31Å; D827-S1049 PolarHBondContact O-OG 3.04Å; D827-S1049 WeakPolarHBondContact OD1-CA 3.41Å; D827-S1049 PolarHBondContact OD2-N 3.17Å; D827-S1049 VanDerWaalsContact OD2-N 3.1Å; D827-G1050 PolarHBondContact OD1-N 3.42Å | ||
| 828 | G | 44.1 | Very low | 44 | Very low | 46 Ų | 46 | 100.2 Ų | 100.2 | 47% | 0.474 | 64% | 0.642 | S | S | . | * | trans | -136.5 | 160.5 | -176.3 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 829 | P | 43.1 | Very low | 44.1 | Very low | 104 Ų | 104 | 95.5 Ų | 95.5 | 68% | 0.675 | 62% | 0.616 | S | S | * | * | trans | -114.7 | 139.8 | -141.1 | 38.8 | -31.5 | 0 | 0 | 0 | 118.9 | P1048 | P829-P1048 HydrophobicContact CB-CB 4.29Š| ||
| 830 | I | 52.3 | Low | 44 | Very low | 107 Ų | 107 | 95.5 Ų | 95.5 | 55% | 0.549 | 62% | 0.616 | S | S | . | * | trans | 53.2 | 119.3 | 134.7 | -52.8 | -177.8 | 0 | 0 | 0 | 122.4 | M832 P1045 | I830-M832 HydrophobicContact CG2-CG 4.32Å; I830-P1045 HydrophobicContact CB-CG 4.16Å; I830-P1045 HydrophobicContact CG1-CG 4.23Å; I830-P1045 HydrophobicContact CG2-CG 4.01Å | ||
| 831 | G | 42.7 | Very low | 44.1 | Very low | 50 Ų | 50 | 91.7 Ų | 91.7 | 52% | 0.515 | 60% | 0.598 | S | S | . | * | trans | -165.4 | 114.7 | 140.9 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 832 | M | 40.7 | Very low | 44.7 | Very low | 150 Ų | 150 | 92.2 Ų | 92.2 | 74% | 0.739 | 60% | 0.601 | S | S | * | * | 59.8 | 126.5 | 75 | -63.4 | -176.1 | 71.3 | 0 | 0 | 113.9 | I830 | I830-M832 HydrophobicContact CG2-CG 4.32Š| |||
| 833 | I | 44.4 | Very low | 45 | Very low | 142 Ų | 142 | 91.6 Ų | 91.6 | 73% | 0.728 | 60% | 0.596 | S | S | * | * | cis | -155 | 156 | -4.6 | -113.7 | 173.8 | 0 | 0 | 0 | 108.7 | ||||
| 834 | G | 42.4 | Very low | 45.4 | Very low | 42 Ų | 42 | 92.9 Ų | 92.9 | 43% | 0.433 | 60% | 0.595 | S | S | . | * | trans | -175.1 | 100.3 | 170.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | P1042 | G834-P1042 WeakPolarHBondContact O-CB 3.47Å; G834-P1042 WeakPolarHBondContact O-CD 3.46Å; G834-P1042 WeakPolarHBondContact O-CG 3.36Å | ||
| 835 | M | 38.7 | Very low | 45.3 | Very low | 150 Ų | 150 | 98.6 Ų | 98.6 | 74% | 0.739 | 60% | 0.604 | S | S | * | * | trans | -82.9 | 164.2 | -160.9 | -59.7 | 160.7 | 58 | 0 | 0 | 116.1 | ||||
| 836 | R | 42.1 | Very low | 45.6 | Very low | 190 Ų | 190 | 97.8 Ų | 97.8 | 72% | 0.717 | 60% | 0.595 | S | S | * | * | trans | 82.2 | 155.6 | 155.7 | -81 | -167.7 | -160.2 | -177.4 | 10 | 119.8 | E1039 T1040 | R836-E1039 WeakPolarHBondContact CB-OE2 3.3Å; R836-E1039 WeakPolarHBondContact CD-OE2 3.5Å; R836-E1039 HydrophobicContact CG-CB 4.17Å; R836-E1039 WeakPolarHBondContact CG-OE2 2.96Å; R836-T1040 CarbonylContact C-O 3.52Å; R836-T1040 WeakPolarHBondContact CA-O 3.5Å; R836-T1040 PolarHBondContact N-O 3.1Å | ||
| 837 | G | 41.9 | Very low | 45.7 | Very low | 32 Ų | 32 | 96.6 Ų | 96.6 | 33% | 0.33 | 61% | 0.606 | S | S | . | * | trans | 153.2 | -154.9 | -164.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | E1039 T1040 | G837-E1039 PolarHBondContact N-OE2 3.03Å; G837-E1039 CarbonylContact O-C 3.41Å; G837-E1039 WeakPolarHBondContact O-CA 3.35Å; G837-E1039 WeakPolarHBondContact O-CB 3.35Å; G837-E1039 WeakPolarHBondContact O-CG 3.2Å; G837-T1040 PolarHBondContact N-O 3.48Å; G837-T1040 VanDerWaalsContact N-O 3.16Å; G837-T1040 PolarHBondContact O-N 3.42Å; G837-T1040 VanDerWaalsContact O-N 3.11Å | ||
| 838 | S | 37.4 | Very low | 45.9 | Very low | 62 Ų | 62 | 98.1 Ų | 98.1 | 43% | 0.434 | 62% | 0.62 | S | S | . | * | trans | 161.7 | 151 | 151 | 39 | 0 | 0 | 0 | 0 | 114.1 | G1038 T1040 | S838-G1038 WeakPolarHBondContact OG-CA 3.17Å; S838-T1040 VanDerWaalsContact CA-OG1 3.26Å; S838-T1040 WeakPolarHBondContact CA-OG1 3.26Å | ||
| 839 | S | 48.6 | Very low | 46.2 | Very low | 52 Ų | 52 | 98.8 Ų | 98.8 | 36% | 0.364 | 63% | 0.627 | S | S | . | * | -176 | 132.4 | 53.7 | 41.2 | 0 | 0 | 0 | 0 | 110.8 | G841 R1037 | S839-G841 PolarHBondContact O-N 3.16Å; S839-R1037 VanDerWaalsContact CB-CD 3.5Å; S839-R1037 PolarHBondContact O-NH2 3.32Å; S839-R1037 PolarHBondContact OG-NH1 2.91Å | |||
| 840 | G | 42 | Very low | 46.3 | Very low | 62 Ų | 62 | 99.6 Ų | 99.6 | 64% | 0.639 | 63% | 0.632 | S | S | * | * | trans | -58.5 | 120.5 | -161 | 0 | 0 | 0 | 0 | 0 | 116.7 | R1037 | G840-R1037 PolarHBondContact O-NH2 3.18Š| ||
| 841 | G | 46.4 | Very low | 46.5 | Very low | 55 Ų | 55 | 100.6 Ų | 100.6 | 57% | 0.567 | 65% | 0.645 | S | S | * | * | trans | -66.7 | -175.2 | 166.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | S839 G843 | S839-G841 PolarHBondContact O-N 3.16Å; G841-G843 PolarHBondContact O-N 2.82Å | ||
| 842 | P | 57.5 | Low | 46.8 | Very low | 137 Ų | 137 | 101.6 Ų | 101.6 | 89% | 0.89 | 66% | 0.656 | S | S | * | * | P | Polyproline II helix | trans | -56.6 | 126.7 | -176.5 | -24.6 | 34.6 | 0 | 0 | 0 | 112.1 | ||
| 843 | G | 49.8 | Very low | 46.8 | Very low | 61 Ų | 61 | 101.6 Ų | 101.6 | 63% | 0.629 | 66% | 0.658 | S | S | * | * | P | Polyproline II helix | trans | -60.5 | 151.6 | 161 | 0 | 0 | 0 | 0 | 0 | 109.5 | G841 R845 | G841-G843 PolarHBondContact O-N 2.82Å; G843-R845 PolarHBondContact O-N 2.81Å |
| 844 | P | 46.6 | Very low | 47.1 | Very low | 128 Ų | 128 | 100.3 Ų | 100.3 | 83% | 0.831 | 66% | 0.662 | S | S | * | * | P | Polyproline II helix | trans | -55.3 | 143.6 | -178.8 | 24 | -34.1 | 0 | 0 | 0 | 110.5 | G846 | P844-G846 PolarHBondContact O-N 2.85Š|
| 845 | R | 49.5 | Very low | 47.4 | Very low | 221 Ų | 221 | 101.2 Ų | 101.2 | 83% | 0.834 | 67% | 0.671 | S | S | * | * | trans | -50.7 | 108.8 | 172.1 | 173.7 | -179.1 | 176.1 | -173.7 | 0 | 107.9 | G843 | G843-R845 PolarHBondContact O-N 2.81Š| ||
| 846 | G | 53.1 | Low | 47.7 | Very low | 48 Ų | 48 | 98.1 Ų | 98.1 | 50% | 0.495 | 66% | 0.662 | S | S | . | * | P | Polyproline II helix | trans | -54.6 | 148.3 | 172.6 | 0 | 0 | 0 | 0 | 0 | 109.6 | P844 | P844-G846 PolarHBondContact O-N 2.85Š|
| 847 | P | 43.6 | Very low | 48.4 | Very low | 121 Ų | 121 | 97.9 Ų | 97.9 | 79% | 0.786 | 67% | 0.669 | S | S | * | * | P | Polyproline II helix | trans | -51 | 135.8 | 176.3 | 23.4 | -33.7 | 0 | 0 | 0 | 108.5 | G849 | P847-G849 PolarHBondContact O-N 3.37Š|
| 848 | P | 57.7 | Low | 48.8 | Very low | 100 Ų | 100 | 99.3 Ų | 99.3 | 65% | 0.649 | 68% | 0.684 | S | S | * | * | P | Polyproline II helix | trans | -49.3 | 122.5 | 178.7 | -27.4 | 35.1 | 0 | 0 | 0 | 109.5 | ||
| 849 | G | 50.1 | Low | 48.9 | Very low | 60 Ų | 60 | 100.6 Ų | 100.6 | 62% | 0.619 | 70% | 0.699 | S | S | * | * | P | Polyproline II helix | trans | -55.6 | 142.6 | 175.7 | 0 | 0 | 0 | 0 | 0 | 109 | P847 | P847-G849 PolarHBondContact O-N 3.37Š|
| 850 | P | 45.2 | Very low | 49 | Very low | 121 Ų | 121 | 103 Ų | 103 | 79% | 0.786 | 72% | 0.721 | S | S | * | * | P | Polyproline II helix | trans | -52.1 | 134.4 | 178.1 | 23.1 | -33.6 | 0 | 0 | 0 | 108.7 | G852 | P850-G852 PolarHBondContact O-N 2.86Š|
| 851 | P | 57.1 | Low | 49.3 | Very low | 128 Ų | 128 | 103.2 Ų | 103.2 | 83% | 0.831 | 72% | 0.723 | S | S | * | * | P | Polyproline II helix | trans | -47.7 | 118 | -177 | -31 | 36.1 | 0 | 0 | 0 | 110.8 | L853 | P851-L853 PolarHBondContact O-N 2.88Š|
| 852 | G | 48.5 | Very low | 49.1 | Very low | 71 Ų | 71 | 106.9 Ų | 106.9 | 73% | 0.732 | 74% | 0.737 | S | S | * | * | P | Polyproline II helix | trans | -58.6 | 128.8 | -175.3 | 0 | 0 | 0 | 0 | 0 | 109.6 | P850 S854 | P850-G852 PolarHBondContact O-N 2.86Å; G852-S854 PolarHBondContact O-N 3.25Å |
| 853 | L | 39.2 | Very low | 48.4 | Very low | 151 Ų | 151 | 107.1 Ų | 107.1 | 79% | 0.791 | 74% | 0.736 | S | S | * | * | trans | -47.4 | 115.5 | 180 | -69.5 | 172.5 | 0 | 0 | 0 | 109.4 | P851 G855 | P851-L853 PolarHBondContact O-N 2.88Å; L853-G855 PolarHBondContact O-N 3.41Å; L853-G855 VanDerWaalsContact O-N 3.1Å | ||
| 854 | S | 51.9 | Low | 48.3 | Very low | 115 Ų | 115 | 107 Ų | 107 | 80% | 0.804 | 74% | 0.735 | S | S | * | * | P | Polyproline II helix | trans | -58 | 117.4 | -179.5 | 43.7 | 0 | 0 | 0 | 0 | 109 | G852 | G852-S854 PolarHBondContact O-N 3.25Š|
| 855 | G | 49.2 | Very low | 47.9 | Very low | 61 Ų | 61 | 107.2 Ų | 107.2 | 63% | 0.629 | 74% | 0.737 | S | S | * | * | P | Polyproline II helix | trans | -56.8 | 151.6 | -179.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | L853 Q857 | L853-G855 PolarHBondContact O-N 3.41Å; L853-G855 VanDerWaalsContact O-N 3.1Å; G855-Q857 PolarHBondContact O-N 3.05Å |
| 856 | P | 44.3 | Very low | 47.7 | Very low | 84 Ų | 84 | 105.7 Ų | 105.7 | 55% | 0.545 | 74% | 0.739 | S | S | . | * | P | Polyproline II helix | trans | -57.2 | 135.3 | -175.1 | 25.6 | -36.4 | 0 | 0 | 0 | 111.6 | G858 | P856-G858 PolarHBondContact O-N 2.81Š|
| 857 | Q | 55.7 | Low | 47.3 | Very low | 185 Ų | 185 | 106 Ų | 106 | 86% | 0.864 | 74% | 0.742 | S | S | * | * | P | Polyproline II helix | trans | -53.7 | 125.4 | 173.4 | 179.8 | 175.7 | -18.2 | 0 | 0 | 110 | G855 | G855-Q857 PolarHBondContact O-N 3.05Š|
| 858 | G | 50.4 | Low | 46.9 | Very low | 63 Ų | 63 | 106.7 Ų | 106.7 | 65% | 0.649 | 75% | 0.747 | S | S | * | * | P | Polyproline II helix | trans | -60.5 | 146.1 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | P856 | P856-G858 PolarHBondContact O-N 2.81Š|
| 859 | A | 39.5 | Very low | 46.5 | Very low | 89 Ų | 89 | 111.1 Ų | 111.1 | 74% | 0.736 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -57.8 | 142.4 | -178.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||
| 860 | A | 50.8 | Low | 46.2 | Very low | 102 Ų | 102 | 111 Ų | 111 | 84% | 0.843 | 76% | 0.757 | S | S | * | * | P | Polyproline II helix | trans | -61.8 | 140.5 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||
| 861 | G | 49.4 | Very low | 45.9 | Very low | 66 Ų | 66 | 111.6 Ų | 111.6 | 68% | 0.68 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -66.6 | 147.8 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||
| 862 | P | 41.3 | Very low | 45.3 | Very low | 132 Ų | 132 | 117.7 Ų | 117.7 | 86% | 0.857 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -67.4 | 144.6 | -176.8 | 28 | -35.2 | 0 | 0 | 0 | 112.5 | G864 | P862-G864 PolarHBondContact O-N 3Š|
| 863 | T | 42.8 | Very low | 45 | Very low | 142 Ų | 142 | 117.9 Ų | 117.9 | 87% | 0.871 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -57.8 | 128.2 | -177.6 | -46.6 | 0 | 0 | 0 | 0 | 112.8 | ||
| 864 | G | 48.8 | Very low | 44.8 | Very low | 58 Ų | 58 | 116.8 Ų | 116.8 | 60% | 0.598 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -68.2 | 148.4 | 170 | 0 | 0 | 0 | 0 | 0 | 112.2 | P862 | P862-G864 PolarHBondContact O-N 3Š|
| 865 | P | 38.5 | Very low | 44.2 | Very low | 134 Ų | 134 | 121.5 Ų | 121.5 | 87% | 0.87 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -69.7 | 148.2 | -169 | 28 | -35.7 | 0 | 0 | 0 | 113.8 | G867 | P865-G867 PolarHBondContact O-N 2.82Š|
| 866 | Q | 45 | Very low | 43.9 | Very low | 189 Ų | 189 | 122.1 Ų | 122.1 | 88% | 0.883 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -67.4 | 123.1 | 179.7 | -179.7 | 176.4 | -4 | 0 | 0 | 112.2 | ||
| 867 | G | 44 | Very low | 43.5 | Very low | 55 Ų | 55 | 123.2 Ų | 123.2 | 57% | 0.567 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -73.6 | 154.5 | 168.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | P865 | P865-G867 PolarHBondContact O-N 2.82Š|
| 868 | P | 36.3 | Very low | 42.7 | Very low | 135 Ų | 135 | 124.6 Ų | 124.6 | 88% | 0.877 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -77.9 | 153.9 | -161.3 | 30.6 | -36.9 | 0 | 0 | 0 | 115.1 | ||
| 869 | Q | 49.2 | Very low | 42.7 | Very low | 192 Ų | 192 | 124.6 Ų | 124.6 | 90% | 0.897 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -72.7 | 122.2 | 175.5 | -176.2 | 176.7 | 15.2 | 0 | 0 | 111.9 | ||
| 870 | G | 43.9 | Very low | 42.5 | Very low | 57 Ų | 57 | 126.4 Ų | 126.4 | 59% | 0.588 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -77 | 152.9 | 169.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||
| 871 | P | 38 | Very low | 42.3 | Very low | 134 Ų | 134 | 127.6 Ų | 127.6 | 87% | 0.87 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -80.9 | 158.3 | -164.6 | 31.6 | -36.9 | 0 | 0 | 0 | 115.7 | G873 | P871-G873 PolarHBondContact O-N 3.47Å; P871-G873 VanDerWaalsContact O-N 3.13Å |
| 872 | R | 44 | Very low | 41.9 | Very low | 257 Ų | 257 | 128.3 Ų | 128.3 | 97% | 0.97 | 82% | 0.817 | S | S | * | * | trans | -82.4 | 84.2 | -173.5 | -175 | -174.2 | 170.8 | 179.7 | -3.4 | 113.9 | ||||
| 873 | G | 42 | Very low | 41.6 | Very low | 74 Ų | 74 | 127.7 Ų | 127.7 | 76% | 0.763 | 82% | 0.816 | S | S | * | * | trans | 67 | 169.4 | 136 | 0 | 0 | 0 | 0 | 0 | 121.4 | P871 | P871-G873 PolarHBondContact O-N 3.47Å; P871-G873 VanDerWaalsContact O-N 3.13Å | ||
| 874 | S | 36.5 | Very low | 41.5 | Very low | 128 Ų | 128 | 130.2 Ų | 130.2 | 90% | 0.895 | 82% | 0.817 | S | S | * | * | trans | -148.4 | 158.7 | 163 | 62.4 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 875 | K | 39 | Very low | 41.4 | Very low | 214 Ų | 214 | 130.2 Ų | 130.2 | 93% | 0.93 | 82% | 0.818 | S | S | * | * | trans | -119.2 | 137.1 | -176.6 | 170.3 | -168.7 | 179.2 | -173.2 | 0 | 106.5 | ||||
| 876 | G | 41.8 | Very low | 41.4 | Very low | 74 Ų | 74 | 130.1 Ų | 130.1 | 76% | 0.763 | 82% | 0.817 | S | S | * | * | cis | 167.2 | 166 | -0.7 | 0 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 877 | A | 36.7 | Very low | 41.4 | Very low | 108 Ų | 108 | 129.9 Ų | 129.9 | 89% | 0.893 | 82% | 0.816 | S | S | * | * | trans | -132.1 | 146.4 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 878 | K | 39.7 | Very low | 41.6 | Very low | 214 Ų | 214 | 129.8 Ų | 129.8 | 93% | 0.93 | 82% | 0.815 | S | S | * | * | trans | -94 | 124.9 | -176.6 | -172.7 | 179.9 | 179.6 | -176.1 | 0 | 109.5 | ||||
| 879 | G | 48.8 | Very low | 41.8 | Very low | 62 Ų | 62 | 129.3 Ų | 129.3 | 64% | 0.639 | 81% | 0.812 | S | S | * | * | trans | -89 | -176.9 | -177.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 880 | P | 35.8 | Very low | 41.9 | Very low | 127 Ų | 127 | 125.7 Ų | 125.7 | 83% | 0.825 | 81% | 0.805 | S | S | * | * | trans | -79 | 160.4 | 169.5 | 34.8 | -34.5 | 0 | 0 | 0 | 111.8 | ||||
| 881 | P | 47.2 | Very low | 42.1 | Very low | 128 Ų | 128 | 126.2 Ų | 126.2 | 83% | 0.831 | 81% | 0.811 | S | S | * | * | trans | -90.8 | 155.7 | -179 | 0.7 | 20.1 | 0 | 0 | 0 | 113.3 | ||||
| 882 | G | 40.6 | Very low | 42.2 | Very low | 81 Ų | 81 | 129.3 Ų | 129.3 | 84% | 0.835 | 81% | 0.813 | S | S | * | * | trans | 81 | 103.3 | 146.5 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 883 | S | 35.7 | Very low | 41.9 | Very low | 119 Ų | 119 | 124.8 Ų | 124.8 | 83% | 0.832 | 81% | 0.808 | S | S | * | * | trans | -121.8 | 119.7 | 132.8 | 62.1 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 884 | E | 40.1 | Very low | 42.1 | Very low | 194 Ų | 194 | 124.8 Ų | 124.8 | 91% | 0.907 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -52.4 | 129.9 | -179.5 | -165.8 | 162 | -145.6 | 0 | 0 | 111.8 | ||
| 885 | G | 46.9 | Very low | 42.2 | Very low | 59 Ų | 59 | 128.1 Ų | 128.1 | 61% | 0.608 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -86.2 | 142.8 | 169.8 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||
| 886 | P | 37.5 | Very low | 42.2 | Very low | 132 Ų | 132 | 127.1 Ų | 127.1 | 86% | 0.857 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 140.8 | -173.3 | 26.2 | -34.6 | 0 | 0 | 0 | 112.1 | G888 | P886-G888 PolarHBondContact O-N 3.02Š|
| 887 | E | 44.9 | Very low | 42.6 | Very low | 183 Ų | 183 | 126.4 Ų | 126.4 | 86% | 0.855 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -51.8 | 130.2 | 168.9 | -171.9 | 172.8 | -163.8 | 0 | 0 | 110.5 | ||
| 888 | G | 49.6 | Very low | 42.7 | Very low | 53 Ų | 53 | 127.4 Ų | 127.4 | 55% | 0.546 | 80% | 0.799 | S | S | . | * | P | Polyproline II helix | trans | -70.7 | 148.2 | 173 | 0 | 0 | 0 | 0 | 0 | 110.4 | P886 | P886-G888 PolarHBondContact O-N 3.02Š|
| 889 | P | 40.2 | Very low | 43.1 | Very low | 125 Ų | 125 | 127 Ų | 127 | 81% | 0.812 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -58.1 | 137.9 | 176.3 | 26 | -34 | 0 | 0 | 0 | 110 | ||
| 890 | P | 51.6 | Low | 43 | Very low | 116 Ų | 116 | 127.3 Ų | 127.3 | 75% | 0.753 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -52.4 | 144.8 | 169.3 | -26.7 | 35.4 | 0 | 0 | 0 | 111.2 | ||
| 891 | G | 47.8 | Very low | 43 | Very low | 69 Ų | 69 | 129.8 Ų | 129.8 | 71% | 0.711 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -63.7 | 139.7 | 172.2 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||
| 892 | E | 39.1 | Very low | 42.8 | Very low | 198 Ų | 198 | 128.6 Ų | 128.6 | 93% | 0.925 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -66.5 | 133.2 | 177.1 | -62.6 | 178.7 | 137.9 | 0 | 0 | 110.1 | G894 | E892-G894 PolarHBondContact O-N 2.78Š|
| 893 | D | 39.2 | Very low | 43.5 | Very low | 162 Ų | 162 | 127.7 Ų | 127.7 | 87% | 0.866 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -62.5 | 130.3 | -179.4 | -69.7 | -60 | 0 | 0 | 0 | 111.1 | ||
| 894 | G | 46 | Very low | 43.7 | Very low | 74 Ų | 74 | 127.9 Ų | 127.9 | 76% | 0.763 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -71.1 | 131.8 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | E892 Q896 | E892-G894 PolarHBondContact O-N 2.78Å; G894-Q896 PolarHBondContact O-N 2.86Å |
| 895 | E | 37 | Very low | 44.5 | Very low | 198 Ų | 198 | 124.8 Ų | 124.8 | 93% | 0.925 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -56.3 | 130.7 | -179.5 | -66.7 | -171.1 | 121 | 0 | 0 | 112.4 | G897 | E895-G897 PolarHBondContact O-N 3.34Å; E895-G897 VanDerWaalsContact O-N 3.16Å |
| 896 | Q | 40.8 | Very low | 44.9 | Very low | 194 Ų | 194 | 125.5 Ų | 125.5 | 91% | 0.907 | 80% | 0.803 | S | S | * | * | trans | -68.3 | 110.6 | 178.4 | -177.1 | 178.8 | -4.8 | 0 | 0 | 110.5 | G894 | G894-Q896 PolarHBondContact O-N 2.86Š| ||
| 897 | G | 49.8 | Very low | 45 | Very low | 58 Ų | 58 | 128.1 Ų | 128.1 | 60% | 0.598 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -63 | 146.3 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | E895 | E895-G897 PolarHBondContact O-N 3.34Å; E895-G897 VanDerWaalsContact O-N 3.16Å |
| 898 | P | 39.3 | Very low | 45.5 | Very low | 130 Ų | 130 | 125.4 Ų | 125.4 | 84% | 0.844 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -69.8 | 148 | 179.7 | 29.7 | -35.4 | 0 | 0 | 0 | 112.1 | G900 | P898-G900 PolarHBondContact O-N 2.8Š|
| 899 | E | 46.1 | Very low | 45.8 | Very low | 204 Ų | 204 | 126.4 Ų | 126.4 | 95% | 0.953 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -65.6 | 118.7 | -178.4 | -168.1 | 171.7 | -165.3 | 0 | 0 | 111.7 | ||
| 900 | G | 48.6 | Very low | 46 | Very low | 70 Ų | 70 | 128.9 Ų | 128.9 | 72% | 0.722 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -92.3 | 134.6 | -177.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | P898 | P898-G900 PolarHBondContact O-N 2.8Š|
| 901 | L | 35.1 | Very low | 46.1 | Very low | 178 Ų | 178 | 131.3 Ų | 131.3 | 93% | 0.932 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -60.6 | 143.3 | -176.1 | -64.9 | 170.4 | 0 | 0 | 0 | 113.3 | ||
| 902 | A | 43.5 | Very low | 46.6 | Very low | 104 Ų | 104 | 131 Ų | 131 | 86% | 0.86 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -62.2 | 133.9 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||
| 903 | G | 54.9 | Low | 47 | Very low | 62 Ų | 62 | 128 Ų | 128 | 64% | 0.639 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -73 | 156.6 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||
| 904 | P | 40.3 | Very low | 47.8 | Very low | 122 Ų | 122 | 131.5 Ų | 131.5 | 79% | 0.792 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -67 | 150.9 | 176.8 | 29.5 | -35.2 | 0 | 0 | 0 | 111.5 | G906 | P904-G906 PolarHBondContact O-N 3.13Š|
| 905 | P | 55.5 | Low | 48 | Very low | 130 Ų | 130 | 131.2 Ų | 131.2 | 84% | 0.844 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -58 | 134.6 | 172 | -23 | 33.9 | 0 | 0 | 0 | 111.7 | ||
| 906 | G | 55.4 | Low | 48.3 | Very low | 73 Ų | 73 | 131.1 Ų | 131.1 | 75% | 0.753 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -70.1 | 149.1 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | P904 | P904-G906 PolarHBondContact O-N 3.13Š|
| 907 | E | 39.9 | Very low | 48.8 | Very low | 188 Ų | 188 | 133 Ų | 133 | 88% | 0.879 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -64.3 | 141.7 | 176.9 | -62.1 | -174.4 | 135.7 | 0 | 0 | 111.5 | G909 | E907-G909 PolarHBondContact O-N 3.46Š|
| 908 | P | 56.4 | Low | 48.6 | Very low | 126 Ų | 126 | 133.1 Ų | 133.1 | 82% | 0.818 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -60.3 | 126.2 | 173 | -23.4 | 34.3 | 0 | 0 | 0 | 111.7 | ||
| 909 | G | 55.8 | Low | 48.9 | Very low | 73 Ų | 73 | 134.9 Ų | 134.9 | 75% | 0.753 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -63.4 | 139.7 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | E907 | E907-G909 PolarHBondContact O-N 3.46Š|
| 910 | L | 44.7 | Very low | 49.4 | Very low | 178 Ų | 178 | 130.5 Ų | 130.5 | 93% | 0.932 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -64.9 | 134.6 | 179.3 | -66.3 | 171.2 | 0 | 0 | 0 | 111.8 | G912 | L910-G912 PolarHBondContact O-N 3.13Š|
| 911 | D | 53.8 | Low | 49.3 | Very low | 167 Ų | 167 | 130.7 Ų | 130.7 | 89% | 0.893 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -58.7 | 127.5 | 177 | -82.7 | -48.6 | 0 | 0 | 0 | 112.2 | ||
| 912 | G | 57.7 | Low | 50.3 | Low | 62 Ų | 62 | 128.4 Ų | 128.4 | 64% | 0.639 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -68.8 | 145.1 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | L910 R914 | L910-G912 PolarHBondContact O-N 3.13Å; G912-R914 PolarHBondContact O-N 2.92Å; G912-R914 VanDerWaalsContact O-N 3.14Å |
| 913 | P | 47.3 | Very low | 50.6 | Low | 135 Ų | 135 | 132 Ų | 132 | 88% | 0.877 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -61.9 | 119.1 | -177.1 | 24.2 | -33.5 | 0 | 0 | 0 | 111.8 | G915 | P913-G915 PolarHBondContact O-N 2.72Å; P913-G915 VanDerWaalsContact O-N 3.15Å |
| 914 | R | 55.8 | Low | 50.2 | Low | 235 Ų | 235 | 131.8 Ų | 131.8 | 89% | 0.887 | 81% | 0.805 | S | S | * | * | trans | -53.9 | 111.8 | -178.3 | -177 | -178.1 | -172.7 | 169.3 | 4.8 | 112.3 | G912 | G912-R914 PolarHBondContact O-N 2.92Å; G912-R914 VanDerWaalsContact O-N 3.14Å | ||
| 915 | G | 50.6 | Low | 50.9 | Low | 68 Ų | 68 | 132.4 Ų | 132.4 | 70% | 0.701 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -55.6 | 138.5 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | P913 | P913-G915 PolarHBondContact O-N 2.72Å; P913-G915 VanDerWaalsContact O-N 3.15Å |
| 916 | Q | 42.6 | Very low | 50.3 | Low | 197 Ų | 197 | 133.3 Ų | 133.3 | 92% | 0.921 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -68.8 | 141.1 | -178.7 | -68.1 | -172.3 | -0.1 | 0 | 0 | 111.5 | ||
| 917 | R | 51.9 | Low | 49.6 | Very low | 233 Ų | 233 | 132.9 Ų | 132.9 | 88% | 0.879 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -65.8 | 130.9 | -177.2 | 170.5 | -178.5 | -85.5 | 179.3 | -8.8 | 110.7 | ||
| 918 | G | 45.3 | Very low | 49.7 | Very low | 60 Ų | 60 | 133.6 Ų | 133.6 | 62% | 0.619 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -61.5 | 152 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113.7 | P920 | G918-P920 WeakPolarHBondContact O-CD 3.41Š|
| 919 | I | 46.1 | Very low | 48.9 | Very low | 168 Ų | 168 | 134.5 Ų | 134.5 | 86% | 0.862 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -75.9 | 122.8 | -175.5 | -46.2 | 171.7 | 0 | 0 | 0 | 109.9 | ||
| 920 | P | 55.6 | Low | 48.2 | Very low | 111 Ų | 111 | 134.3 Ų | 134.3 | 72% | 0.721 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -69.8 | 129.4 | 169.1 | -16.4 | 31.8 | 0 | 0 | 0 | 110.6 | G918 | G918-P920 WeakPolarHBondContact O-CD 3.41Š|
| 921 | G | 46.9 | Very low | 47.9 | Very low | 74 Ų | 74 | 135.1 Ų | 135.1 | 76% | 0.763 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -73.5 | 133.9 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||
| 922 | P | 56.3 | Low | 47.6 | Very low | 130 Ų | 130 | 133.6 Ų | 133.6 | 84% | 0.844 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -73.4 | 149.1 | 172 | 30.4 | -33.7 | 0 | 0 | 0 | 111.9 | ||
| 923 | L | 49 | Very low | 46.7 | Very low | 180 Ų | 180 | 134.2 Ų | 134.2 | 94% | 0.942 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -68.6 | 143.2 | -177.8 | -168.2 | 67.6 | 0 | 0 | 0 | 112 | ||
| 924 | G | 47.5 | Very low | 46.5 | Very low | 58 Ų | 58 | 137.2 Ų | 137.2 | 60% | 0.598 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -82.1 | 162.4 | -179.7 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||
| 925 | P | 54.1 | Low | 45.8 | Very low | 134 Ų | 134 | 134.3 Ų | 134.3 | 87% | 0.87 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -74.1 | 153.4 | 173.4 | 31.7 | -34.8 | 0 | 0 | 0 | 112.4 | ||
| 926 | V | 44.2 | Very low | 45.2 | Very low | 149 Ų | 149 | 134.4 Ų | 134.4 | 90% | 0.903 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -74.1 | 146 | 176.9 | 178.2 | 0 | 0 | 0 | 0 | 110.7 | ||
| 927 | G | 39.9 | Very low | 45.1 | Very low | 65 Ų | 65 | 136.4 Ų | 136.4 | 67% | 0.67 | 82% | 0.821 | S | S | * | * | trans | -100.3 | -165.8 | -176.6 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 928 | E | 41.9 | Very low | 45 | Very low | 202 Ų | 202 | 131.8 Ų | 131.8 | 94% | 0.944 | 82% | 0.821 | S | S | * | * | trans | -103.5 | 166.9 | 176.7 | -64.7 | -170.5 | 131.4 | 0 | 0 | 112.6 | ||||
| 929 | V | 40.3 | Very low | 45 | Very low | 146 Ų | 146 | 132.2 Ų | 132.2 | 89% | 0.885 | 83% | 0.826 | S | S | * | * | trans | -133.1 | 137 | -164.4 | 174 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 930 | G | 39.6 | Very low | 45.3 | Very low | 69 Ų | 69 | 130.5 Ų | 130.5 | 71% | 0.711 | 83% | 0.825 | S | S | * | * | trans | 106.1 | 150.7 | 164.4 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 931 | Q | 38.5 | Very low | 44.7 | Very low | 194 Ų | 194 | 134.5 Ų | 134.5 | 91% | 0.907 | 84% | 0.835 | S | S | * | * | cis | -142.3 | 155.7 | 3.3 | -61.8 | 179.8 | -1.7 | 0 | 0 | 111.1 | ||||
| 932 | P | 48.4 | Very low | 44.4 | Very low | 136 Ų | 136 | 134 Ų | 134 | 88% | 0.883 | 83% | 0.83 | S | S | * | * | trans | -102.8 | 152.3 | 177.2 | 37 | -31.3 | 0 | 0 | 0 | 115 | ||||
| 933 | G | 39.5 | Very low | 43.7 | Very low | 74 Ų | 74 | 137.7 Ų | 137.7 | 76% | 0.763 | 84% | 0.836 | S | S | * | * | trans | 126.2 | 147.5 | 174 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 934 | Q | 42.6 | Very low | 43.3 | Very low | 199 Ų | 199 | 141.1 Ų | 141.1 | 93% | 0.93 | 84% | 0.836 | S | S | * | * | cis | -145.8 | 169.5 | 4.8 | -64 | 180 | -11.6 | 0 | 0 | 111.1 | ||||
| 935 | D | 40.3 | Very low | 43 | Very low | 174 Ų | 174 | 141.5 Ų | 141.5 | 93% | 0.93 | 84% | 0.84 | S | S | * | * | trans | -80.7 | 156.3 | -177.8 | -69.4 | -67.8 | 0 | 0 | 0 | 116.4 | ||||
| 936 | G | 38.2 | Very low | 42.6 | Very low | 69 Ų | 69 | 142.2 Ų | 142.2 | 71% | 0.711 | 84% | 0.842 | S | S | * | * | trans | 141.6 | 137 | 161.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 937 | R | 41.4 | Very low | 42.5 | Very low | 240 Ų | 240 | 139.7 Ų | 139.7 | 91% | 0.906 | 83% | 0.83 | S | S | * | * | cis | -145.7 | 158.6 | 8 | -61.9 | 175.5 | 177.3 | 174.9 | -2 | 110.8 | ||||
| 938 | P | 48.8 | Very low | 42.6 | Very low | 135 Ų | 135 | 140.4 Ų | 140.4 | 88% | 0.877 | 84% | 0.838 | S | S | * | * | trans | -63 | 150.8 | 166.6 | -20.4 | 33.6 | 0 | 0 | 0 | 113.1 | ||||
| 939 | G | 46.4 | Very low | 42.5 | Very low | 70 Ų | 70 | 139.7 Ų | 139.7 | 72% | 0.722 | 83% | 0.832 | S | S | * | * | trans | -108 | -172.9 | -174.8 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 940 | P | 52.7 | Low | 42.7 | Very low | 131 Ų | 131 | 138.8 Ų | 138.8 | 85% | 0.851 | 83% | 0.829 | S | S | * | * | trans | -97.5 | 127.4 | -174.7 | 35.2 | -31.5 | 0 | 0 | 0 | 114.8 | ||||
| 941 | Q | 43.1 | Very low | 43 | Very low | 196 Ų | 196 | 139.1 Ų | 139.1 | 92% | 0.916 | 83% | 0.832 | S | S | * | * | trans | -68.8 | 147.1 | 148.4 | 167.2 | -169.5 | -31.4 | 0 | 0 | 108.7 | ||||
| 942 | G | 40.1 | Very low | 43.2 | Very low | 64 Ų | 64 | 138 Ų | 138 | 66% | 0.66 | 83% | 0.832 | S | S | * | * | cis | 145.2 | 154.7 | 3.3 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 943 | E | 42.1 | Very low | 43.2 | Very low | 207 Ų | 207 | 137.5 Ų | 137.5 | 97% | 0.967 | 83% | 0.828 | S | S | * | * | trans | -123 | 159.6 | 178.3 | -73.1 | -151.6 | 139.7 | 0 | 0 | 114.3 | ||||
| 944 | R | 40.1 | Very low | 43.8 | Very low | 251 Ų | 251 | 137 Ų | 137 | 95% | 0.947 | 82% | 0.823 | S | S | * | * | trans | -152.5 | 121.5 | -170.1 | 176 | -163.2 | -73 | -171.5 | -3.1 | 112.3 | ||||
| 945 | G | 41.4 | Very low | 43.9 | Very low | 67 Ų | 67 | 133.3 Ų | 133.3 | 69% | 0.691 | 82% | 0.817 | S | S | * | * | trans | 146.7 | 150.3 | 161.7 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 946 | V | 44.4 | Very low | 44.8 | Very low | 149 Ų | 149 | 131.6 Ų | 131.6 | 90% | 0.903 | 82% | 0.815 | S | S | * | * | cis | -145.7 | 142 | -6 | -169.3 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 947 | S | 43.4 | Very low | 45.3 | Very low | 95 Ų | 95 | 131.8 Ų | 131.8 | 66% | 0.664 | 82% | 0.817 | S | S | * | * | trans | -11.7 | 128.1 | 170.2 | 174.4 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 948 | G | 42.5 | Very low | 45 | Very low | 81 Ų | 81 | 127.6 Ų | 127.6 | 84% | 0.835 | 82% | 0.818 | S | S | * | * | trans | -136.2 | 128.9 | 145.4 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 949 | K | 38.7 | Very low | 45 | Very low | 186 Ų | 186 | 131.1 Ų | 131.1 | 81% | 0.809 | 82% | 0.82 | S | S | * | * | trans | -117.2 | 168.4 | -172.2 | -64 | -178 | -175.8 | 178.5 | 0 | 111.4 | ||||
| 950 | P | 45.4 | Very low | 45.1 | Very low | 127 Ų | 127 | 131.5 Ų | 131.5 | 83% | 0.825 | 82% | 0.823 | S | S | * | * | cis | -128.1 | 160 | -29.4 | 31.1 | -13.6 | 0 | 0 | 0 | 113.7 | ||||
| 951 | G | 44.6 | Very low | 44.4 | Very low | 76 Ų | 76 | 130 Ų | 130 | 78% | 0.784 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -100.2 | 159.5 | 165.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||
| 952 | L | 42.8 | Very low | 44.5 | Very low | 172 Ų | 172 | 125.7 Ų | 125.7 | 90% | 0.901 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -74.4 | 162.1 | -177.2 | -74.3 | 168.1 | 0 | 0 | 0 | 113.5 | ||
| 953 | P | 49.6 | Very low | 44.9 | Very low | 124 Ų | 124 | 126.4 Ų | 126.4 | 81% | 0.805 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -62.8 | 133.1 | -170.7 | -24.3 | 35.2 | 0 | 0 | 0 | 115.1 | ||
| 954 | G | 51.4 | Low | 44.7 | Very low | 64 Ų | 64 | 125.2 Ų | 125.2 | 66% | 0.66 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -79 | 164.7 | 166.3 | 0 | 0 | 0 | 0 | 0 | 113 | ||
| 955 | P | 44.6 | Very low | 44.8 | Very low | 121 Ų | 121 | 120.4 Ų | 120.4 | 79% | 0.786 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -71.1 | 151.6 | -173.7 | 28.9 | -35.6 | 0 | 0 | 0 | 113.4 | G957 | P955-G957 PolarHBondContact O-N 2.88Š|
| 956 | P | 59.3 | Low | 44.7 | Very low | 138 Ų | 138 | 120.3 Ų | 120.3 | 90% | 0.896 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -55.7 | 129.3 | 170.4 | -25.3 | 35.4 | 0 | 0 | 0 | 112.1 | ||
| 957 | G | 48.1 | Very low | 44.7 | Very low | 74 Ų | 74 | 118.8 Ų | 118.8 | 76% | 0.763 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -89.5 | 165.8 | -163 | 0 | 0 | 0 | 0 | 0 | 116.7 | P955 | P955-G957 PolarHBondContact O-N 2.88Š|
| 958 | V | 36.4 | Very low | 44.6 | Very low | 152 Ų | 152 | 122.2 Ų | 122.2 | 92% | 0.921 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -67.4 | 138.3 | 169.3 | -74.1 | 0 | 0 | 0 | 0 | 111.6 | ||
| 959 | K | 48.4 | Very low | 44.6 | Very low | 209 Ų | 209 | 122.1 Ų | 122.1 | 91% | 0.909 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -96.2 | 129.7 | 173.1 | -169 | 175.6 | 179.3 | -177.1 | 0 | 109.5 | ||
| 960 | G | 48.1 | Very low | 44.4 | Very low | 77 Ų | 77 | 121.9 Ų | 121.9 | 79% | 0.794 | 82% | 0.824 | S | S | * | * | trans | -72.2 | 175.6 | -170.7 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 961 | A | 38.5 | Very low | 44 | Very low | 100 Ų | 100 | 123.1 Ų | 123.1 | 83% | 0.826 | 82% | 0.824 | S | S | * | * | trans | -103.1 | 152.3 | -169.2 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 962 | A | 43.7 | Very low | 43.9 | Very low | 106 Ų | 106 | 122.6 Ų | 122.6 | 88% | 0.876 | 82% | 0.818 | S | S | * | * | trans | 62 | 138.5 | 153.1 | 0 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 963 | G | 48.5 | Very low | 43.8 | Very low | 78 Ų | 78 | 120.7 Ų | 120.7 | 80% | 0.804 | 82% | 0.819 | S | S | * | * | trans | -151.1 | 136.8 | 151.5 | 0 | 0 | 0 | 0 | 0 | 107 | ||||
| 964 | E | 38.7 | Very low | 43.7 | Very low | 182 Ų | 182 | 120.3 Ų | 120.3 | 85% | 0.85 | 82% | 0.819 | S | S | * | * | trans | -117.3 | 177.6 | -174.1 | -65.3 | -172.4 | 126.9 | 0 | 0 | 112 | ||||
| 965 | T | 41.8 | Very low | 43.4 | Very low | 151 Ų | 151 | 120.7 Ų | 120.7 | 93% | 0.926 | 82% | 0.823 | S | S | * | * | trans | 82.4 | 136.8 | -178.8 | -31.7 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 966 | G | 40.7 | Very low | 43.3 | Very low | 65 Ų | 65 | 123.1 Ų | 123.1 | 67% | 0.67 | 83% | 0.829 | S | S | * | * | cis | -153.3 | -172.6 | 5.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 967 | P | 44.5 | Very low | 43.1 | Very low | 117 Ų | 117 | 122.5 Ų | 122.5 | 76% | 0.76 | 83% | 0.825 | S | S | * | * | trans | -110.1 | 169.6 | -140.2 | 40.8 | -38.7 | 0 | 0 | 0 | 118.8 | ||||
| 968 | D | 41.2 | Very low | 43.2 | Very low | 167 Ų | 167 | 122.2 Ų | 122.2 | 89% | 0.893 | 82% | 0.822 | S | S | * | * | trans | 72.3 | 134.5 | 153.1 | -61.5 | -21.1 | 0 | 0 | 0 | 122.8 | ||||
| 969 | G | 42.5 | Very low | 43.7 | Very low | 78 Ų | 78 | 120.2 Ų | 120.2 | 80% | 0.804 | 81% | 0.814 | S | S | * | * | trans | 173.6 | 77.5 | -179.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 970 | Q | 34.8 | Very low | 44.2 | Very low | 182 Ų | 182 | 116.3 Ų | 116.3 | 85% | 0.85 | 81% | 0.811 | S | S | * | * | trans | -65.3 | 152.1 | 167.8 | -75.7 | 166.6 | -23.7 | 0 | 0 | 110.5 | ||||
| 971 | D | 36.8 | Very low | 44.2 | Very low | 153 Ų | 153 | 116 Ų | 116 | 82% | 0.818 | 81% | 0.807 | S | S | * | * | cis | -142.4 | 166.1 | 6.9 | -96 | -42.7 | 0 | 0 | 0 | 110.7 | ||||
| 972 | G | 41.7 | Very low | 44.5 | Very low | 64 Ų | 64 | 115.1 Ų | 115.1 | 66% | 0.66 | 81% | 0.808 | S | S | * | * | trans | 172.5 | 81.2 | 172.1 | 0 | 0 | 0 | 0 | 0 | 115.7 | S974 | G972-S974 PolarHBondContact O-N 2.89Å; G972-S974 VanDerWaalsContact O-N 3.17Å | ||
| 973 | S | 40.6 | Very low | 44.6 | Very low | 132 Ų | 132 | 121.6 Ų | 121.6 | 92% | 0.923 | 81% | 0.81 | S | S | * | * | trans | -58.8 | 115.4 | -177.2 | 56.6 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 974 | S | 48.3 | Very low | 44.5 | Very low | 117 Ų | 117 | 120.7 Ų | 120.7 | 82% | 0.818 | 80% | 0.8 | S | S | * | * | trans | -123 | 141.4 | 173.8 | -62.8 | 0 | 0 | 0 | 0 | 110.2 | G972 | G972-S974 PolarHBondContact O-N 2.89Å; G972-S974 VanDerWaalsContact O-N 3.17Å | ||
| 975 | G | 45.3 | Very low | 44.4 | Very low | 72 Ų | 72 | 120.9 Ų | 120.9 | 74% | 0.742 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -71.5 | 165.3 | -163.7 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||
| 976 | L | 40.9 | Very low | 45 | Very low | 172 Ų | 172 | 119.3 Ų | 119.3 | 90% | 0.901 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -54.9 | 130.1 | 172.1 | -71 | 167.3 | 0 | 0 | 0 | 111 | G978 | L976-G978 PolarHBondContact O-N 3.01Š|
| 977 | P | 55.9 | Low | 45.2 | Very low | 125 Ų | 125 | 119.3 Ų | 119.3 | 81% | 0.812 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -58.2 | 125.1 | 165.7 | -23 | 34.2 | 0 | 0 | 0 | 110 | ||
| 978 | G | 50.4 | Low | 45 | Very low | 68 Ų | 68 | 126.1 Ų | 126.1 | 70% | 0.701 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 141.3 | 180 | 0 | 0 | 0 | 0 | 0 | 112 | L976 | L976-G978 PolarHBondContact O-N 3.01Š|
| 979 | S | 45.9 | Very low | 45.4 | Very low | 109 Ų | 109 | 123.7 Ų | 123.7 | 76% | 0.762 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -53 | 128.9 | 173.4 | 51.9 | 0 | 0 | 0 | 0 | 110.5 | G981 | S979-G981 PolarHBondContact O-N 2.92Š|
| 980 | P | 59.3 | Low | 45.8 | Very low | 128 Ų | 128 | 122.8 Ų | 122.8 | 83% | 0.831 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -52.3 | 125 | 174.6 | -27.5 | 35.4 | 0 | 0 | 0 | 110.7 | ||
| 981 | G | 48.3 | Very low | 46.4 | Very low | 70 Ų | 70 | 119.8 Ų | 119.8 | 72% | 0.722 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -55.6 | 140.1 | -174.7 | 0 | 0 | 0 | 0 | 0 | 112 | S979 R983 | S979-G981 PolarHBondContact O-N 2.92Å; G981-R983 PolarHBondContact O-N 3.33Å |
| 982 | G | 45.9 | Very low | 47.4 | Very low | 81 Ų | 81 | 118.7 Ų | 118.7 | 84% | 0.835 | 79% | 0.788 | S | S | * | * | trans | -53.2 | 114.5 | -179.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | G984 | G982-G984 PolarHBondContact O-N 2.94Å; G982-G984 VanDerWaalsContact O-N 3.11Å | ||
| 983 | R | 45.9 | Very low | 48.2 | Very low | 243 Ų | 243 | 118.6 Ų | 118.6 | 92% | 0.917 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -62.3 | 116.3 | 178.2 | -172.3 | 178.7 | -172.5 | 175.6 | 2.8 | 108.2 | G981 | G981-R983 PolarHBondContact O-N 3.33Š|
| 984 | G | 46.6 | Very low | 48.6 | Very low | 59 Ų | 59 | 118 Ų | 118 | 61% | 0.608 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -50.7 | 145 | -175.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | G982 P986 | G982-G984 PolarHBondContact O-N 2.94Å; G982-G984 VanDerWaalsContact O-N 3.11Å; G984-P986 WeakPolarHBondContact O-CD 3.48Å |
| 985 | H | 36.3 | Very low | 49.3 | Very low | 185 Ų | 185 | 118.4 Ų | 118.4 | 86% | 0.856 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -50.5 | 123.3 | -175.1 | -50 | -73.9 | 0 | 0 | 0 | 110.8 | G987 | H985-G987 PolarHBondContact O-N 2.97Å; H985-G987 VanDerWaalsContact O-N 3.15Å |
| 986 | P | 53.7 | Low | 49.9 | Very low | 119 Ų | 119 | 117.9 Ų | 117.9 | 77% | 0.773 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -57.3 | 122.1 | 167.2 | -22.3 | 33.7 | 0 | 0 | 0 | 108.3 | G984 | G984-P986 WeakPolarHBondContact O-CD 3.48Š|
| 987 | G | 44.5 | Very low | 50.6 | Low | 65 Ų | 65 | 115.5 Ų | 115.5 | 67% | 0.67 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -54.1 | 142.8 | 177.1 | 0 | 0 | 0 | 0 | 0 | 110.4 | H985 S989 | H985-G987 PolarHBondContact O-N 2.97Å; H985-G987 VanDerWaalsContact O-N 3.15Å; G987-S989 PolarHBondContact O-N 2.73Å |
| 988 | W | 39.8 | Very low | 50.9 | Low | 259 Ų | 259 | 115.7 Ų | 115.7 | 98% | 0.981 | 77% | 0.77 | S | S | * | * | trans | -56.7 | 108.2 | -177.4 | -76.5 | 0.9 | 0 | 0 | 0 | 110.7 | G990 | W988-G990 PolarHBondContact O-N 2.9Å; W988-G990 VanDerWaalsContact O-N 3.07Å | ||
| 989 | S | 49.9 | Very low | 51.2 | Low | 117 Ų | 117 | 115.3 Ų | 115.3 | 82% | 0.818 | 77% | 0.766 | S | S | * | * | trans | -54.1 | 114.8 | 163.9 | -56.3 | 0 | 0 | 0 | 0 | 107.8 | G987 | G987-S989 PolarHBondContact O-N 2.73Š| ||
| 990 | G | 52.1 | Low | 51.5 | Low | 58 Ų | 58 | 116.2 Ų | 116.2 | 60% | 0.598 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -52.8 | 145 | 173.1 | 0 | 0 | 0 | 0 | 0 | 110.2 | W988 | W988-G990 PolarHBondContact O-N 2.9Å; W988-G990 VanDerWaalsContact O-N 3.07Å |
| 991 | P | 47.7 | Very low | 51.1 | Low | 120 Ų | 120 | 117.8 Ų | 117.8 | 78% | 0.779 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -53.9 | 135.7 | -180 | 23.3 | -33.6 | 0 | 0 | 0 | 109.3 | G993 | P991-G993 PolarHBondContact O-N 3.38Å; P991-G993 VanDerWaalsContact O-N 3.14Å |
| 992 | P | 57.8 | Low | 51.1 | Low | 129 Ų | 129 | 117.9 Ų | 117.9 | 84% | 0.838 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -50.6 | 125.9 | 177 | -27.4 | 34.9 | 0 | 0 | 0 | 109.7 | ||
| 993 | G | 57.3 | Low | 50.9 | Low | 62 Ų | 62 | 121 Ų | 121 | 64% | 0.639 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -52.4 | 139.3 | 179.8 | 0 | 0 | 0 | 0 | 0 | 109.9 | P991 | P991-G993 PolarHBondContact O-N 3.38Å; P991-G993 VanDerWaalsContact O-N 3.14Å |
| 994 | P | 49.9 | Very low | 51 | Low | 119 Ų | 119 | 120 Ų | 120 | 77% | 0.773 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -53.4 | 137.3 | -175.9 | 22.5 | -33.5 | 0 | 0 | 0 | 109.4 | G996 | P994-G996 PolarHBondContact O-N 3.25Å; P994-G996 VanDerWaalsContact O-N 3.16Å |
| 995 | P | 61.5 | Low | 51.1 | Low | 127 Ų | 127 | 120.3 Ų | 120.3 | 83% | 0.825 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -48.9 | 127.9 | 177 | -28.1 | 35.1 | 0 | 0 | 0 | 109.8 | ||
| 996 | G | 59.4 | Low | 51.5 | Low | 60 Ų | 60 | 118.7 Ų | 118.7 | 62% | 0.619 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -53 | 141.4 | 177.7 | 0 | 0 | 0 | 0 | 0 | 109.6 | P994 | P994-G996 PolarHBondContact O-N 3.25Å; P994-G996 VanDerWaalsContact O-N 3.16Å |
| 997 | P | 55.3 | Low | 51.3 | Low | 123 Ų | 123 | 118.6 Ų | 118.6 | 80% | 0.799 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -52.9 | 138.9 | -179.3 | 23.5 | -34 | 0 | 0 | 0 | 109.1 | G999 | P997-G999 PolarHBondContact O-N 2.82Š|
| 998 | P | 61.6 | Low | 51.2 | Low | 128 Ų | 128 | 119.2 Ų | 119.2 | 83% | 0.831 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -47.4 | 131.7 | 176.5 | -28.8 | 35.3 | 0 | 0 | 0 | 110.1 | ||
| 999 | G | 56.3 | Low | 51.4 | Low | 60 Ų | 60 | 115.7 Ų | 115.7 | 62% | 0.619 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -54.1 | 138.8 | 174.3 | 0 | 0 | 0 | 0 | 0 | 108.9 | P997 D1001 | P997-G999 PolarHBondContact O-N 2.82Å; G999-D1001 PolarHBondContact O-N 2.84Å |
| 1000 | P | 51.7 | Low | 51.1 | Low | 129 Ų | 129 | 117.3 Ų | 117.3 | 84% | 0.838 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -54.2 | 132.6 | -177.1 | 23.9 | -34.3 | 0 | 0 | 0 | 109.4 | G1002 | P1000-G1002 PolarHBondContact O-N 2.73Å; P1000-G1002 VanDerWaalsContact O-N 3.09Å |
| 1001 | D | 52.3 | Low | 50.8 | Low | 160 Ų | 160 | 117.7 Ų | 117.7 | 86% | 0.856 | 77% | 0.774 | S | S | * | * | trans | -44.1 | 118.8 | -170.2 | -73.9 | -50.9 | 0 | 0 | 0 | 111.2 | G999 V1003 | G999-D1001 PolarHBondContact O-N 2.84Å; D1001-V1003 PolarHBondContact O-N 2.81Å | ||
| 1002 | G | 46.9 | Very low | 50.4 | Low | 73 Ų | 73 | 121.9 Ų | 121.9 | 75% | 0.753 | 78% | 0.776 | S | S | * | * | trans | -55.1 | 117.6 | -179.3 | 0 | 0 | 0 | 0 | 0 | 109 | P1000 R1004 | P1000-G1002 PolarHBondContact O-N 2.73Å; P1000-G1002 VanDerWaalsContact O-N 3.09Å; G1002-R1004 PolarHBondContact O-N 3.18Å | ||
| 1003 | V | 42.3 | Very low | 49.9 | Very low | 146 Ų | 146 | 121.6 Ų | 121.6 | 89% | 0.885 | 77% | 0.774 | S | S | * | * | trans | -49.3 | 116.4 | -168.9 | -174.9 | 0 | 0 | 0 | 0 | 109.2 | D1001 G1005 | D1001-V1003 PolarHBondContact O-N 2.81Å; V1003-G1005 PolarHBondContact O-N 3.47Å | ||
| 1004 | R | 48.9 | Very low | 49.2 | Very low | 221 Ų | 221 | 122.4 Ų | 122.4 | 83% | 0.834 | 78% | 0.782 | S | S | * | * | trans | -48.5 | 113.1 | -174.4 | 178.6 | -179.4 | -176.9 | 161.1 | 2 | 109.4 | G1002 D1006 | G1002-R1004 PolarHBondContact O-N 3.18Å; R1004-D1006 PolarHBondContact O-N 3.13Å | ||
| 1005 | G | 49 | Very low | 48.5 | Very low | 66 Ų | 66 | 123 Ų | 123 | 68% | 0.68 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -58.8 | 125.6 | 176.9 | 0 | 0 | 0 | 0 | 0 | 110.1 | V1003 | V1003-G1005 PolarHBondContact O-N 3.47Š|
| 1006 | D | 43 | Very low | 48.1 | Very low | 151 Ų | 151 | 123.1 Ų | 123.1 | 81% | 0.807 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -63.3 | 141.3 | 176.1 | -70.8 | -56.6 | 0 | 0 | 0 | 110.1 | R1004 G1008 | R1004-D1006 PolarHBondContact O-N 3.13Å; D1006-G1008 PolarHBondContact O-N 2.81Å |
| 1007 | P | 49.6 | Very low | 47.4 | Very low | 118 Ų | 118 | 123.8 Ų | 123.8 | 77% | 0.766 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -58.6 | 131.9 | -179.8 | -24.8 | 34.9 | 0 | 0 | 0 | 112.4 | ||
| 1008 | G | 43.6 | Very low | 47.5 | Very low | 78 Ų | 78 | 123.7 Ų | 123.7 | 80% | 0.804 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -70.4 | 137.7 | -176.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | D1006 | D1006-G1008 PolarHBondContact O-N 2.81Š|
| 1009 | E | 43.2 | Very low | 46.7 | Very low | 185 Ų | 185 | 124.1 Ų | 124.1 | 86% | 0.864 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -85.2 | 158.2 | 174.1 | -68.6 | -165 | 129.6 | 0 | 0 | 113.1 | ||
| 1010 | I | 43.7 | Very low | 45.9 | Very low | 151 Ų | 151 | 124.5 Ų | 124.5 | 77% | 0.774 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -83 | 126.5 | -169.9 | -61.1 | 163.4 | 0 | 0 | 0 | 110.6 | Y1012 | I1010-Y1012 HydrophobicContact CG2-CD2 4.29Å; I1010-Y1012 HydrophobicContact CG2-CE2 3.65Å |
| 1011 | G | 46.2 | Very low | 45.4 | Very low | 65 Ų | 65 | 123 Ų | 123 | 67% | 0.67 | 78% | 0.777 | S | S | * | * | trans | -111.6 | 145.3 | -174.8 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 1012 | Y | 38.8 | Very low | 44.7 | Very low | 209 Ų | 209 | 120 Ų | 120 | 82% | 0.82 | 77% | 0.769 | S | S | * | * | trans | -157.9 | 168.8 | 172.9 | -64.2 | -74.5 | 0 | 0 | 0 | 109.6 | I1010 | I1010-Y1012 HydrophobicContact CG2-CD2 4.29Å; I1010-Y1012 HydrophobicContact CG2-CE2 3.65Å | ||
| 1013 | P | 47.5 | Very low | 44.5 | Very low | 123 Ų | 123 | 119.3 Ų | 119.3 | 80% | 0.799 | 76% | 0.762 | S | S | * | * | -118.3 | 176.8 | -53 | 35.7 | -21.2 | 0 | 0 | 0 | 111.9 | |||||
| 1014 | G | 43 | Very low | 44.8 | Very low | 78 Ų | 78 | 114.9 Ų | 114.9 | 80% | 0.804 | 74% | 0.736 | S | S | * | * | P | Polyproline II helix | trans | -83.1 | 167.4 | -163.4 | 0 | 0 | 0 | 0 | 0 | 119.6 | ||
| 1015 | N | 35.4 | Very low | 44.4 | Very low | 131 Ų | 131 | 110.8 Ų | 110.8 | 70% | 0.701 | 73% | 0.729 | S | S | * | * | P | Polyproline II helix | trans | -93.5 | 145.8 | -173 | -63 | -42.7 | 0 | 0 | 0 | 115.1 | ||
| 1016 | P | 52.1 | Low | 43.9 | Very low | 131 Ų | 131 | 110.8 Ų | 110.8 | 85% | 0.851 | 73% | 0.73 | S | S | * | * | P | Polyproline II helix | trans | -73.6 | 162.8 | 159.6 | -16.7 | 32.5 | 0 | 0 | 0 | 114 | ||
| 1017 | G | 45.2 | Very low | 43.6 | Very low | 74 Ų | 74 | 111.4 Ų | 111.4 | 76% | 0.763 | 73% | 0.728 | S | S | * | * | trans | -110 | 177.8 | -167.8 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 1018 | P | 56.8 | Low | 43 | Very low | 120 Ų | 120 | 111.3 Ų | 111.3 | 78% | 0.779 | 73% | 0.725 | S | S | * | * | trans | -107.9 | 171.2 | -164.6 | 41.8 | -37 | 0 | 0 | 0 | 116.5 | ||||
| 1019 | P | 44.9 | Very low | 42.7 | Very low | 137 Ų | 137 | 111 Ų | 111 | 89% | 0.89 | 72% | 0.722 | S | S | * | * | -138 | -176.2 | 114.8 | 35.6 | -20.7 | 0 | 0 | 0 | 112.2 | |||||
| 1020 | G | 39.7 | Very low | 42.4 | Very low | 68 Ų | 68 | 109.2 Ų | 109.2 | 70% | 0.701 | 72% | 0.724 | S | S | * | * | cis | 178.9 | -177.3 | -0.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 1021 | D | 41.2 | Very low | 42.3 | Very low | 97 Ų | 97 | 112 Ų | 112 | 52% | 0.519 | 73% | 0.731 | S | S | . | * | trans | -99.8 | 163.4 | -169.7 | -47.7 | -82.5 | 0 | 0 | 0 | 114.3 | P751 | P751-D1021 HydrophobicContact CB-CB 3.95Å; P751-D1021 HydrophobicContact CG-CB 4.45Å | ||
| 1022 | S | 38.6 | Very low | 42.4 | Very low | 98 Ų | 98 | 112.1 Ų | 112.1 | 69% | 0.685 | 73% | 0.732 | S | S | * | * | 174.3 | 157.9 | 69.1 | -56.1 | 0 | 0 | 0 | 0 | 112.7 | P751 | P751-S1022 WeakPolarHBondContact CB-OG 3.39Š| |||
| 1023 | G | 42.3 | Very low | 42.4 | Very low | 59 Ų | 59 | 107.3 Ų | 107.3 | 61% | 0.608 | 73% | 0.726 | S | S | * | * | trans | 161.6 | 115.1 | 159.7 | 0 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 1024 | P | 47.6 | Very low | 42.5 | Very low | 53 Ų | 53 | 108.4 Ų | 108.4 | 34% | 0.344 | 72% | 0.719 | S | S | . | * | trans | -152.5 | 171.6 | -154.3 | 37.7 | -12.3 | 0 | 0 | 0 | 122.4 | R749 Q752 | R749-P1024 VanDerWaalsContact CZ-CG 3.47Å; R749-P1024 PolarHBondContact NH1-O 3.06Å; R749-P1024 VanDerWaalsContact NH2-CG 3.34Å; R749-P1024 PolarHBondContact NH2-O 3.5Å; Q752-P1024 HydrophobicContact CB-CB 4.38Å | ||
| 1025 | I | 41.5 | Very low | 42.2 | Very low | 134 Ų | 134 | 105.5 Ų | 105.5 | 69% | 0.687 | 69% | 0.689 | S | S | * | * | trans | 68.9 | 154.8 | 178.1 | -91.6 | 171.9 | 0 | 0 | 0 | 118.5 | R749 | R749-I1025 VanDerWaalsContact NH2-N 3.2Š| ||
| 1026 | G | 38 | Very low | 42.3 | Very low | 67 Ų | 67 | 105 Ų | 105 | 69% | 0.691 | 68% | 0.682 | S | S | * | * | cis | -164.8 | -157.6 | 2.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 1027 | E | 37.8 | Very low | 42 | Very low | 163 Ų | 163 | 106.6 Ų | 106.6 | 76% | 0.762 | 67% | 0.671 | S | S | * | * | cis | -164.1 | 170.8 | -2.5 | -142.3 | -167.4 | -120.3 | 0 | 0 | 111.8 | ||||
| 1028 | T | 36.7 | Very low | 41.7 | Very low | 117 Ų | 117 | 105.8 Ų | 105.8 | 72% | 0.718 | 66% | 0.663 | S | S | * | * | trans | 37 | 111 | 155 | -53.4 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 1029 | G | 36.8 | Very low | 40.7 | Very low | 72 Ų | 72 | 105.9 Ų | 105.9 | 74% | 0.742 | 65% | 0.653 | S | S | * | * | 129.1 | 176.6 | 89.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | |||||
| 1030 | T | 37.6 | Very low | 41 | Very low | 147 Ų | 147 | 102.9 Ų | 102.9 | 90% | 0.902 | 63% | 0.632 | S | S | * | * | cis | -141.5 | -112.3 | -7.7 | 62.6 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 1031 | K | 41.8 | Very low | 41.4 | Very low | 209 Ų | 209 | 101.9 Ų | 101.9 | 91% | 0.909 | 62% | 0.622 | S | S | * | * | trans | -166.2 | 145.6 | -167.5 | -179.5 | -178.2 | 179.2 | -178.5 | 0 | 116.9 | ||||
| 1032 | G | 47.5 | Very low | 41.3 | Very low | 68 Ų | 68 | 100.7 Ų | 100.7 | 70% | 0.701 | 62% | 0.619 | S | S | * | * | trans | 112.4 | 173.7 | 157.3 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 1033 | P | 37.7 | Very low | 42.1 | Very low | 108 Ų | 108 | 102 Ų | 102 | 70% | 0.701 | 63% | 0.625 | S | S | * | * | cis | -128.6 | -161.7 | 11.6 | 27.5 | -2.6 | 0 | 0 | 0 | 115.3 | M388 | M388-P1033 HydrophobicContact CG-CB 4.4Å; M388-P1033 HydrophobicContact CG-CG 4.19Å; M388-P1033 WeakPolarHBondContact CG-O 3.37Å; M388-P1033 HydrophobicContact SD-CB 4.38Å; M388-P1033 HydrophobicContact SD-CG 3.76Å | ||
| 1034 | K | 49.6 | Very low | 42.5 | Very low | 146 Ų | 146 | 102.3 Ų | 102.3 | 64% | 0.635 | 63% | 0.629 | S | S | * | * | trans | -145.8 | 115.5 | -171.9 | -121.7 | -161.2 | 133.1 | -140.5 | 0 | 113.4 | M388 G389 K390 | M388-K1034 VanDerWaalsContact CG-CA 3.42Å; M388-K1034 VanDerWaalsContact CG-N 3.33Å; G389-K1034 CarbonylContact C-O 3.57Å; G389-K1034 VanDerWaalsContact N-C 3.25Å; G389-K1034 VanDerWaalsContact N-CA 3.28Å; G389-K1034 CarbonylContact O-C 3.57Å; G389-K1034 WeakPolarHBondContact O-CB 3.39Å; G389-K1034 WeakPolarHBondContact O-CD 3.38Å; G389-K1034 WeakPolarHBondContact O-CE 3.44Å; G389-K1034 WeakPolarHBondContact O-CG 3.43Å; G389-K1034 PolarHBondContact O-NZ 2.73Å; G389-K1034 VanDerWaalsContact O-NZ 3.15Å; K390-K1034 VanDerWaalsContact CA-O 3.26Å; K390-K1034 WeakPolarHBondContact CA-O 3.48Å | ||
| 1035 | G | 37.6 | Very low | 42.3 | Very low | 17 Ų | 17 | 102.1 Ų | 102.1 | 18% | 0.175 | 63% | 0.628 | C | S | . | * | trans | 175.7 | 121.9 | 160.9 | 0 | 0 | 0 | 0 | 0 | 120.6 | M388 G389 K390 | M388-G1035 VanDerWaalsContact C-C 3.43Å; M388-G1035 VanDerWaalsContact C-CA 3.47Å; M388-G1035 WeakPolarHBondContact CB-O 3.39Å; M388-G1035 VanDerWaalsContact CG-N 3.31Å; M388-G1035 CarbonylContact O-C 2.9Å; M388-G1035 WeakPolarHBondContact O-CA 3.42Å; M388-G1035 PolarHBondContact O-N 2.71Å; G389-G1035 VanDerWaalsContact C-CA 3.44Å; G389-G1035 VanDerWaalsContact C-N 3.29Å; K390-G1035 VanDerWaalsContact N-CA 3.27Å | ||
| 1036 | Q | 36.8 | Very low | 43.1 | Very low | 121 Ų | 121 | 100.4 Ų | 100.4 | 57% | 0.565 | 63% | 0.625 | S | S | * | * | cis | -145.1 | -83.9 | 12.8 | -162.1 | 170.8 | -15.4 | 0 | 0 | 120.4 | M388 K390 | M388-Q1036 PolarHBondContact O-N 2.91Å; K390-Q1036 HydrophobicContact CD-CB 4.27Å; K390-Q1036 HydrophobicContact CD-CG 4.26Å; K390-Q1036 VanDerWaalsContact CD-OE1 3.31Å; K390-Q1036 HydrophobicContact CG-CB 4.06Å; K390-Q1036 HydrophobicContact CG-CG 4.19Å | ||
| 1037 | R | 46.7 | Very low | 44 | Very low | 163 Ų | 163 | 99 Ų | 99 | 62% | 0.615 | 61% | 0.611 | S | S | * | * | trans | -167.4 | 143.6 | -167 | -126.6 | 169.3 | 167.1 | -153.9 | 16.1 | 113.5 | S839 G840 | S839-R1037 VanDerWaalsContact CB-CD 3.5Å; S839-R1037 PolarHBondContact O-NH2 3.32Å; S839-R1037 PolarHBondContact OG-NH1 2.91Å; G840-R1037 PolarHBondContact O-NH2 3.18Å | ||
| 1038 | G | 38.1 | Very low | 44.4 | Very low | 57 Ų | 57 | 95.3 Ų | 95.3 | 59% | 0.588 | 60% | 0.601 | S | S | * | * | trans | 145.6 | 139.9 | 161.9 | 0 | 0 | 0 | 0 | 0 | 115.8 | S838 | S838-G1038 WeakPolarHBondContact OG-CA 3.17Š| ||
| 1039 | E | 37.3 | Very low | 45.3 | Very low | 122 Ų | 122 | 92.2 Ų | 92.2 | 57% | 0.57 | 58% | 0.584 | S | S | * | * | cis | -141.5 | 144.1 | 28.8 | -72.8 | -125.8 | 155.3 | 0 | 0 | 115.7 | R836 G837 | R836-E1039 WeakPolarHBondContact CB-OE2 3.3Å; R836-E1039 WeakPolarHBondContact CD-OE2 3.5Å; R836-E1039 HydrophobicContact CG-CB 4.17Å; R836-E1039 WeakPolarHBondContact CG-OE2 2.96Å; G837-E1039 PolarHBondContact N-OE2 3.03Å; G837-E1039 CarbonylContact O-C 3.41Å; G837-E1039 WeakPolarHBondContact O-CA 3.35Å; G837-E1039 WeakPolarHBondContact O-CB 3.35Å; G837-E1039 WeakPolarHBondContact O-CG 3.2Å | ||
| 1040 | T | 50.8 | Low | 46 | Very low | 74 Ų | 74 | 90.4 Ų | 90.4 | 45% | 0.454 | 57% | 0.566 | S | S | . | * | P | Polyproline II helix | trans | -77.7 | 133 | -178.8 | -73.6 | 0 | 0 | 0 | 0 | 113.3 | R836 G837 S838 | R836-T1040 CarbonylContact C-O 3.52Å; R836-T1040 WeakPolarHBondContact CA-O 3.5Å; R836-T1040 PolarHBondContact N-O 3.1Å; G837-T1040 PolarHBondContact N-O 3.48Å; G837-T1040 VanDerWaalsContact N-O 3.16Å; G837-T1040 PolarHBondContact O-N 3.42Å; G837-T1040 VanDerWaalsContact O-N 3.11Å; S838-T1040 VanDerWaalsContact CA-OG1 3.26Å; S838-T1040 WeakPolarHBondContact CA-OG1 3.26Å |
| 1041 | G | 47 | Very low | 46.6 | Very low | 48 Ų | 48 | 94.3 Ų | 94.3 | 50% | 0.495 | 56% | 0.564 | S | S | . | * | P | Polyproline II helix | trans | -88.4 | 172.8 | 171.3 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||
| 1042 | P | 40 | Very low | 47.5 | Very low | 71 Ų | 71 | 89.1 Ų | 89.1 | 46% | 0.461 | 55% | 0.546 | S | S | . | . | P | Polyproline II helix | trans | -74.1 | 168.4 | -175.4 | 34.7 | -36.9 | 0 | 0 | 0 | 112.1 | G834 G1044 | G834-P1042 WeakPolarHBondContact O-CB 3.47Å; G834-P1042 WeakPolarHBondContact O-CD 3.46Å; G834-P1042 WeakPolarHBondContact O-CG 3.36Å; P1042-G1044 PolarHBondContact O-N 2.99Å |
| 1043 | P | 54.6 | Low | 47.9 | Very low | 125 Ų | 125 | 88.9 Ų | 88.9 | 81% | 0.812 | 54% | 0.544 | S | S | * | . | P | Polyproline II helix | trans | -51.2 | 131.2 | 164.8 | -24.6 | 34.9 | 0 | 0 | 0 | 111 | ||
| 1044 | G | 51.4 | Low | 48.4 | Very low | 66 Ų | 66 | 89.2 Ų | 89.2 | 68% | 0.68 | 55% | 0.549 | S | S | * | . | P | Polyproline II helix | trans | -68 | 145.4 | 171 | 0 | 0 | 0 | 0 | 0 | 110.4 | P1042 | P1042-G1044 PolarHBondContact O-N 2.99Š|
| 1045 | P | 43.2 | Very low | 49.1 | Very low | 50 Ų | 50 | 87.9 Ų | 87.9 | 33% | 0.325 | 56% | 0.557 | S | S | . | * | P | Polyproline II helix | trans | -64.4 | 165.6 | 169.9 | 30.6 | -36.3 | 0 | 0 | 0 | 110.9 | I830 | I830-P1045 HydrophobicContact CB-CG 4.16Å; I830-P1045 HydrophobicContact CG1-CG 4.23Å; I830-P1045 HydrophobicContact CG2-CG 4.01Å |
| 1046 | P | 58.5 | Low | 50.3 | Low | 97 Ų | 97 | 89.8 Ų | 89.8 | 63% | 0.63 | 58% | 0.578 | S | S | * | * | P | Polyproline II helix | trans | -50.2 | 147.9 | -178.7 | -29.7 | 36.6 | 0 | 0 | 0 | 114.5 | ||
| 1047 | G | 57 | Low | 51.3 | Low | 37 Ų | 37 | 89.8 Ų | 89.8 | 38% | 0.381 | 59% | 0.588 | S | S | . | * | P | Polyproline II helix | trans | -60.5 | 154.2 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | D827 | D827-G1047 WeakPolarHBondContact CB-O 3.41Š|
| 1048 | P | 45.6 | Very low | 52.3 | Low | 87 Ų | 87 | 88 Ų | 88 | 57% | 0.565 | 60% | 0.597 | S | S | * | * | P | Polyproline II helix | trans | -94.5 | 123.3 | 171.6 | 34.1 | -29.1 | 0 | 0 | 0 | 111.1 | P829 G1050 | P829-P1048 HydrophobicContact CB-CB 4.29Å; P1048-G1050 PolarHBondContact O-N 3.38Å |
| 1049 | S | 55.2 | Low | 53.4 | Low | 51 Ų | 51 | 88.2 Ų | 88.2 | 36% | 0.357 | 60% | 0.599 | S | S | . | * | trans | 12.3 | 96.9 | 177.2 | -72.4 | 0 | 0 | 0 | 0 | 116.1 | D827 R1051 | D827-S1049 VanDerWaalsContact CG-CA 3.48Å; D827-S1049 VanDerWaalsContact CG-N 3.31Å; D827-S1049 WeakPolarHBondContact O-CA 3.26Å; D827-S1049 WeakPolarHBondContact O-CB 3.41Å; D827-S1049 PolarHBondContact O-N 3.31Å; D827-S1049 PolarHBondContact O-OG 3.04Å; D827-S1049 WeakPolarHBondContact OD1-CA 3.41Å; D827-S1049 PolarHBondContact OD2-N 3.17Å; D827-S1049 VanDerWaalsContact OD2-N 3.1Å; S1049-R1051 PolarHBondContact O-N 2.62Å | ||
| 1050 | G | 52.2 | Low | 54.5 | Low | 35 Ų | 35 | 88.4 Ų | 88.4 | 36% | 0.361 | 61% | 0.612 | S | S | . | * | trans | -40.8 | 107.8 | 163.1 | 0 | 0 | 0 | 0 | 0 | 109.8 | D827 P1048 D1052 | D827-G1050 PolarHBondContact OD1-N 3.42Å; P1048-G1050 PolarHBondContact O-N 3.38Å; G1050-D1052 PolarHBondContact O-N 2.96Å | ||
| 1051 | R | 50.5 | Low | 54.9 | Low | 228 Ų | 228 | 93.1 Ų | 93.1 | 86% | 0.86 | 63% | 0.63 | S | S | * | * | trans | -61.5 | 138.6 | -175.4 | -78.3 | 179.6 | 163.4 | -172.1 | -6.2 | 108.9 | S1049 G1053 | S1049-R1051 PolarHBondContact O-N 2.62Å; R1051-G1053 PolarHBondContact O-N 3.49Å; R1051-G1053 VanDerWaalsContact O-N 3.08Å | ||
| 1052 | D | 61.3 | Low | 55.3 | Low | 101 Ų | 101 | 93.1 Ų | 93.1 | 54% | 0.54 | 63% | 0.63 | S | S | . | * | trans | -44 | 121.2 | 171.6 | -48.7 | -59.9 | 0 | 0 | 0 | 108.4 | R826 G1050 S1054 | R826-D1052 VanDerWaalsContact CZ-CG 3.47Å; R826-D1052 IonicContact CZ-OD1 3.19Å; R826-D1052 IonicContact CZ-OD2 3.05Å; R826-D1052 IonicContact NE-OD1 3.75Å; R826-D1052 IonicContact NH1-OD1 2.77Å; R826-D1052 PolarHBondContact NH1-OD1 2.88Å; R826-D1052 IonicContact NH1-OD2 2.77Å; R826-D1052 PolarHBondContact NH1-OD2 2.7Å; R826-D1052 IonicContact NH2-OD1 3.65Å; R826-D1052 IonicContact NH2-OD2 2.74Å; R826-D1052 PolarHBondContact NH2-OD2 2.93Å; G1050-D1052 PolarHBondContact O-N 2.96Å; D1052-S1054 PolarHBondContact O-N 2.87Å | ||
| 1053 | G | 54.1 | Low | 56.5 | Low | 63 Ų | 63 | 95.4 Ų | 95.4 | 65% | 0.649 | 65% | 0.645 | S | S | * | * | trans | -52.7 | 128 | -176.2 | 0 | 0 | 0 | 0 | 0 | 108.9 | R1051 S1055 | R1051-G1053 PolarHBondContact O-N 3.49Å; R1051-G1053 VanDerWaalsContact O-N 3.08Å; G1053-S1055 PolarHBondContact O-N 3.02Å | ||
| 1054 | S | 49.8 | Very low | 56.9 | Low | 115 Ų | 115 | 94.9 Ų | 94.9 | 80% | 0.804 | 64% | 0.642 | S | S | * | * | trans | -52.5 | 119.2 | -179.2 | 54.8 | 0 | 0 | 0 | 0 | 108.6 | D1052 G1056 | D1052-S1054 PolarHBondContact O-N 2.87Å; S1054-G1056 PolarHBondContact O-N 3.21Å; S1054-G1056 VanDerWaalsContact O-N 3.15Å | ||
| 1055 | S | 64.2 | Low | 56.9 | Low | 117 Ų | 117 | 94.6 Ų | 94.6 | 82% | 0.818 | 64% | 0.639 | S | S | * | * | trans | -36.6 | 122.9 | -178.9 | -55.8 | 0 | 0 | 0 | 0 | 109.7 | G1053 | G1053-S1055 PolarHBondContact O-N 3.02Š| ||
| 1056 | G | 62.7 | Low | 57.6 | Low | 58 Ų | 58 | 97.8 Ų | 97.8 | 60% | 0.598 | 66% | 0.66 | S | S | * | * | P | Polyproline II helix | trans | -48.6 | 143.6 | -177.5 | 0 | 0 | 0 | 0 | 0 | 109.8 | S1054 P1058 | S1054-G1056 PolarHBondContact O-N 3.21Å; S1054-G1056 VanDerWaalsContact O-N 3.15Å; G1056-P1058 VanDerWaalsContact O-N 3.16Å |
| 1057 | P | 57.7 | Low | 57.7 | Low | 120 Ų | 120 | 99 Ų | 99 | 78% | 0.779 | 67% | 0.668 | S | S | * | * | P | Polyproline II helix | trans | -50.2 | 131 | 176 | 24.1 | -33.4 | 0 | 0 | 0 | 107.6 | G1059 | P1057-G1059 PolarHBondContact O-N 3.3Å; P1057-G1059 VanDerWaalsContact O-N 3.11Å |
| 1058 | P | 67 | Low | 57.1 | Low | 126 Ų | 126 | 100.1 Ų | 100.1 | 82% | 0.818 | 68% | 0.679 | S | S | * | * | P | Polyproline II helix | trans | -47.1 | 127.6 | 178 | -29.1 | 35.2 | 0 | 0 | 0 | 108.5 | G1056 | G1056-P1058 VanDerWaalsContact O-N 3.16Š|
| 1059 | G | 60.8 | Low | 57.3 | Low | 61 Ų | 61 | 101.6 Ų | 101.6 | 63% | 0.629 | 69% | 0.688 | S | S | * | * | P | Polyproline II helix | trans | -47.9 | 138.2 | -176.5 | 0 | 0 | 0 | 0 | 0 | 109.2 | P1057 M1061 | P1057-G1059 PolarHBondContact O-N 3.3Å; P1057-G1059 VanDerWaalsContact O-N 3.11Å; G1059-M1061 PolarHBondContact O-N 2.75Å |
| 1060 | P | 61.5 | Low | 57 | Low | 127 Ų | 127 | 104.8 Ų | 104.8 | 83% | 0.825 | 71% | 0.708 | S | S | * | * | P | Polyproline II helix | trans | -49.1 | 121.4 | -171.9 | 21.4 | -33.4 | 0 | 0 | 0 | 108.2 | G1062 | P1060-G1062 PolarHBondContact O-N 2.79Š|
| 1061 | M | 57.8 | Low | 56.3 | Low | 172 Ų | 172 | 106.5 Ų | 106.5 | 85% | 0.847 | 73% | 0.726 | S | S | * | * | P | Polyproline II helix | trans | -48 | 119.4 | -176.9 | -179.9 | 177.5 | 73 | 0 | 0 | 107 | G1059 | G1059-M1061 PolarHBondContact O-N 2.75Š|
| 1062 | G | 56.8 | Low | 55.7 | Low | 48 Ų | 48 | 101.4 Ų | 101.4 | 50% | 0.495 | 71% | 0.713 | S | S | . | * | P | Polyproline II helix | trans | -49.8 | 144.5 | -171.4 | 0 | 0 | 0 | 0 | 0 | 109.9 | P1060 P1064 | P1060-G1062 PolarHBondContact O-N 2.79Å; G1062-P1064 VanDerWaalsContact O-N 3.14Å |
| 1063 | P | 64.7 | Low | 54.4 | Low | 120 Ų | 120 | 101.3 Ų | 101.3 | 78% | 0.779 | 72% | 0.718 | S | S | * | * | P | Polyproline II helix | trans | -47.5 | 129.2 | -179.5 | 22 | -33.5 | 0 | 0 | 0 | 107.8 | G1065 | P1063-G1065 PolarHBondContact O-N 2.83Š|
| 1064 | P | 63.2 | Low | 53.4 | Low | 114 Ų | 114 | 103.5 Ų | 103.5 | 74% | 0.74 | 72% | 0.724 | S | S | * | * | P | Polyproline II helix | trans | -46.5 | 121.5 | -174.9 | -30.4 | 35.1 | 0 | 0 | 0 | 108.9 | G1062 | G1062-P1064 VanDerWaalsContact O-N 3.14Š|
| 1065 | G | 50.1 | Low | 52.6 | Low | 60 Ų | 60 | 102.4 Ų | 102.4 | 62% | 0.619 | 71% | 0.712 | S | S | * | * | P | Polyproline II helix | trans | -48.6 | 135.7 | -172 | 0 | 0 | 0 | 0 | 0 | 109.1 | P1063 | P1063-G1065 PolarHBondContact O-N 2.83Š|
| 1066 | P | 59.3 | Low | 50.9 | Low | 117 Ų | 117 | 105.5 Ų | 105.5 | 76% | 0.76 | 71% | 0.713 | S | S | * | * | P | Polyproline II helix | trans | -48.5 | 130.5 | -172.3 | 20.7 | -33.3 | 0 | 0 | 0 | 108.4 | G1068 | P1066-G1068 PolarHBondContact O-N 2.98Š|
| 1067 | P | 60.9 | Low | 49.2 | Very low | 123 Ų | 123 | 109.1 Ų | 109.1 | 80% | 0.799 | 72% | 0.718 | S | S | * | * | trans | -45.7 | 119.7 | -171.2 | -31.2 | 35 | 0 | 0 | 0 | 109.8 | ||||
| 1068 | G | 44.5 | Very low | 47.9 | Very low | 59 Ų | 59 | 108.2 Ų | 108.2 | 61% | 0.608 | 71% | 0.712 | S | S | * | * | trans | -48.2 | 130.5 | -169.3 | 0 | 0 | 0 | 0 | 0 | 109.4 | P1066 | P1066-G1068 PolarHBondContact O-N 2.98Š| ||
| 1069 | P | 48.8 | Very low | 46.2 | Very low | 118 Ų | 118 | 108.7 Ų | 108.7 | 77% | 0.766 | 71% | 0.713 | S | S | * | * | S | Bend | trans | -48.8 | 126.3 | -165.4 | 18.9 | -32.8 | 0 | 0 | 0 | 108.9 | G1071 | P1069-G1071 WeakPolarHBondContact O-CA 3.42Å; P1069-G1071 PolarHBondContact O-N 2.82Å |
| 1070 | P | 49.8 | Very low | 44.9 | Very low | 118 Ų | 118 | 112.9 Ų | 112.9 | 77% | 0.766 | 72% | 0.719 | S | S | * | * | trans | -42.7 | 110.4 | -160.4 | -34.4 | 35.2 | 0 | 0 | 0 | 111.4 | M1072 | P1070-M1072 WeakPolarHBondContact O-CA 3.43Å; P1070-M1072 PolarHBondContact O-N 2.77Å | ||
| 1071 | G | 35.9 | Very low | 43.4 | Very low | 72 Ų | 72 | 111.8 Ų | 111.8 | 74% | 0.742 | 72% | 0.715 | S | S | * | * | trans | -48.5 | 112.4 | -162.5 | 0 | 0 | 0 | 0 | 0 | 109.8 | P1069 P1073 | P1069-G1071 WeakPolarHBondContact O-CA 3.42Å; P1069-G1071 PolarHBondContact O-N 2.82Å; G1071-P1073 VanDerWaalsContact O-N 3.12Å | ||
| 1072 | M | 38 | Very low | 42.1 | Very low | 120 Ų | 120 | 114.9 Ų | 114.9 | 59% | 0.591 | 72% | 0.717 | S | S | * | * | trans | -31.9 | 112.5 | -158.6 | -83.7 | -74.3 | -169.9 | 0 | 0 | 110.7 | P1070 S1074 Y1205 | P1070-M1072 WeakPolarHBondContact O-CA 3.43Å; P1070-M1072 PolarHBondContact O-N 2.77Å; M1072-S1074 PolarHBondContact O-N 3.33Å; M1072-Y1205 HydrophobicContact CB-CE2 4.3Å; M1072-Y1205 HydrophobicContact CE-CD2 3.96Å; M1072-Y1205 HydrophobicContact CE-CE1 4.24Å; M1072-Y1205 HydrophobicContact CE-CE2 3.49Å; M1072-Y1205 VanDerWaalsContact CE-CE2 3.49Å; M1072-Y1205 HydrophobicContact CG-CD2 4.28Å; M1072-Y1205 HydrophobicContact CG-CE2 3.66Å; M1072-Y1205 HydrophobicContact SD-CD2 4.43Å; M1072-Y1205 HydrophobicContact SD-CE2 3.51Å; M1072-Y1205 VanDerWaalsContact SD-CE2 3.51Å | ||
| 1073 | P | 34.1 | Very low | 40.8 | Very low | 99 Ų | 99 | 119.9 Ų | 119.9 | 64% | 0.643 | 73% | 0.732 | S | S | * | * | trans | -53.2 | 119.3 | -172.8 | 21.4 | -32.5 | 0 | 0 | 0 | 107.1 | G1071 V1075 | G1071-P1073 VanDerWaalsContact O-N 3.12Å; P1073-V1075 PolarHBondContact O-N 3.37Å | ||
| 1074 | S | 34 | Very low | 39.3 | Very low | 110 Ų | 110 | 121 Ų | 121 | 77% | 0.769 | 74% | 0.737 | S | S | * | * | trans | -52.6 | 115.6 | -171.5 | 39.2 | 0 | 0 | 0 | 0 | 107.2 | M1072 Q1076 | M1072-S1074 PolarHBondContact O-N 3.33Å; S1074-Q1076 PolarHBondContact O-N 3.33Å | ||
| 1075 | V | 33.1 | Very low | 37.8 | Very low | 92 Ų | 92 | 125.3 Ų | 125.3 | 56% | 0.558 | 75% | 0.745 | S | S | * | * | trans | -69.7 | 87.6 | -163.4 | -178.9 | 0 | 0 | 0 | 0 | 108.3 | P1073 L1077 | P1073-V1075 PolarHBondContact O-N 3.37Å; V1075-L1077 HydrophobicContact CG1-CG 4.49Å; V1075-L1077 PolarHBondContact O-N 3.1Å | ||
| 1076 | Q | 28.5 | Very low | 36.9 | Very low | 182 Ų | 182 | 126.7 Ų | 126.7 | 85% | 0.85 | 75% | 0.75 | S | S | * | * | trans | -52.3 | 99.1 | 145.1 | -67.3 | -176.4 | -5 | 0 | 0 | 103.9 | S1074 P1078 | S1074-Q1076 PolarHBondContact O-N 3.33Å; Q1076-P1078 VanDerWaalsContact O-N 3.15Å | ||
| 1077 | L | 27.2 | Very low | 35.6 | Very low | 134 Ų | 134 | 123.1 Ų | 123.1 | 70% | 0.702 | 74% | 0.735 | S | S | * | * | trans | -52.8 | 128.2 | 176.3 | -71 | 87.7 | 0 | 0 | 0 | 105.7 | V1075 T1079 | V1075-L1077 HydrophobicContact CG1-CG 4.49Å; V1075-L1077 PolarHBondContact O-N 3.1Å; L1077-T1079 PolarHBondContact O-N 2.99Å | ||
| 1078 | P | 30.3 | Very low | 34.4 | Very low | 100 Ų | 100 | 122 Ų | 122 | 65% | 0.649 | 72% | 0.721 | S | S | * | * | trans | -53.5 | 118.2 | 163.5 | 24.4 | -31.5 | 0 | 0 | 0 | 104.7 | Q1076 I1080 | Q1076-P1078 VanDerWaalsContact O-N 3.15Å; P1078-I1080 PolarHBondContact O-N 2.85Å | ||
| 1079 | T | 30.6 | Very low | 34 | Very low | 137 Ų | 137 | 125.4 Ų | 125.4 | 84% | 0.84 | 73% | 0.725 | S | S | * | * | trans | -72.1 | 85.8 | -178.9 | -61.6 | 0 | 0 | 0 | 0 | 105.8 | L1077 S1081 | L1077-T1079 PolarHBondContact O-N 2.99Å; T1079-S1081 VanDerWaalsContact C-N 3.3Å; T1079-S1081 PolarHBondContact O-N 3.32Å | ||
| 1080 | I | 33.8 | Very low | 33.3 | Very low | 148 Ų | 148 | 124.8 Ų | 124.8 | 76% | 0.759 | 71% | 0.708 | S | S | * | * | trans | -61.8 | 99.8 | 179.3 | -66.3 | 176.7 | 0 | 0 | 0 | 105.6 | P1078 R1082 | P1078-I1080 PolarHBondContact O-N 2.85Å; I1080-R1082 PolarHBondContact O-N 3.29Å | ||
| 1081 | S | 30.6 | Very low | 32.6 | Very low | 104 Ų | 104 | 119.5 Ų | 119.5 | 73% | 0.727 | 67% | 0.674 | S | S | * | * | trans | -58.3 | 131.2 | -178.7 | -171.5 | 0 | 0 | 0 | 0 | 108.2 | T1079 N1083 | T1079-S1081 VanDerWaalsContact C-N 3.3Å; T1079-S1081 PolarHBondContact O-N 3.32Å; S1081-N1083 VanDerWaalsContact C-N 3.26Å; S1081-N1083 PolarHBondContact O-N 2.58Å | ||
| 1082 | R | 29.9 | Very low | 32.7 | Very low | 238 Ų | 238 | 121.5 Ų | 121.5 | 90% | 0.898 | 67% | 0.668 | S | S | * | * | S | Bend | trans | -72.6 | 79.4 | -179 | -67.2 | -179.9 | 179.8 | 172.1 | 0.4 | 110.1 | I1080 | I1080-R1082 PolarHBondContact O-N 3.29Š|
| 1083 | N | 28.9 | Very low | 33.2 | Very low | 152 Ų | 152 | 119.6 Ų | 119.6 | 81% | 0.813 | 66% | 0.66 | S | S | * | * | trans | -174 | 103.1 | 154.5 | -97.5 | -22.7 | 0 | 0 | 0 | 113.5 | S1081 | S1081-N1083 VanDerWaalsContact C-N 3.26Å; S1081-N1083 PolarHBondContact O-N 2.58Å | ||
| 1084 | T | 34.2 | Very low | 33.9 | Very low | 144 Ų | 144 | 116.9 Ų | 116.9 | 88% | 0.883 | 64% | 0.642 | S | S | * | * | trans | -159.5 | 156.8 | 135.5 | 17.3 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 1085 | K | 31.1 | Very low | 34.7 | Very low | 205 Ų | 205 | 117.2 Ų | 117.2 | 89% | 0.891 | 64% | 0.635 | S | S | * | * | trans | -131.9 | 150.3 | 170.5 | -74 | 179.2 | 175.6 | 177.7 | 0 | 107.7 | ||||
| 1086 | A | 31.5 | Very low | 35.2 | Very low | 89 Ų | 89 | 114.5 Ų | 114.5 | 74% | 0.736 | 62% | 0.622 | S | S | * | * | trans | 67.9 | 151.5 | -171.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 1087 | G | 30.9 | Very low | 36.3 | Very low | 42 Ų | 42 | 106 Ų | 106 | 43% | 0.433 | 58% | 0.583 | S | S | . | * | cis | 115.1 | 115.5 | 8.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | E1104 | G1087-E1104 WeakPolarHBondContact CA-OE2 3.44Å; G1087-E1104 VanDerWaalsContact N-CD 3.29Å; G1087-E1104 PolarHBondContact N-OE1 3.21Å; G1087-E1104 PolarHBondContact N-OE2 2.95Å | ||
| 1088 | N | 36.3 | Very low | 37.4 | Very low | 98 Ų | 98 | 108.1 Ų | 108.1 | 52% | 0.524 | 58% | 0.581 | S | S | . | * | cis | -155.3 | -166.5 | 0.9 | -104 | 92.2 | 0 | 0 | 0 | 107.8 | E1104 | N1088-E1104 WeakPolarHBondContact CA-OE2 3.33Š| ||
| 1089 | I | 37.2 | Very low | 38.4 | Very low | 132 Ų | 132 | 109.4 Ų | 109.4 | 68% | 0.677 | 58% | 0.582 | S | S | * | * | S | Bend | 170.5 | -30.3 | 124.4 | -87.4 | 157.2 | 0 | 0 | 0 | 116.2 | T1102 | I1089-T1102 WeakPolarHBondContact CA-OG1 3.44Å; I1089-T1102 WeakPolarHBondContact CB-OG1 3.17Å; I1089-T1102 PolarHBondContact N-OG1 3.4Å | |
| 1090 | Y | 32.9 | Very low | 39 | Very low | 105 Ų | 105 | 107.7 Ų | 107.7 | 41% | 0.412 | 57% | 0.565 | S | S | . | * | S | Bend | trans | -119.8 | 43.8 | 178.5 | -64.5 | -64.7 | 0 | 0 | 0 | 110.5 | D1092 G1097 M1100 T1102 Y1103 | Y1090-D1092 PolarHBondContact O-N 3.43Å; Y1090-G1097 VanDerWaalsContact O-CA 3.28Å; Y1090-G1097 WeakPolarHBondContact O-CA 3.09Å; Y1090-M1100 HydrophobicContact CD1-CB 4.11Å; Y1090-M1100 HydrophobicContact CD2-CB 3.35Å; Y1090-M1100 WeakPolarHBondContact CD2-O 3.37Å; Y1090-M1100 HydrophobicContact CE1-CB 4.2Å; Y1090-M1100 HydrophobicContact CE1-CE 4.12Å; Y1090-M1100 HydrophobicContact CE2-CB 3.48Å; Y1090-M1100 VanDerWaalsContact CE2-CB 3.48Å; Y1090-M1100 HydrophobicContact CE2-CE 4.25Å; Y1090-M1100 HydrophobicContact CE2-CG 4.49Å; Y1090-M1100 WeakPolarHBondContact CE2-O 3.49Å; Y1090-M1100 HydrophobicContact CG-CB 3.72Å; Y1090-M1100 WeakPolarHBondContact OH-CE 3.41Å; Y1090-T1102 CarbonylContact C-O 3.25Å; Y1090-T1102 WeakPolarHBondContact CA-O 3.39Å; Y1090-T1102 WeakPolarHBondContact CB-OG1 3.32Å; Y1090-T1102 WeakPolarHBondContact CD2-OG1 3.37Å; Y1090-T1102 PolarHBondContact N-O 3.08Å; Y1090-T1102 PolarHBondContact N-OG1 2.93Å; Y1090-Y1103 WeakPolarHBondContact O-CA 3.5Å; Y1090-Y1103 PolarHBondContact O-N 3.05Å |
| 1091 | A | 34.8 | Very low | 39.2 | Very low | 6 Ų | 6 | 103.6 Ų | 103.6 | 5% | 0.05 | 56% | 0.559 | C | S | . | * | T | Hydrogen-bonded Turn | trans | -74.2 | -20.4 | -155.3 | 0 | 0 | 0 | 0 | 0 | 116.8 | T1102 Y1103 E1104 | A1091-T1102 PolarHBondContact N-O 3.1Å; A1091-Y1103 WeakPolarHBondContact O-CD2 3.21Å; A1091-Y1103 WeakPolarHBondContact O-CE2 3.33Å; A1091-E1104 WeakPolarHBondContact CB-O 3.41Å |
| 1092 | D | 39.1 | Very low | 39.5 | Very low | 115 Ų | 115 | 101 Ų | 101 | 62% | 0.615 | 54% | 0.539 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -126.5 | 10.1 | -160.2 | -56.7 | -68.7 | 0 | 0 | 0 | 114.6 | Y1090 S1106 | Y1090-D1092 PolarHBondContact O-N 3.43Å; D1092-S1106 VanDerWaalsContact OD1-CB 3.25Å; D1092-S1106 WeakPolarHBondContact OD1-CB 3.36Å; D1092-S1106 PolarHBondContact OD1-OG 3.37Å |
| 1093 | D | 47.4 | Very low | 40 | Very low | 79 Ų | 79 | 93.9 Ų | 93.9 | 42% | 0.422 | 51% | 0.513 | S | S | . | . | trans | -113.5 | 112.3 | 165.2 | -178.1 | -33.2 | 0 | 0 | 0 | 109.1 | L1095 A1096 G1097 Y1103 | D1093-L1095 PolarHBondContact O-N 2.97Å; D1093-L1095 VanDerWaalsContact O-N 3.12Å; D1093-L1095 WeakPolarHBondContact OD1-CA 3.02Å; D1093-L1095 PolarHBondContact OD1-N 3.41Å; D1093-A1096 HydrophobicContact CB-CB 3.89Å; D1093-A1096 VanDerWaalsContact CG-N 3.34Å; D1093-A1096 PolarHBondContact OD1-N 3.12Å; D1093-A1096 WeakPolarHBondContact OD2-CB 3.35Å; D1093-G1097 VanDerWaalsContact O-CA 3.31Å; D1093-G1097 WeakPolarHBondContact O-CA 2.98Å; D1093-G1097 PolarHBondContact O-N 3.33Å; D1093-Y1103 VanDerWaalsContact C-CE2 3.43Å; D1093-Y1103 WeakPolarHBondContact O-CD2 3.36Å; D1093-Y1103 WeakPolarHBondContact O-CE2 3.08Å | ||
| 1094 | P | 49.8 | Very low | 40.8 | Very low | 43 Ų | 43 | 90.3 Ų | 90.3 | 28% | 0.279 | 49% | 0.491 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60.1 | -22.9 | -177.1 | -24.6 | 33.8 | 0 | 0 | 0 | 114.9 | R1098 Y1103 | P1094-R1098 VanDerWaalsContact O-CD 3.3Å; P1094-R1098 WeakPolarHBondContact O-CD 3.49Å; P1094-R1098 VanDerWaalsContact O-CG 3.3Å; P1094-R1098 WeakPolarHBondContact O-CG 3.22Å; P1094-Y1103 HydrophobicContact CB-CE2 4.37Å; P1094-Y1103 HydrophobicContact CG-CE2 4.24Å |
| 1095 | L | 49.8 | Very low | 41.5 | Very low | 117 Ų | 117 | 86.6 Ų | 86.6 | 61% | 0.613 | 47% | 0.469 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -102.7 | -52 | -178.4 | -164.4 | 70.2 | 0 | 0 | 0 | 111.1 | D1093 G1097 R1098 I1099 | D1093-L1095 PolarHBondContact O-N 2.97Å; D1093-L1095 VanDerWaalsContact O-N 3.12Å; D1093-L1095 WeakPolarHBondContact OD1-CA 3.02Å; D1093-L1095 PolarHBondContact OD1-N 3.41Å; L1095-G1097 VanDerWaalsContact C-N 3.32Å; L1095-G1097 PolarHBondContact O-N 3.02Å; L1095-R1098 WeakPolarHBondContact O-CB 3.38Å; L1095-R1098 PolarHBondContact O-N 3.27Å; L1095-R1098 VanDerWaalsContact O-N 3.17Å; L1095-I1099 HydrophobicContact CG-CD1 4.06Å; L1095-I1099 WeakPolarHBondContact O-CD1 3.32Å; L1095-I1099 VanDerWaalsContact O-CG1 3.26Å; L1095-I1099 WeakPolarHBondContact O-CG1 3.07Å; L1095-I1099 PolarHBondContact O-N 2.69Å |
| 1096 | A | 45.4 | Very low | 42.8 | Very low | 35 Ų | 35 | 79.7 Ų | 79.7 | 29% | 0.289 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -67.1 | -33.3 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | D1093 R1098 I1099 M1100 | D1093-A1096 HydrophobicContact CB-CB 3.89Å; D1093-A1096 VanDerWaalsContact CG-N 3.34Å; D1093-A1096 PolarHBondContact OD1-N 3.12Å; D1093-A1096 WeakPolarHBondContact OD2-CB 3.35Å; A1096-R1098 VanDerWaalsContact C-N 3.34Å; A1096-I1099 PolarHBondContact O-N 3.02Å; A1096-M1100 WeakPolarHBondContact O-CB 3.18Å; A1096-M1100 WeakPolarHBondContact O-CG 3.38Å; A1096-M1100 PolarHBondContact O-N 3.2Å |
| 1097 | G | 50 | Low | 44.9 | Very low | 2 Ų | 2 | 83.3 Ų | 83.3 | 2% | 0.021 | 44% | 0.442 | C | S | . | . | H | α-helix | trans | -68.9 | -29.9 | 172.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | Y1090 D1093 L1095 G1101 T1102 Y1103 | Y1090-G1097 VanDerWaalsContact O-CA 3.28Å; Y1090-G1097 WeakPolarHBondContact O-CA 3.09Å; D1093-G1097 VanDerWaalsContact O-CA 3.31Å; D1093-G1097 WeakPolarHBondContact O-CA 2.98Å; D1093-G1097 PolarHBondContact O-N 3.33Å; L1095-G1097 VanDerWaalsContact C-N 3.32Å; L1095-G1097 PolarHBondContact O-N 3.02Å; G1097-G1101 PolarHBondContact O-N 3.05Å; G1097-T1102 PolarHBondContact O-N 3.33Å; G1097-Y1103 PolarHBondContact O-N 2.97Å |
| 1098 | R | 50.2 | Low | 47.6 | Very low | 179 Ų | 179 | 81.9 Ų | 81.9 | 68% | 0.675 | 42% | 0.424 | S | S | * | . | H | α-helix | trans | -70.6 | -36.9 | 168.5 | -88.1 | -179.8 | 169.6 | 150.7 | -4.5 | 112.2 | P1094 L1095 A1096 | P1094-R1098 VanDerWaalsContact O-CD 3.3Å; P1094-R1098 WeakPolarHBondContact O-CD 3.49Å; P1094-R1098 VanDerWaalsContact O-CG 3.3Å; P1094-R1098 WeakPolarHBondContact O-CG 3.22Å; L1095-R1098 WeakPolarHBondContact O-CB 3.38Å; L1095-R1098 PolarHBondContact O-N 3.27Å; L1095-R1098 VanDerWaalsContact O-N 3.17Å; A1096-R1098 VanDerWaalsContact C-N 3.34Å |
| 1099 | I | 52.3 | Low | 50.1 | Low | 128 Ų | 128 | 85.7 Ų | 85.7 | 66% | 0.656 | 43% | 0.431 | S | S | * | . | H | α-helix | trans | -76 | -40.4 | -179.8 | -69.9 | 163.7 | 0 | 0 | 0 | 111.8 | L1095 A1096 | L1095-I1099 HydrophobicContact CG-CD1 4.06Å; L1095-I1099 WeakPolarHBondContact O-CD1 3.32Å; L1095-I1099 VanDerWaalsContact O-CG1 3.26Å; L1095-I1099 WeakPolarHBondContact O-CG1 3.07Å; L1095-I1099 PolarHBondContact O-N 2.69Å; A1096-I1099 PolarHBondContact O-N 3.02Å |
| 1100 | M | 43.5 | Very low | 52.7 | Low | 101 Ų | 101 | 79.6 Ų | 79.6 | 50% | 0.498 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -97.9 | -7.3 | -172.5 | -56.2 | -71.3 | -71.5 | 0 | 0 | 113.3 | Y1090 A1096 | Y1090-M1100 HydrophobicContact CD1-CB 4.11Å; Y1090-M1100 HydrophobicContact CD2-CB 3.35Å; Y1090-M1100 WeakPolarHBondContact CD2-O 3.37Å; Y1090-M1100 HydrophobicContact CE1-CB 4.2Å; Y1090-M1100 HydrophobicContact CE1-CE 4.12Å; Y1090-M1100 HydrophobicContact CE2-CB 3.48Å; Y1090-M1100 VanDerWaalsContact CE2-CB 3.48Å; Y1090-M1100 HydrophobicContact CE2-CE 4.25Å; Y1090-M1100 HydrophobicContact CE2-CG 4.49Å; Y1090-M1100 WeakPolarHBondContact CE2-O 3.49Å; Y1090-M1100 HydrophobicContact CG-CB 3.72Å; Y1090-M1100 WeakPolarHBondContact OH-CE 3.41Å; A1096-M1100 WeakPolarHBondContact O-CB 3.18Å; A1096-M1100 WeakPolarHBondContact O-CG 3.38Å; A1096-M1100 PolarHBondContact O-N 3.2Å |
| 1101 | G | 37 | Very low | 55.5 | Low | 61 Ų | 61 | 77.4 Ų | 77.4 | 63% | 0.629 | 40% | 0.399 | S | S | * | . | S | Bend | trans | 92.9 | 4.8 | 160.4 | 0 | 0 | 0 | 0 | 0 | 117.8 | G1097 | G1097-G1101 PolarHBondContact O-N 3.05Š|
| 1102 | T | 36.5 | Very low | 58.2 | Low | 49 Ų | 49 | 83.7 Ų | 83.7 | 30% | 0.301 | 42% | 0.421 | S | S | . | . | trans | -134.3 | 42.7 | 175.7 | 59.2 | 0 | 0 | 0 | 0 | 114 | I1089 Y1090 A1091 G1097 E1104 | I1089-T1102 WeakPolarHBondContact CA-OG1 3.44Å; I1089-T1102 WeakPolarHBondContact CB-OG1 3.17Å; I1089-T1102 PolarHBondContact N-OG1 3.4Å; Y1090-T1102 CarbonylContact C-O 3.25Å; Y1090-T1102 WeakPolarHBondContact CA-O 3.39Å; Y1090-T1102 WeakPolarHBondContact CB-OG1 3.32Å; Y1090-T1102 WeakPolarHBondContact CD2-OG1 3.37Å; Y1090-T1102 PolarHBondContact N-O 3.08Å; Y1090-T1102 PolarHBondContact N-OG1 2.93Å; A1091-T1102 PolarHBondContact N-O 3.1Å; G1097-T1102 PolarHBondContact O-N 3.33Å; T1102-E1104 PolarHBondContact O-N 3.43Å | ||
| 1103 | Y | 40.9 | Very low | 60.5 | Low | 90 Ų | 90 | 83 Ų | 83 | 35% | 0.353 | 43% | 0.425 | S | S | . | . | trans | -65 | 83.1 | 158.4 | -163.1 | -103.7 | 0 | 0 | 0 | 110.3 | Y1090 A1091 D1093 P1094 G1097 P1105 | Y1090-Y1103 WeakPolarHBondContact O-CA 3.5Å; Y1090-Y1103 PolarHBondContact O-N 3.05Å; A1091-Y1103 WeakPolarHBondContact O-CD2 3.21Å; A1091-Y1103 WeakPolarHBondContact O-CE2 3.33Å; D1093-Y1103 VanDerWaalsContact C-CE2 3.43Å; D1093-Y1103 WeakPolarHBondContact O-CD2 3.36Å; D1093-Y1103 WeakPolarHBondContact O-CE2 3.08Å; P1094-Y1103 HydrophobicContact CB-CE2 4.37Å; P1094-Y1103 HydrophobicContact CG-CE2 4.24Å; G1097-Y1103 PolarHBondContact O-N 2.97Å; Y1103-P1105 HydrophobicContact CD1-CB 4.3Å; Y1103-P1105 HydrophobicContact CE1-CB 3.89Å; Y1103-P1105 VanDerWaalsContact O-CD 3.27Å; Y1103-P1105 WeakPolarHBondContact O-CD 3.3Å | ||
| 1104 | E | 45.3 | Very low | 62.5 | Low | 77 Ų | 77 | 80.2 Ų | 80.2 | 36% | 0.36 | 41% | 0.413 | S | S | . | . | trans | -91.5 | 96.6 | 169.5 | -172.8 | 166.6 | 176.2 | 0 | 0 | 108 | G1087 N1088 A1091 T1102 S1106 | G1087-E1104 WeakPolarHBondContact CA-OE2 3.44Å; G1087-E1104 VanDerWaalsContact N-CD 3.29Å; G1087-E1104 PolarHBondContact N-OE1 3.21Å; G1087-E1104 PolarHBondContact N-OE2 2.95Å; N1088-E1104 WeakPolarHBondContact CA-OE2 3.33Å; A1091-E1104 WeakPolarHBondContact CB-O 3.41Å; T1102-E1104 PolarHBondContact O-N 3.43Å; E1104-S1106 PolarHBondContact O-N 3.06Å | ||
| 1105 | P | 50.1 | Low | 64.5 | Low | 65 Ų | 65 | 79.3 Ų | 79.3 | 42% | 0.422 | 41% | 0.408 | S | S | . | . | trans | -59.5 | 114.2 | -162.4 | 23 | -34.4 | 0 | 0 | 0 | 110.7 | Y1103 R1107 | Y1103-P1105 HydrophobicContact CD1-CB 4.3Å; Y1103-P1105 HydrophobicContact CE1-CB 3.89Å; Y1103-P1105 VanDerWaalsContact O-CD 3.27Å; Y1103-P1105 WeakPolarHBondContact O-CD 3.3Å; P1105-R1107 PolarHBondContact O-N 2.6Å | ||
| 1106 | S | 57.6 | Low | 66.6 | Low | 60 Ų | 60 | 73.8 Ų | 73.8 | 42% | 0.42 | 38% | 0.379 | S | S | . | . | trans | -55.9 | 112.8 | 177.1 | 46.6 | 0 | 0 | 0 | 0 | 108.6 | D1092 E1104 P1108 | D1092-S1106 VanDerWaalsContact OD1-CB 3.25Å; D1092-S1106 WeakPolarHBondContact OD1-CB 3.36Å; D1092-S1106 PolarHBondContact OD1-OG 3.37Å; E1104-S1106 PolarHBondContact O-N 3.06Å; S1106-P1108 VanDerWaalsContact O-N 3.12Å | ||
| 1107 | R | 76 | Confident | 68.8 | Low | 166 Ų | 166 | 75 Ų | 75 | 63% | 0.626 | 38% | 0.38 | S | S | * | . | trans | -41.2 | 119.5 | -159.3 | -72.4 | -171 | -177.6 | -174.3 | 5.3 | 111.3 | P1105 R1109 Y1125 | P1105-R1107 PolarHBondContact O-N 2.6Å; R1107-R1109 WeakPolarHBondContact O-CG 3.3Å; R1107-R1109 PolarHBondContact O-N 2.89Å; R1107-R1109 VanDerWaalsContact O-N 3.17Å; R1107-Y1125 HydrophobicContact CB-CD1 4.34Å; R1107-Y1125 HydrophobicContact CG-CD1 3.85Å; R1107-Y1125 HydrophobicContact CG-CE1 4.28Å | ||
| 1108 | P | 87.3 | Confident | 71 | Confident | 11 Ų | 11 | 75.5 Ų | 75.5 | 7% | 0.071 | 38% | 0.383 | C | S | . | . | trans | -60 | 126 | -168.6 | 24.9 | -35.1 | 0 | 0 | 0 | 109.1 | S1106 P1115 A1116 L1122 Y1125 N1126 | S1106-P1108 VanDerWaalsContact O-N 3.12Å; P1108-P1115 VanDerWaalsContact CB-O 3.24Å; P1108-P1115 WeakPolarHBondContact CB-O 3.35Å; P1108-A1116 HydrophobicContact CB-CB 3.84Å; P1108-A1116 HydrophobicContact CG-CB 4.2Å; P1108-L1122 WeakPolarHBondContact O-CD1 3.44Å; P1108-Y1125 HydrophobicContact CG-CD2 3.91Å; P1108-Y1125 HydrophobicContact CG-CE2 4.43Å; P1108-Y1125 HydrophobicContact CG-CG 4.42Å; P1108-N1126 PolarHBondContact O-ND2 3.41Å | ||
| 1109 | R | 89.7 | Confident | 73.2 | Confident | 178 Ų | 178 | 67 Ų | 67 | 67% | 0.672 | 35% | 0.35 | S | S | * | . | trans | -94.6 | -8 | -174.6 | -64.8 | -173.9 | 178.6 | -179.3 | -0.8 | 112.6 | R1107 T1111 A1114 | R1107-R1109 WeakPolarHBondContact O-CG 3.3Å; R1107-R1109 PolarHBondContact O-N 2.89Å; R1107-R1109 VanDerWaalsContact O-N 3.17Å; R1109-T1111 HydrophobicContact CB-CG2 4.1Å; R1109-T1111 PolarHBondContact O-N 2.66Å; R1109-A1114 HydrophobicContact CB-CB 4.49Å; R1109-A1114 PolarHBondContact N-O 3.21Å | ||
| 1110 | G | 91.2 | Very high | 75.2 | Confident | 4 Ų | 4 | 64.9 Ų | 64.9 | 4% | 0.041 | 34% | 0.337 | C | S | . | . | S | Bend | trans | 70.6 | 17.8 | -170.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | A1114 W1135 | G1110-A1114 PolarHBondContact N-O 3.43Å; G1110-A1114 VanDerWaalsContact N-O 3.16Å; G1110-W1135 WeakPolarHBondContact CA-O 3.38Å; G1110-W1135 PolarHBondContact O-N 2.93Å |
| 1111 | T | 92.5 | Very high | 77.6 | Confident | 59 Ų | 59 | 62.5 Ų | 62.5 | 36% | 0.362 | 32% | 0.324 | S | S | . | . | B | Isolated β-bridge | trans | -94.4 | 152.4 | 173.2 | 51.7 | 0 | 0 | 0 | 0 | 109.5 | R1109 S1113 A1114 P1115 | R1109-T1111 HydrophobicContact CB-CG2 4.1Å; R1109-T1111 PolarHBondContact O-N 2.66Å; T1111-S1113 PolarHBondContact O-N 3.46Å; T1111-A1114 CarbonylContact O-C 3.59Å; T1111-A1114 WeakPolarHBondContact O-CA 3.19Å; T1111-A1114 PolarHBondContact O-N 3.48Å; T1111-P1115 VanDerWaalsContact O-N 3.14Å |
| 1112 | R | 90.4 | Very high | 80.3 | Confident | 139 Ų | 139 | 59.6 Ų | 59.6 | 53% | 0.525 | 30% | 0.295 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -55.3 | -31.1 | -174.7 | -164.3 | 174.5 | -179 | -163.7 | -2.7 | 114.8 | W1135 V1146 | R1112-W1135 HydrophobicContact CB-CB 4.48Å; R1112-W1135 HydrophobicContact CB-CD2 3.72Å; R1112-W1135 HydrophobicContact CB-CE3 4.25Å; R1112-W1135 HydrophobicContact CB-CG 3.8Å; R1112-W1135 HydrophobicContact CG-CD2 3.74Å; R1112-W1135 HydrophobicContact CG-CE3 3.73Å; R1112-W1135 HydrophobicContact CG-CG 4.27Å; R1112-W1135 HydrophobicContact CG-CH2 4.37Å; R1112-W1135 HydrophobicContact CG-CZ2 4.39Å; R1112-W1135 HydrophobicContact CG-CZ3 4.05Å; R1112-V1146 HydrophobicContact CG-CG2 3.63Å |
| 1113 | S | 87.8 | Confident | 83 | Confident | 99 Ų | 99 | 58 Ų | 58 | 69% | 0.692 | 29% | 0.288 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.3 | -4.9 | 176.2 | 53 | 0 | 0 | 0 | 0 | 115.2 | T1111 | T1111-S1113 PolarHBondContact O-N 3.46Š|
| 1114 | A | 89.5 | Confident | 85.4 | Confident | 21 Ų | 21 | 59.3 Ų | 59.3 | 17% | 0.174 | 30% | 0.297 | C | S | . | . | B | Isolated β-bridge | trans | -149.6 | 64.5 | 177 | 0 | 0 | 0 | 0 | 0 | 109.6 | R1109 G1110 T1111 | R1109-A1114 HydrophobicContact CB-CB 4.49Å; R1109-A1114 PolarHBondContact N-O 3.21Å; G1110-A1114 PolarHBondContact N-O 3.43Å; G1110-A1114 VanDerWaalsContact N-O 3.16Å; T1111-A1114 CarbonylContact O-C 3.59Å; T1111-A1114 WeakPolarHBondContact O-CA 3.19Å; T1111-A1114 PolarHBondContact O-N 3.48Å |
| 1115 | P | 92.4 | Very high | 87.4 | Confident | 25 Ų | 25 | 60.3 Ų | 60.3 | 16% | 0.162 | 30% | 0.298 | C | S | . | . | trans | -68 | 159.5 | -178.3 | 32.1 | -38.3 | 0 | 0 | 0 | 111.3 | P1108 T1111 W1135 D1137 I1143 V1146 | P1108-P1115 VanDerWaalsContact CB-O 3.24Å; P1108-P1115 WeakPolarHBondContact CB-O 3.35Å; T1111-P1115 VanDerWaalsContact O-N 3.14Å; P1115-W1135 WeakPolarHBondContact CA-O 3.2Å; P1115-D1137 HydrophobicContact CB-CB 4.12Å; P1115-D1137 HydrophobicContact CG-CB 3.94Å; P1115-I1143 HydrophobicContact CG-CG2 4.44Å; P1115-V1146 HydrophobicContact CB-CG1 3.98Å; P1115-V1146 HydrophobicContact CG-CG1 3.75Å | ||
| 1116 | A | 92.8 | Very high | 89.3 | Confident | 1 Ų | 1 | 59.3 Ų | 59.3 | 1% | 0.008 | 29% | 0.289 | C | S | . | . | B | Isolated β-bridge | trans | -96.5 | 159.1 | 164.3 | 0 | 0 | 0 | 0 | 0 | 110.5 | P1108 T1118 L1122 W1135 I1136 D1137 | P1108-A1116 HydrophobicContact CB-CB 3.84Å; P1108-A1116 HydrophobicContact CG-CB 4.2Å; A1116-T1118 VanDerWaalsContact C-N 3.29Å; A1116-T1118 WeakPolarHBondContact CB-O 3.41Å; A1116-T1118 PolarHBondContact O-N 3.25Å; A1116-L1122 HydrophobicContact CB-CB 3.66Å; A1116-L1122 HydrophobicContact CB-CD1 4.3Å; A1116-L1122 HydrophobicContact CB-CG 4.42Å; A1116-W1135 PolarHBondContact N-O 3.21Å; A1116-I1136 HydrophobicContact CB-CG2 4.43Å; A1116-I1136 CarbonylContact O-C 3.58Å; A1116-I1136 WeakPolarHBondContact O-CA 3.39Å; A1116-I1136 WeakPolarHBondContact O-CB 3.43Å; A1116-D1137 PolarHBondContact O-N 3.1Å |
| 1117 | L | 93 | Very high | 90.7 | Very high | 59 Ų | 59 | 64.9 Ų | 64.9 | 31% | 0.309 | 31% | 0.306 | S | S | . | . | S | Bend | trans | -63.9 | -39 | 170.8 | -59 | 177.4 | 0 | 0 | 0 | 111.3 | D1137 P1138 | L1117-D1137 WeakPolarHBondContact CA-O 3.24Å; L1117-D1137 WeakPolarHBondContact CD2-O 3.17Å; L1117-P1138 WeakPolarHBondContact O-CA 3.04Å |
| 1118 | T | 94.7 | Very high | 91.4 | Very high | 13 Ų | 13 | 64.6 Ų | 64.6 | 8% | 0.08 | 32% | 0.317 | C | S | . | . | S | Bend | trans | -149 | 162.7 | 178.1 | 60 | 0 | 0 | 0 | 0 | 111.4 | A1116 K1120 Q1121 L1122 L1203 H1206 | A1116-T1118 VanDerWaalsContact C-N 3.29Å; A1116-T1118 WeakPolarHBondContact CB-O 3.41Å; A1116-T1118 PolarHBondContact O-N 3.25Å; T1118-K1120 PolarHBondContact O-N 3.39Å; T1118-Q1121 PolarHBondContact O-N 3.09Å; T1118-Q1121 PolarHBondContact OG1-N 3.09Å; T1118-L1122 PolarHBondContact O-N 3.32Å; T1118-L1203 HydrophobicContact CG2-CD1 3.97Å; T1118-H1206 HydrophobicContact CG2-CB 3.75Å |
| 1119 | C | 96.1 | Very high | 91.6 | Very high | 0 Ų | 0 | 66.3 Ų | 66.3 | 0% | 0 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -59.9 | -30.3 | 172.4 | -67.6 | 0 | 0 | 0 | 0 | 113.1 | L1122 G1123 C1151 F1153 T1158 | C1119-L1122 PolarHBondContact O-N 3.37Å; C1119-G1123 PolarHBondContact O-N 3.45Å; C1119-C1151 VanDerWaalsContact CA-SG 3.53Å; C1119-C1151 HydrophobicContact CB-CB 3.42Å; C1119-C1151 VanDerWaalsContact CB-CB 3.42Å; C1119-C1151 WeakPolarHBondContact CB-SG 3.25Å; C1119-C1151 WeakPolarHBondContact SG-CA 3.33Å; C1119-C1151 WeakPolarHBondContact SG-CB 3.46Å; C1119-C1151 CovalentContact SG-SG 2.03Å; C1119-C1151 PolarHBondContact SG-SG 2.7Å; C1119-F1153 WeakPolarHBondContact O-CE1 3.47Å; C1119-T1158 WeakPolarHBondContact CB-OG1 3.43Å; C1119-T1158 PolarHBondContact N-OG1 3.15Å; C1119-T1158 VanDerWaalsContact N-OG1 3.13Å |
| 1120 | K | 94.9 | Very high | 91.9 | Very high | 84 Ų | 84 | 61.9 Ų | 61.9 | 37% | 0.365 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -61.1 | -52.7 | 172.9 | 178.9 | 176.3 | 176.8 | -177.4 | 0 | 111.6 | T1118 L1122 G1123 E1124 | T1118-K1120 PolarHBondContact O-N 3.39Å; K1120-L1122 VanDerWaalsContact C-N 3.29Å; K1120-L1122 PolarHBondContact O-N 2.77Å; K1120-G1123 PolarHBondContact O-N 3.14Å; K1120-E1124 WeakPolarHBondContact CE-OE1 3.25Å; K1120-E1124 WeakPolarHBondContact CG-OE1 3.44Å; K1120-E1124 WeakPolarHBondContact O-CG 3.16Å; K1120-E1124 PolarHBondContact O-N 3.23Å |
| 1121 | Q | 93.3 | Very high | 92.1 | Very high | 52 Ų | 52 | 64.7 Ų | 64.7 | 24% | 0.243 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -59.2 | -42.6 | 176.8 | -171 | -166.3 | 44 | 0 | 0 | 111 | T1118 G1123 E1124 Y1125 | T1118-Q1121 PolarHBondContact O-N 3.09Å; T1118-Q1121 PolarHBondContact OG1-N 3.09Å; Q1121-G1123 PolarHBondContact O-N 2.78Å; Q1121-E1124 PolarHBondContact O-N 3.5Å; Q1121-Y1125 HydrophobicContact CG-CD2 4Å; Q1121-Y1125 HydrophobicContact CG-CE2 3.95Å; Q1121-Y1125 WeakPolarHBondContact O-CD2 3.38Å; Q1121-Y1125 PolarHBondContact O-N 3.26Å; Q1121-Y1125 VanDerWaalsContact O-N 3.14Å |
| 1122 | L | 94.1 | Very high | 92.3 | Very high | 0 Ų | 0 | 65.9 Ų | 65.9 | 0% | 0 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -59.2 | -44.3 | 179.3 | -178 | 58.3 | 0 | 0 | 0 | 112.7 | P1108 A1116 T1118 C1119 K1120 N1126 L1129 Y1134 F1153 | P1108-L1122 WeakPolarHBondContact O-CD1 3.44Å; A1116-L1122 HydrophobicContact CB-CB 3.66Å; A1116-L1122 HydrophobicContact CB-CD1 4.3Å; A1116-L1122 HydrophobicContact CB-CG 4.42Å; T1118-L1122 PolarHBondContact O-N 3.32Å; C1119-L1122 PolarHBondContact O-N 3.37Å; K1120-L1122 VanDerWaalsContact C-N 3.29Å; K1120-L1122 PolarHBondContact O-N 2.77Å; L1122-N1126 WeakPolarHBondContact O-CB 3.38Å; L1122-N1126 PolarHBondContact O-N 2.79Å; L1122-N1126 PolarHBondContact O-ND2 2.8Å; L1122-N1126 VanDerWaalsContact O-ND2 3.13Å; L1122-L1129 HydrophobicContact CD1-CD1 3.8Å; L1122-L1129 HydrophobicContact CD2-CD1 4.17Å; L1122-L1129 HydrophobicContact CG-CD1 3.71Å; L1122-Y1134 HydrophobicContact CD2-CD1 3.76Å; L1122-Y1134 HydrophobicContact CD2-CD2 4.04Å; L1122-Y1134 HydrophobicContact CD2-CG 3.48Å; L1122-Y1134 VanDerWaalsContact CD2-CG 3.48Å; L1122-F1153 HydrophobicContact CB-CE1 4.01Å; L1122-F1153 HydrophobicContact CD2-CE1 4.04Å; L1122-F1153 HydrophobicContact CD2-CZ 3.8Å; L1122-F1153 HydrophobicContact CG-CE1 3.87Å; L1122-F1153 HydrophobicContact CG-CZ 3.96Å |
| 1123 | G | 93.1 | Very high | 92.5 | Very high | 15 Ų | 15 | 61.7 Ų | 61.7 | 16% | 0.155 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -72.3 | -31.2 | 177 | 0 | 0 | 0 | 0 | 0 | 114.1 | C1119 K1120 Q1121 N1126 K1127 F1153 | C1119-G1123 PolarHBondContact O-N 3.45Å; K1120-G1123 PolarHBondContact O-N 3.14Å; Q1121-G1123 PolarHBondContact O-N 2.78Å; G1123-N1126 CarbonylContact O-C 3.03Å; G1123-K1127 PolarHBondContact O-N 3.12Å; G1123-F1153 VanDerWaalsContact CA-CD1 3.47Å |
| 1124 | E | 91 | Very high | 92.9 | Very high | 117 Ų | 117 | 58.3 Ų | 58.3 | 55% | 0.547 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -64.1 | -39.4 | 173.5 | -75.5 | 171.7 | -171 | 0 | 0 | 111.7 | K1120 Q1121 | K1120-E1124 WeakPolarHBondContact CE-OE1 3.25Å; K1120-E1124 WeakPolarHBondContact CG-OE1 3.44Å; K1120-E1124 WeakPolarHBondContact O-CG 3.16Å; K1120-E1124 PolarHBondContact O-N 3.23Å; Q1121-E1124 PolarHBondContact O-N 3.5Å |
| 1125 | Y | 89.1 | Confident | 93.1 | Very high | 98 Ų | 98 | 60.4 Ų | 60.4 | 38% | 0.384 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -78.6 | -35.1 | 174.9 | -81.8 | -75.2 | 0 | 0 | 0 | 114.2 | R1107 P1108 Q1121 | R1107-Y1125 HydrophobicContact CB-CD1 4.34Å; R1107-Y1125 HydrophobicContact CG-CD1 3.85Å; R1107-Y1125 HydrophobicContact CG-CE1 4.28Å; P1108-Y1125 HydrophobicContact CG-CD2 3.91Å; P1108-Y1125 HydrophobicContact CG-CE2 4.43Å; P1108-Y1125 HydrophobicContact CG-CG 4.42Å; Q1121-Y1125 HydrophobicContact CG-CD2 4Å; Q1121-Y1125 HydrophobicContact CG-CE2 3.95Å; Q1121-Y1125 WeakPolarHBondContact O-CD2 3.38Å; Q1121-Y1125 PolarHBondContact O-N 3.26Å; Q1121-Y1125 VanDerWaalsContact O-N 3.14Å |
| 1126 | N | 89.5 | Confident | 93.2 | Very high | 44 Ų | 44 | 59.2 Ų | 59.2 | 24% | 0.235 | 29% | 0.29 | C | S | . | . | trans | -129.8 | 72.4 | -170.9 | -50.5 | -80.4 | 0 | 0 | 0 | 111.4 | P1108 L1122 G1123 N1128 L1129 | P1108-N1126 PolarHBondContact O-ND2 3.41Å; L1122-N1126 WeakPolarHBondContact O-CB 3.38Å; L1122-N1126 PolarHBondContact O-N 2.79Å; L1122-N1126 PolarHBondContact O-ND2 2.8Å; L1122-N1126 VanDerWaalsContact O-ND2 3.13Å; G1123-N1126 CarbonylContact O-C 3.03Å; N1126-N1128 PolarHBondContact O-N 3.15Å; N1126-L1129 HydrophobicContact CB-CD1 3.61Å; N1126-L1129 HydrophobicContact CB-CG 3.73Å; N1126-L1129 PolarHBondContact O-N 3.02Å | ||
| 1127 | K | 87.3 | Confident | 93.2 | Very high | 178 Ų | 178 | 59.6 Ų | 59.6 | 77% | 0.774 | 29% | 0.292 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.6 | -9.5 | -172 | -61.4 | -171.1 | 176.4 | -171.6 | 0 | 117 | G1123 | G1123-K1127 PolarHBondContact O-N 3.12Š|
| 1128 | N | 89.1 | Confident | 93.3 | Very high | 159 Ų | 159 | 56.8 Ų | 56.8 | 85% | 0.85 | 28% | 0.278 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -109 | 9.3 | -175.6 | -62.9 | 10.4 | 0 | 0 | 0 | 112.9 | N1126 | N1126-N1128 PolarHBondContact O-N 3.15Š|
| 1129 | L | 91.9 | Very high | 93.1 | Very high | 48 Ų | 48 | 57 Ų | 57 | 25% | 0.251 | 28% | 0.278 | S | S | . | . | trans | -71.7 | 137.2 | 175.4 | -71 | 178 | 0 | 0 | 0 | 111.4 | L1122 N1126 Y1134 F1153 | L1122-L1129 HydrophobicContact CD1-CD1 3.8Å; L1122-L1129 HydrophobicContact CD2-CD1 4.17Å; L1122-L1129 HydrophobicContact CG-CD1 3.71Å; N1126-L1129 HydrophobicContact CB-CD1 3.61Å; N1126-L1129 HydrophobicContact CB-CG 3.73Å; N1126-L1129 PolarHBondContact O-N 3.02Å; L1129-Y1134 HydrophobicContact CD1-CE1 3.96Å; L1129-Y1134 HydrophobicContact CD2-CE1 4.05Å; L1129-Y1134 HydrophobicContact CG-CE1 4.45Å; L1129-F1153 HydrophobicContact CB-CD2 3.92Å; L1129-F1153 HydrophobicContact CB-CE2 3.4Å; L1129-F1153 HydrophobicContact CB-CZ 3.83Å; L1129-F1153 HydrophobicContact CD1-CE2 4.28Å; L1129-F1153 HydrophobicContact CD1-CZ 3.84Å; L1129-F1153 HydrophobicContact CG-CE2 4.49Å; L1129-F1153 VanDerWaalsContact O-CD2 3.29Å; L1129-F1153 WeakPolarHBondContact O-CD2 3.48Å | ||
| 1130 | P | 96.1 | Very high | 92.6 | Very high | 85 Ų | 85 | 58 Ų | 58 | 55% | 0.552 | 29% | 0.289 | S | S | * | . | trans | -75.9 | 151.1 | 171.2 | 32.3 | -35.5 | 0 | 0 | 0 | 111.4 | D1132 Y1134 F1153 | P1130-D1132 PolarHBondContact O-N 2.84Å; P1130-D1132 VanDerWaalsContact O-N 3.09Å; P1130-Y1134 WeakPolarHBondContact CD-OH 3.35Å; P1130-Y1134 WeakPolarHBondContact O-CE2 3.43Å; P1130-Y1134 PolarHBondContact O-OH 2.92Å; P1130-F1153 VanDerWaalsContact O-CE2 3.3Å; P1130-F1153 WeakPolarHBondContact O-CE2 3.49Å | ||
| 1131 | D | 96.5 | Very high | 91.8 | Very high | 62 Ų | 62 | 58.3 Ų | 58.3 | 33% | 0.332 | 29% | 0.294 | S | S | . | . | S | Bend | trans | -61 | 109.9 | 174.1 | -66.7 | -8.8 | 0 | 0 | 0 | 109.9 | Y1150 C1151 K1152 F1153 | D1131-Y1150 HydrophobicContact CB-CE1 4.42Å; D1131-Y1150 PolarHBondContact O-OH 3.01Å; D1131-C1151 CarbonylContact C-O 3.58Å; D1131-C1151 WeakPolarHBondContact CA-O 3.14Å; D1131-C1151 WeakPolarHBondContact CB-O 3.47Å; D1131-K1152 WeakPolarHBondContact OD1-CA 3.4Å; D1131-F1153 PolarHBondContact OD1-N 3.32Å |
| 1132 | D | 96.1 | Very high | 91.2 | Very high | 85 Ų | 85 | 59.9 Ų | 59.9 | 46% | 0.455 | 30% | 0.301 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -160.6 | -176.1 | -172.9 | -157 | -5.2 | 0 | 0 | 0 | 111.5 | P1130 Y1134 C1151 | P1130-D1132 PolarHBondContact O-N 2.84Å; P1130-D1132 VanDerWaalsContact O-N 3.09Å; D1132-Y1134 HydrophobicContact CB-CE2 3.81Å; D1132-Y1134 WeakPolarHBondContact O-CD2 3.36Å; D1132-Y1134 WeakPolarHBondContact O-CE2 3.31Å; D1132-C1151 PolarHBondContact N-O 3.47Å; D1132-C1151 PolarHBondContact O-N 3.09Å |
| 1133 | Y | 95.4 | Very high | 90.6 | Very high | 50 Ų | 50 | 64.1 Ų | 64.1 | 20% | 0.196 | 32% | 0.323 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.7 | 104.2 | -179.2 | -73.5 | -84.2 | 0 | 0 | 0 | 113.7 | Q1148 A1149 Y1150 R1161 E1304 | Y1133-Q1148 PolarHBondContact O-NE2 3.47Å; Y1133-Q1148 VanDerWaalsContact O-NE2 3.12Å; Y1133-A1149 CarbonylContact C-O 3.55Å; Y1133-A1149 WeakPolarHBondContact CA-O 3.45Å; Y1133-Y1150 HydrophobicContact CD1-CD2 4.31Å; Y1133-Y1150 AromaticContact CD2-CD2 3.63Å; Y1133-Y1150 HydrophobicContact CD2-CD2 3.63Å; Y1133-Y1150 HydrophobicContact CD2-CE2 4.26Å; Y1133-Y1150 VanDerWaalsContact CE1-CB 3.5Å; Y1133-Y1150 HydrophobicContact CE1-CD2 4.03Å; Y1133-Y1150 HydrophobicContact CE1-CG 4.22Å; Y1133-Y1150 AromaticContact CE2-CD2 3.29Å; Y1133-Y1150 HydrophobicContact CE2-CD2 3.29Å; Y1133-Y1150 AromaticContact CE2-CE2 3.89Å; Y1133-Y1150 HydrophobicContact CE2-CE2 3.89Å; Y1133-Y1150 HydrophobicContact CE2-CG 4.18Å; Y1133-Y1150 HydrophobicContact CG-CD2 4.09Å; Y1133-Y1150 AromaticContact CZ-CD2 3.44Å; Y1133-Y1150 VanDerWaalsContact CZ-CD2 3.44Å; Y1133-Y1150 AromaticContact CZ-CG 3.86Å; Y1133-R1161 HydrophobicContact CE1-CG 4.41Å; Y1133-R1161 VanDerWaalsContact CZ-NE 3.3Å; Y1133-R1161 VanDerWaalsContact OH-CZ 3.27Å; Y1133-R1161 PolarHBondContact OH-NE 3.06Å; Y1133-R1161 PolarHBondContact OH-NH2 3.01Å; Y1133-E1304 PolarHBondContact OH-OE1 3.41Å; Y1133-E1304 PolarHBondContact OH-OE2 2.77Å; Y1133-E1304 VanDerWaalsContact OH-OE2 3.05Å |
| 1134 | Y | 95.5 | Very high | 90 | Very high | 28 Ų | 28 | 68.7 Ų | 68.7 | 11% | 0.11 | 34% | 0.344 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.1 | 159 | 178.2 | -60.3 | -91.6 | 0 | 0 | 0 | 111.9 | L1122 L1129 P1130 D1132 Q1148 A1149 C1151 F1153 | L1122-Y1134 HydrophobicContact CD2-CD1 3.76Å; L1122-Y1134 HydrophobicContact CD2-CD2 4.04Å; L1122-Y1134 HydrophobicContact CD2-CG 3.48Å; L1122-Y1134 VanDerWaalsContact CD2-CG 3.48Å; L1129-Y1134 HydrophobicContact CD1-CE1 3.96Å; L1129-Y1134 HydrophobicContact CD2-CE1 4.05Å; L1129-Y1134 HydrophobicContact CG-CE1 4.45Å; P1130-Y1134 WeakPolarHBondContact CD-OH 3.35Å; P1130-Y1134 WeakPolarHBondContact O-CE2 3.43Å; P1130-Y1134 PolarHBondContact O-OH 2.92Å; D1132-Y1134 HydrophobicContact CB-CE2 3.81Å; D1132-Y1134 WeakPolarHBondContact O-CD2 3.36Å; D1132-Y1134 WeakPolarHBondContact O-CE2 3.31Å; Y1134-Q1148 WeakPolarHBondContact O-CA 3.46Å; Y1134-A1149 PolarHBondContact N-O 3.14Å; Y1134-A1149 PolarHBondContact O-N 2.77Å; Y1134-C1151 HydrophobicContact CD2-CB 3.7Å; Y1134-C1151 HydrophobicContact CE2-CB 4.19Å; Y1134-F1153 HydrophobicContact CD2-CE2 4.17Å; Y1134-F1153 AromaticContact CD2-CZ 3.87Å; Y1134-F1153 HydrophobicContact CD2-CZ 3.87Å; Y1134-F1153 AromaticContact CE2-CE2 3.46Å; Y1134-F1153 HydrophobicContact CE2-CE2 3.46Å; Y1134-F1153 VanDerWaalsContact CE2-CE2 3.46Å; Y1134-F1153 AromaticContact CE2-CZ 3.6Å; Y1134-F1153 HydrophobicContact CE2-CZ 3.6Å; Y1134-F1153 AromaticContact CZ-CE2 3.87Å |
| 1135 | W | 93.7 | Very high | 89.9 | Confident | 65 Ų | 65 | 66.4 Ų | 66.4 | 25% | 0.246 | 34% | 0.335 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.6 | 131.1 | 173 | -66.7 | 83.1 | 0 | 0 | 0 | 110.9 | G1110 R1112 P1115 A1116 V1146 V1147 Q1148 | G1110-W1135 WeakPolarHBondContact CA-O 3.38Å; G1110-W1135 PolarHBondContact O-N 2.93Å; R1112-W1135 HydrophobicContact CB-CB 4.48Å; R1112-W1135 HydrophobicContact CB-CD2 3.72Å; R1112-W1135 HydrophobicContact CB-CE3 4.25Å; R1112-W1135 HydrophobicContact CB-CG 3.8Å; R1112-W1135 HydrophobicContact CG-CD2 3.74Å; R1112-W1135 HydrophobicContact CG-CE3 3.73Å; R1112-W1135 HydrophobicContact CG-CG 4.27Å; R1112-W1135 HydrophobicContact CG-CH2 4.37Å; R1112-W1135 HydrophobicContact CG-CZ2 4.39Å; R1112-W1135 HydrophobicContact CG-CZ3 4.05Å; P1115-W1135 WeakPolarHBondContact CA-O 3.2Å; A1116-W1135 PolarHBondContact N-O 3.21Å; W1135-V1146 HydrophobicContact CE3-CB 4.07Å; W1135-V1146 HydrophobicContact CE3-CG2 3.83Å; W1135-V1146 HydrophobicContact CZ3-CG2 4.08Å; W1135-V1146 WeakPolarHBondContact CZ3-O 2.99Å; W1135-V1147 CarbonylContact C-O 3.58Å; W1135-V1147 WeakPolarHBondContact CA-O 3.33Å; W1135-Q1148 HydrophobicContact CD2-CB 4.46Å |
| 1136 | I | 93.3 | Very high | 90 | Very high | 0 Ų | 0 | 62.1 Ų | 62.1 | 0% | 0 | 32% | 0.32 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.7 | 156 | 176.9 | 61.3 | 169.4 | 0 | 0 | 0 | 111.4 | A1116 P1138 V1147 A1149 T1158 | A1116-I1136 HydrophobicContact CB-CG2 4.43Å; A1116-I1136 CarbonylContact O-C 3.58Å; A1116-I1136 WeakPolarHBondContact O-CA 3.39Å; A1116-I1136 WeakPolarHBondContact O-CB 3.43Å; I1136-P1138 HydrophobicContact CD1-CG 3.98Å; I1136-P1138 HydrophobicContact CG1-CG 4.35Å; I1136-V1147 HydrophobicContact CD1-CG2 4.41Å; I1136-V1147 HydrophobicContact CG1-CG2 3.77Å; I1136-V1147 PolarHBondContact N-O 3.27Å; I1136-V1147 PolarHBondContact O-N 3.17Å; I1136-A1149 HydrophobicContact CD1-CB 3.53Å; I1136-A1149 HydrophobicContact CG1-CB 3.94Å; I1136-T1158 HydrophobicContact CD1-CG2 3.41Å; I1136-T1158 VanDerWaalsContact CD1-CG2 3.41Å |
| 1137 | D | 94.2 | Very high | 90.1 | Very high | 10 Ų | 10 | 61.3 Ų | 61.3 | 5% | 0.053 | 32% | 0.316 | C | S | . | . | trans | -130.5 | 82.3 | 172.1 | 177.3 | 8.7 | 0 | 0 | 0 | 109 | P1115 A1116 L1117 N1139 G1140 N1141 V1146 Q1199 | P1115-D1137 HydrophobicContact CB-CB 4.12Å; P1115-D1137 HydrophobicContact CG-CB 3.94Å; A1116-D1137 PolarHBondContact O-N 3.1Å; L1117-D1137 WeakPolarHBondContact CA-O 3.24Å; L1117-D1137 WeakPolarHBondContact CD2-O 3.17Å; D1137-N1139 PolarHBondContact O-N 3.35Å; D1137-N1139 PolarHBondContact OD1-N 3.16Å; D1137-N1139 PolarHBondContact OD1-OD1 3.17Å; D1137-N1139 VanDerWaalsContact OD1-OD1 3.14Å; D1137-G1140 PolarHBondContact O-N 2.75Å; D1137-G1140 PolarHBondContact OD1-N 3.47Å; D1137-G1140 WeakPolarHBondContact OD2-CA 3.39Å; D1137-G1140 PolarHBondContact OD2-N 3.03Å; D1137-N1141 PolarHBondContact OD2-N 2.96Å; D1137-N1141 VanDerWaalsContact OD2-N 3.15Å; D1137-V1146 HydrophobicContact CB-CG1 4.06Å; D1137-Q1199 PolarHBondContact OD1-NE2 2.94Å | ||
| 1138 | P | 93.7 | Very high | 90.3 | Very high | 0 Ų | 0 | 56.8 Ų | 56.8 | 0% | 0 | 30% | 0.298 | C | S | . | . | S | Bend | trans | -53.6 | -32.2 | 176 | -28.4 | 33 | 0 | 0 | 0 | 114.9 | L1117 I1136 Q1199 Y1202 L1203 H1206 | L1117-P1138 WeakPolarHBondContact O-CA 3.04Å; I1136-P1138 HydrophobicContact CD1-CG 3.98Å; I1136-P1138 HydrophobicContact CG1-CG 4.35Å; P1138-Q1199 WeakPolarHBondContact CB-O 3.46Å; P1138-Y1202 WeakPolarHBondContact O-CB 3.28Å; P1138-L1203 HydrophobicContact CB-CB 3.99Å; P1138-L1203 HydrophobicContact CG-CB 3.99Å; P1138-L1203 HydrophobicContact CG-CD1 4.44Å; P1138-H1206 PolarHBondContact O-CD2 2.91Å; P1138-H1206 PolarHBondContact O-NE2 3.05Å |
| 1139 | N | 90.5 | Very high | 90.6 | Very high | 18 Ų | 18 | 49.2 Ų | 49.2 | 10% | 0.096 | 26% | 0.257 | C | S | . | . | S | Bend | trans | -85.3 | -23 | -176.4 | 82.8 | 38.9 | 0 | 0 | 0 | 113.5 | D1137 N1141 D1145 Q1199 Y1202 | D1137-N1139 PolarHBondContact O-N 3.35Å; D1137-N1139 PolarHBondContact OD1-N 3.16Å; D1137-N1139 PolarHBondContact OD1-OD1 3.17Å; D1137-N1139 VanDerWaalsContact OD1-OD1 3.14Å; N1139-N1141 VanDerWaalsContact CG-ND2 3.32Å; N1139-N1141 PolarHBondContact O-ND2 3.01Å; N1139-N1141 VanDerWaalsContact OD1-CB 3.27Å; N1139-N1141 WeakPolarHBondContact OD1-CB 3.39Å; N1139-N1141 PolarHBondContact OD1-N 2.95Å; N1139-N1141 PolarHBondContact OD1-ND2 3.1Å; N1139-D1145 PolarHBondContact ND2-OD1 3.17Å; N1139-D1145 PolarHBondContact ND2-OD2 3.24Å; N1139-Q1199 VanDerWaalsContact CG-CD 3.47Å; N1139-Q1199 PolarHBondContact ND2-NE2 3.01Å; N1139-Q1199 PolarHBondContact ND2-OE1 3.45Å; N1139-Y1202 HydrophobicContact CB-CD1 4.12Å; N1139-Y1202 HydrophobicContact CB-CD2 3.62Å; N1139-Y1202 HydrophobicContact CB-CE1 4.43Å; N1139-Y1202 HydrophobicContact CB-CE2 3.98Å; N1139-Y1202 HydrophobicContact CB-CG 3.69Å |
| 1140 | G | 86.6 | Confident | 90.8 | Very high | 21 Ų | 21 | 50 Ų | 50 | 22% | 0.216 | 26% | 0.257 | C | S | . | . | trans | 69.3 | 31.4 | 172.6 | 0 | 0 | 0 | 0 | 0 | 114.4 | D1137 | D1137-G1140 PolarHBondContact O-N 2.75Å; D1137-G1140 PolarHBondContact OD1-N 3.47Å; D1137-G1140 WeakPolarHBondContact OD2-CA 3.39Å; D1137-G1140 PolarHBondContact OD2-N 3.03Å | ||
| 1141 | N | 79.1 | Confident | 90.8 | Very high | 90 Ų | 90 | 45.9 Ų | 45.9 | 48% | 0.481 | 23% | 0.231 | S | C | . | . | S | Bend | trans | -110.9 | -77.6 | -176.1 | -59.6 | -74.5 | 0 | 0 | 0 | 113.1 | D1137 N1139 | D1137-N1141 PolarHBondContact OD2-N 2.96Å; D1137-N1141 VanDerWaalsContact OD2-N 3.15Å; N1139-N1141 VanDerWaalsContact CG-ND2 3.32Å; N1139-N1141 PolarHBondContact O-ND2 3.01Å; N1139-N1141 VanDerWaalsContact OD1-CB 3.27Å; N1139-N1141 WeakPolarHBondContact OD1-CB 3.39Å; N1139-N1141 PolarHBondContact OD1-N 2.95Å; N1139-N1141 PolarHBondContact OD1-ND2 3.1Å |
| 1142 | E | 80.1 | Confident | 90.8 | Very high | 85 Ų | 85 | 45.8 Ų | 45.8 | 40% | 0.397 | 23% | 0.228 | S | C | . | . | trans | -113.2 | 126.3 | -176.5 | -82.8 | -165 | -153.2 | 0 | 0 | 111.9 | N1144 D1145 | E1142-N1144 HydrophobicContact CB-CB 4.33Å; E1142-N1144 PolarHBondContact O-N 3.29Å; E1142-N1144 PolarHBondContact OE2-ND2 3.26Å; E1142-D1145 PolarHBondContact O-N 3.28Å; E1142-D1145 VanDerWaalsContact O-N 3.14Å | ||
| 1143 | I | 81.9 | Confident | 90.8 | Very high | 88 Ų | 88 | 43.5 Ų | 43.5 | 45% | 0.451 | 21% | 0.214 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -61.5 | 2.9 | 171.9 | 63.8 | 167.9 | 0 | 0 | 0 | 114.6 | P1115 V1146 | P1115-I1143 HydrophobicContact CG-CG2 4.44Å; I1143-V1146 HydrophobicContact CB-CG1 4.42Å; I1143-V1146 WeakPolarHBondContact O-CG2 3.44Å |
| 1144 | N | 80.4 | Confident | 90.7 | Very high | 111 Ų | 111 | 50.7 Ų | 50.7 | 59% | 0.594 | 25% | 0.246 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -85.3 | -37.9 | 175.5 | -67.3 | -43.5 | 0 | 0 | 0 | 112.8 | E1142 | E1142-N1144 HydrophobicContact CB-CB 4.33Å; E1142-N1144 PolarHBondContact O-N 3.29Å; E1142-N1144 PolarHBondContact OE2-ND2 3.26Å |
| 1145 | D | 88 | Confident | 90.6 | Very high | 69 Ų | 69 | 52.1 Ų | 52.1 | 37% | 0.369 | 26% | 0.257 | S | S | . | . | S | Bend | trans | -95.5 | 8.6 | -178.1 | 91.5 | -25.4 | 0 | 0 | 0 | 113.7 | N1139 E1142 V1147 Q1199 | N1139-D1145 PolarHBondContact ND2-OD1 3.17Å; N1139-D1145 PolarHBondContact ND2-OD2 3.24Å; E1142-D1145 PolarHBondContact O-N 3.28Å; E1142-D1145 VanDerWaalsContact O-N 3.14Å; D1145-V1147 WeakPolarHBondContact O-CG1 3.35Å; D1145-Q1199 PolarHBondContact OD1-NE2 3.14Å |
| 1146 | V | 90.7 | Very high | 90.6 | Very high | 9 Ų | 9 | 51 Ų | 51 | 6% | 0.055 | 26% | 0.26 | C | S | . | . | trans | -44.5 | 140.9 | 166.2 | -70.3 | 0 | 0 | 0 | 0 | 112.8 | R1112 P1115 W1135 D1137 I1143 | R1112-V1146 HydrophobicContact CG-CG2 3.63Å; P1115-V1146 HydrophobicContact CB-CG1 3.98Å; P1115-V1146 HydrophobicContact CG-CG1 3.75Å; W1135-V1146 HydrophobicContact CE3-CB 4.07Å; W1135-V1146 HydrophobicContact CE3-CG2 3.83Å; W1135-V1146 HydrophobicContact CZ3-CG2 4.08Å; W1135-V1146 WeakPolarHBondContact CZ3-O 2.99Å; D1137-V1146 HydrophobicContact CB-CG1 4.06Å; I1143-V1146 HydrophobicContact CB-CG1 4.42Å; I1143-V1146 WeakPolarHBondContact O-CG2 3.44Å | ||
| 1147 | V | 91.8 | Very high | 90.7 | Very high | 27 Ų | 27 | 52.1 Ų | 52.1 | 16% | 0.164 | 27% | 0.265 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125 | 156.4 | -176.5 | -64.9 | 0 | 0 | 0 | 0 | 110.9 | W1135 I1136 D1145 L1195 | W1135-V1147 CarbonylContact C-O 3.58Å; W1135-V1147 WeakPolarHBondContact CA-O 3.33Å; I1136-V1147 HydrophobicContact CD1-CG2 4.41Å; I1136-V1147 HydrophobicContact CG1-CG2 3.77Å; I1136-V1147 PolarHBondContact N-O 3.27Å; I1136-V1147 PolarHBondContact O-N 3.17Å; D1145-V1147 WeakPolarHBondContact O-CG1 3.35Å; V1147-L1195 HydrophobicContact CB-CD1 3.88Å; V1147-L1195 HydrophobicContact CG1-CD1 3.55Å; V1147-L1195 HydrophobicContact CG2-CD1 3.56Å |
| 1148 | Q | 92.9 | Very high | 90.9 | Very high | 83 Ų | 83 | 51.7 Ų | 51.7 | 39% | 0.388 | 26% | 0.263 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.3 | 133.9 | 173.8 | -153.8 | 176.5 | 16 | 0 | 0 | 109.9 | Y1133 Y1134 W1135 | Y1133-Q1148 PolarHBondContact O-NE2 3.47Å; Y1133-Q1148 VanDerWaalsContact O-NE2 3.12Å; Y1134-Q1148 WeakPolarHBondContact O-CA 3.46Å; W1135-Q1148 HydrophobicContact CD2-CB 4.46Å |
| 1149 | A | 95 | Very high | 91 | Very high | 0 Ų | 0 | 51.8 Ų | 51.8 | 0% | 0 | 26% | 0.263 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.3 | 147.3 | 178.9 | 0 | 0 | 0 | 0 | 0 | 110.2 | Y1133 Y1134 I1136 C1151 T1158 I1160 | Y1133-A1149 CarbonylContact C-O 3.55Å; Y1133-A1149 WeakPolarHBondContact CA-O 3.45Å; Y1134-A1149 PolarHBondContact N-O 3.14Å; Y1134-A1149 PolarHBondContact O-N 2.77Å; I1136-A1149 HydrophobicContact CD1-CB 3.53Å; I1136-A1149 HydrophobicContact CG1-CB 3.94Å; A1149-C1151 PolarHBondContact O-N 2.75Å; A1149-T1158 HydrophobicContact CB-CG2 3.83Å; A1149-I1160 HydrophobicContact CB-CD1 3.73Å |
| 1150 | Y | 96 | Very high | 91.2 | Very high | 63 Ų | 63 | 51 Ų | 51 | 25% | 0.247 | 26% | 0.259 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.2 | 119.6 | 172.5 | -168.7 | -106 | 0 | 0 | 0 | 109.7 | D1131 Y1133 K1152 C1159 | D1131-Y1150 HydrophobicContact CB-CE1 4.42Å; D1131-Y1150 PolarHBondContact O-OH 3.01Å; Y1133-Y1150 HydrophobicContact CD1-CD2 4.31Å; Y1133-Y1150 AromaticContact CD2-CD2 3.63Å; Y1133-Y1150 HydrophobicContact CD2-CD2 3.63Å; Y1133-Y1150 HydrophobicContact CD2-CE2 4.26Å; Y1133-Y1150 VanDerWaalsContact CE1-CB 3.5Å; Y1133-Y1150 HydrophobicContact CE1-CD2 4.03Å; Y1133-Y1150 HydrophobicContact CE1-CG 4.22Å; Y1133-Y1150 AromaticContact CE2-CD2 3.29Å; Y1133-Y1150 HydrophobicContact CE2-CD2 3.29Å; Y1133-Y1150 AromaticContact CE2-CE2 3.89Å; Y1133-Y1150 HydrophobicContact CE2-CE2 3.89Å; Y1133-Y1150 HydrophobicContact CE2-CG 4.18Å; Y1133-Y1150 HydrophobicContact CG-CD2 4.09Å; Y1133-Y1150 AromaticContact CZ-CD2 3.44Å; Y1133-Y1150 VanDerWaalsContact CZ-CD2 3.44Å; Y1133-Y1150 AromaticContact CZ-CG 3.86Å; Y1150-K1152 HydrophobicContact CD1-CG 3.84Å; Y1150-K1152 HydrophobicContact CE1-CG 3.71Å; Y1150-C1159 PolarHBondContact N-O 2.84Å; Y1150-C1159 WeakPolarHBondContact O-CB 3.37Å; Y1150-C1159 PolarHBondContact O-N 2.94Å |
| 1151 | C | 96.6 | Very high | 91.3 | Very high | 0 Ų | 0 | 53.8 Ų | 53.8 | 0% | 0 | 26% | 0.263 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.9 | 125.8 | 178 | -63.8 | 0 | 0 | 0 | 0 | 110.6 | C1119 D1131 D1132 Y1134 A1149 F1153 | C1119-C1151 VanDerWaalsContact CA-SG 3.53Å; C1119-C1151 HydrophobicContact CB-CB 3.42Å; C1119-C1151 VanDerWaalsContact CB-CB 3.42Å; C1119-C1151 WeakPolarHBondContact CB-SG 3.25Å; C1119-C1151 WeakPolarHBondContact SG-CA 3.33Å; C1119-C1151 WeakPolarHBondContact SG-CB 3.46Å; C1119-C1151 CovalentContact SG-SG 2.03Å; C1119-C1151 PolarHBondContact SG-SG 2.7Å; D1131-C1151 CarbonylContact C-O 3.58Å; D1131-C1151 WeakPolarHBondContact CA-O 3.14Å; D1131-C1151 WeakPolarHBondContact CB-O 3.47Å; D1132-C1151 PolarHBondContact N-O 3.47Å; D1132-C1151 PolarHBondContact O-N 3.09Å; Y1134-C1151 HydrophobicContact CD2-CB 3.7Å; Y1134-C1151 HydrophobicContact CE2-CB 4.19Å; A1149-C1151 PolarHBondContact O-N 2.75Å; C1151-F1153 HydrophobicContact CB-CD1 4.32Å; C1151-F1153 HydrophobicContact CB-CD2 4.5Å; C1151-F1153 HydrophobicContact CB-CE1 3.69Å; C1151-F1153 HydrophobicContact CB-CE2 3.9Å; C1151-F1153 HydrophobicContact CB-CZ 3.47Å; C1151-F1153 VanDerWaalsContact CB-CZ 3.47Å |
| 1152 | K | 95.9 | Very high | 91.8 | Very high | 60 Ų | 60 | 49.7 Ų | 49.7 | 26% | 0.261 | 24% | 0.241 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -107.6 | 91.7 | 169.2 | -63.7 | 169.3 | -177.6 | 166.1 | 0 | 108.6 | D1131 Y1150 K1154 T1155 S1156 E1157 C1159 C1306 | D1131-K1152 WeakPolarHBondContact OD1-CA 3.4Å; Y1150-K1152 HydrophobicContact CD1-CG 3.84Å; Y1150-K1152 HydrophobicContact CE1-CG 3.71Å; K1152-K1154 PolarHBondContact O-N 3.25Å; K1152-T1155 VanDerWaalsContact CB-OG1 3.26Å; K1152-T1155 WeakPolarHBondContact CB-OG1 3.47Å; K1152-T1155 CarbonylContact O-C 3.56Å; K1152-T1155 PolarHBondContact O-N 2.91Å; K1152-T1155 VanDerWaalsContact O-N 3.11Å; K1152-T1155 PolarHBondContact O-OG1 2.82Å; K1152-S1156 WeakPolarHBondContact O-CA 3.48Å; K1152-S1156 PolarHBondContact O-N 2.95Å; K1152-E1157 HydrophobicContact CB-CB 4.27Å; K1152-E1157 HydrophobicContact CD-CB 4.17Å; K1152-E1157 WeakPolarHBondContact CD-OE2 3.38Å; K1152-E1157 PolarHBondContact N-O 2.76Å; K1152-E1157 IonicContact NZ-OE2 2.69Å; K1152-E1157 PolarHBondContact NZ-OE2 3.28Å; K1152-E1157 PolarHBondContact O-N 2.83Å; K1152-C1159 WeakPolarHBondContact CE-SG 3.08Å; K1152-C1159 PolarHBondContact NZ-SG 3.05Å; K1152-C1159 VanDerWaalsContact NZ-SG 3.38Å; K1152-C1306 PolarHBondContact NZ-SG 2.77Å |
| 1153 | F | 94.9 | Very high | 92 | Very high | 37 Ų | 37 | 51.2 Ų | 51.2 | 16% | 0.162 | 25% | 0.246 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -67.5 | -24.3 | -174.5 | -59.7 | -64.1 | 0 | 0 | 0 | 112.8 | C1119 L1122 G1123 L1129 P1130 D1131 Y1134 C1151 T1155 | C1119-F1153 WeakPolarHBondContact O-CE1 3.47Å; L1122-F1153 HydrophobicContact CB-CE1 4.01Å; L1122-F1153 HydrophobicContact CD2-CE1 4.04Å; L1122-F1153 HydrophobicContact CD2-CZ 3.8Å; L1122-F1153 HydrophobicContact CG-CE1 3.87Å; L1122-F1153 HydrophobicContact CG-CZ 3.96Å; G1123-F1153 VanDerWaalsContact CA-CD1 3.47Å; L1129-F1153 HydrophobicContact CB-CD2 3.92Å; L1129-F1153 HydrophobicContact CB-CE2 3.4Å; L1129-F1153 HydrophobicContact CB-CZ 3.83Å; L1129-F1153 HydrophobicContact CD1-CE2 4.28Å; L1129-F1153 HydrophobicContact CD1-CZ 3.84Å; L1129-F1153 HydrophobicContact CG-CE2 4.49Å; L1129-F1153 VanDerWaalsContact O-CD2 3.29Å; L1129-F1153 WeakPolarHBondContact O-CD2 3.48Å; P1130-F1153 VanDerWaalsContact O-CE2 3.3Å; P1130-F1153 WeakPolarHBondContact O-CE2 3.49Å; D1131-F1153 PolarHBondContact OD1-N 3.32Å; Y1134-F1153 HydrophobicContact CD2-CE2 4.17Å; Y1134-F1153 AromaticContact CD2-CZ 3.87Å; Y1134-F1153 HydrophobicContact CD2-CZ 3.87Å; Y1134-F1153 AromaticContact CE2-CE2 3.46Å; Y1134-F1153 HydrophobicContact CE2-CE2 3.46Å; Y1134-F1153 VanDerWaalsContact CE2-CE2 3.46Å; Y1134-F1153 AromaticContact CE2-CZ 3.6Å; Y1134-F1153 HydrophobicContact CE2-CZ 3.6Å; Y1134-F1153 AromaticContact CZ-CE2 3.87Å; C1151-F1153 HydrophobicContact CB-CD1 4.32Å; C1151-F1153 HydrophobicContact CB-CD2 4.5Å; C1151-F1153 HydrophobicContact CB-CE1 3.69Å; C1151-F1153 HydrophobicContact CB-CE2 3.9Å; C1151-F1153 HydrophobicContact CB-CZ 3.47Å; C1151-F1153 VanDerWaalsContact CB-CZ 3.47Å; F1153-T1155 VanDerWaalsContact C-N 3.34Å; F1153-T1155 PolarHBondContact O-N 3.17Å |
| 1154 | K | 93 | Very high | 91.7 | Very high | 200 Ų | 200 | 52.7 Ų | 52.7 | 87% | 0.87 | 25% | 0.252 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.5 | -30.4 | 171.4 | -87.3 | -178.4 | 175.9 | 172.3 | 0 | 114.5 | K1152 | K1152-K1154 PolarHBondContact O-N 3.25Š|
| 1155 | T | 93.4 | Very high | 91.2 | Very high | 58 Ų | 58 | 51.9 Ų | 51.9 | 36% | 0.356 | 24% | 0.243 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -108.2 | -6.1 | 178 | 52.2 | 0 | 0 | 0 | 0 | 112.7 | K1152 F1153 E1157 Q1308 | K1152-T1155 VanDerWaalsContact CB-OG1 3.26Å; K1152-T1155 WeakPolarHBondContact CB-OG1 3.47Å; K1152-T1155 CarbonylContact O-C 3.56Å; K1152-T1155 PolarHBondContact O-N 2.91Å; K1152-T1155 VanDerWaalsContact O-N 3.11Å; K1152-T1155 PolarHBondContact O-OG1 2.82Å; F1153-T1155 VanDerWaalsContact C-N 3.34Å; F1153-T1155 PolarHBondContact O-N 3.17Å; T1155-E1157 WeakPolarHBondContact CB-OE2 3.28Å; T1155-E1157 PolarHBondContact O-N 3.19Å; T1155-E1157 WeakPolarHBondContact OG1-CB 3.46Å; T1155-E1157 WeakPolarHBondContact OG1-CG 3.42Å; T1155-E1157 PolarHBondContact OG1-OE2 3.31Å; T1155-Q1308 PolarHBondContact O-NE2 3.44Å |
| 1156 | S | 93.8 | Very high | 90.5 | Very high | 42 Ų | 42 | 52.1 Ų | 52.1 | 29% | 0.294 | 25% | 0.247 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 55.2 | 21.1 | -166.4 | -58.6 | 0 | 0 | 0 | 0 | 114 | K1152 | K1152-S1156 WeakPolarHBondContact O-CA 3.48Å; K1152-S1156 PolarHBondContact O-N 2.95Å |
| 1157 | E | 96.3 | Very high | 89.7 | Confident | 23 Ų | 23 | 52.2 Ų | 52.2 | 11% | 0.107 | 25% | 0.247 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -77.9 | 138.5 | 179.4 | -73.5 | 172.2 | 130.8 | 0 | 0 | 111.4 | K1152 T1155 T1211 C1306 F1307 Q1308 | K1152-E1157 HydrophobicContact CB-CB 4.27Å; K1152-E1157 HydrophobicContact CD-CB 4.17Å; K1152-E1157 WeakPolarHBondContact CD-OE2 3.38Å; K1152-E1157 PolarHBondContact N-O 2.76Å; K1152-E1157 IonicContact NZ-OE2 2.69Å; K1152-E1157 PolarHBondContact NZ-OE2 3.28Å; K1152-E1157 PolarHBondContact O-N 2.83Å; T1155-E1157 WeakPolarHBondContact CB-OE2 3.28Å; T1155-E1157 PolarHBondContact O-N 3.19Å; T1155-E1157 WeakPolarHBondContact OG1-CB 3.46Å; T1155-E1157 WeakPolarHBondContact OG1-CG 3.42Å; T1155-E1157 PolarHBondContact OG1-OE2 3.31Å; E1157-T1211 PolarHBondContact OE1-OG1 2.92Å; E1157-C1306 HydrophobicContact CB-CB 4.19Å; E1157-C1306 HydrophobicContact CG-CB 4.28Å; E1157-F1307 CarbonylContact C-O 3.47Å; E1157-F1307 WeakPolarHBondContact CA-O 3.41Å; E1157-Q1308 HydrophobicContact CG-CB 4.19Å; E1157-Q1308 HydrophobicContact CG-CG 4.48Å |
| 1158 | T | 97.5 | Very high | 88.6 | Confident | 2 Ų | 2 | 54.4 Ų | 54.4 | 1% | 0.012 | 26% | 0.258 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.2 | 111.8 | 167.5 | -55.1 | 0 | 0 | 0 | 0 | 108.7 | C1119 I1136 A1149 L1203 C1306 F1307 | C1119-T1158 WeakPolarHBondContact CB-OG1 3.43Å; C1119-T1158 PolarHBondContact N-OG1 3.15Å; C1119-T1158 VanDerWaalsContact N-OG1 3.13Å; I1136-T1158 HydrophobicContact CD1-CG2 3.41Å; I1136-T1158 VanDerWaalsContact CD1-CG2 3.41Å; A1149-T1158 HydrophobicContact CB-CG2 3.83Å; T1158-L1203 HydrophobicContact CG2-CD1 3.76Å; T1158-L1203 HydrophobicContact CG2-CD2 3.86Å; T1158-L1203 HydrophobicContact CG2-CG 4.48Å; T1158-C1306 CarbonylContact O-C 3.54Å; T1158-C1306 WeakPolarHBondContact O-CA 3.33Å; T1158-F1307 PolarHBondContact N-O 2.97Å; T1158-F1307 PolarHBondContact O-N 3.36Å |
| 1159 | C | 96.5 | Very high | 87.2 | Confident | 1 Ų | 1 | 50.5 Ų | 50.5 | 1% | 0.007 | 24% | 0.24 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -110.4 | 133.6 | -173.3 | -58.5 | 0 | 0 | 0 | 0 | 113.1 | Y1150 K1152 E1304 V1305 C1306 | Y1150-C1159 PolarHBondContact N-O 2.84Å; Y1150-C1159 WeakPolarHBondContact O-CB 3.37Å; Y1150-C1159 PolarHBondContact O-N 2.94Å; K1152-C1159 WeakPolarHBondContact CE-SG 3.08Å; K1152-C1159 PolarHBondContact NZ-SG 3.05Å; K1152-C1159 VanDerWaalsContact NZ-SG 3.38Å; C1159-E1304 HydrophobicContact CB-CB 4.43Å; C1159-V1305 CarbonylContact C-O 3.55Å; C1159-V1305 VanDerWaalsContact CA-O 3.32Å; C1159-V1305 WeakPolarHBondContact CA-O 3.3Å; C1159-C1306 HydrophobicContact CB-CB 4.13Å; C1159-C1306 WeakPolarHBondContact CB-SG 3.44Å; C1159-C1306 WeakPolarHBondContact SG-CB 2.89Å; C1159-C1306 CovalentContact SG-SG 2.04Å; C1159-C1306 PolarHBondContact SG-SG 3.47Å |
| 1160 | I | 94.4 | Very high | 85.3 | Confident | 2 Ų | 2 | 56.2 Ų | 56.2 | 1% | 0.01 | 27% | 0.27 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.4 | 134.9 | -174.2 | -54.3 | -55.1 | 0 | 0 | 0 | 110.3 | A1149 Y1193 L1195 L1203 E1304 V1305 F1307 | A1149-I1160 HydrophobicContact CB-CD1 3.73Å; I1160-Y1193 HydrophobicContact CG2-CD1 4.37Å; I1160-L1195 HydrophobicContact CB-CB 4.43Å; I1160-L1195 HydrophobicContact CD1-CB 4.09Å; I1160-L1195 HydrophobicContact CD1-CD2 3.71Å; I1160-L1195 HydrophobicContact CG1-CB 4.11Å; I1160-L1195 HydrophobicContact CG1-CD2 3.92Å; I1160-L1195 HydrophobicContact CG2-CB 3.47Å; I1160-L1195 VanDerWaalsContact CG2-CB 3.47Å; I1160-L1203 HydrophobicContact CD1-CD2 3.95Å; I1160-L1203 HydrophobicContact CG1-CD2 3.91Å; I1160-E1304 WeakPolarHBondContact O-CA 3.14Å; I1160-E1304 WeakPolarHBondContact O-CB 2.95Å; I1160-V1305 HydrophobicContact CB-CG1 3.81Å; I1160-V1305 HydrophobicContact CG2-CG1 4.45Å; I1160-V1305 PolarHBondContact N-O 2.75Å; I1160-V1305 PolarHBondContact O-N 3.11Å; I1160-F1307 HydrophobicContact CG1-CD2 4.44Å; I1160-F1307 HydrophobicContact CG1-CE2 4.25Å |
| 1161 | R | 89.2 | Confident | 83 | Confident | 79 Ų | 79 | 57.8 Ų | 57.8 | 30% | 0.298 | 28% | 0.276 | S | S | . | . | trans | -78.4 | 151.8 | 177.3 | -84.7 | 176.1 | 173.6 | 178.4 | 4.1 | 113.9 | Y1133 Y1193 E1194 E1304 | Y1133-R1161 HydrophobicContact CE1-CG 4.41Å; Y1133-R1161 VanDerWaalsContact CZ-NE 3.3Å; Y1133-R1161 VanDerWaalsContact OH-CZ 3.27Å; Y1133-R1161 PolarHBondContact OH-NE 3.06Å; Y1133-R1161 PolarHBondContact OH-NH2 3.01Å; R1161-Y1193 CarbonylContact O-C 3.58Å; R1161-Y1193 WeakPolarHBondContact O-CA 3.37Å; R1161-E1194 HydrophobicContact CB-CG 4Å; R1161-E1194 WeakPolarHBondContact CB-OE1 3.4Å; R1161-E1194 WeakPolarHBondContact CB-OE2 3.27Å; R1161-E1194 WeakPolarHBondContact CD-OE1 3.26Å; R1161-E1194 PolarHBondContact O-N 3.11Å; R1161-E1304 VanDerWaalsContact CG-CD 3.47Å; R1161-E1304 HydrophobicContact CG-CG 4.04Å; R1161-E1304 WeakPolarHBondContact CG-OE1 2.92Å; R1161-E1304 IonicContact NE-OE1 3.22Å; R1161-E1304 PolarHBondContact NE-OE1 2.8Å; R1161-E1304 VanDerWaalsContact NE-OE1 3.16Å | ||
| 1162 | L | 88.9 | Confident | 80.4 | Confident | 5 Ų | 5 | 62.9 Ų | 62.9 | 3% | 0.026 | 31% | 0.309 | C | S | . | . | B | Isolated β-bridge | trans | -83.3 | 142.8 | 158.2 | -73.6 | 88.5 | 0 | 0 | 0 | 110.6 | Q1164 L1191 I1192 Y1193 I1302 | L1162-Q1164 VanDerWaalsContact CB-O 3.31Å; L1162-Q1164 WeakPolarHBondContact CB-O 3.37Å; L1162-Q1164 PolarHBondContact O-N 3.04Å; L1162-L1191 HydrophobicContact CD2-CB 3.86Å; L1162-L1191 HydrophobicContact CD2-CD1 4.17Å; L1162-L1191 HydrophobicContact CD2-CD2 3.78Å; L1162-L1191 HydrophobicContact CD2-CG 4.15Å; L1162-I1192 WeakPolarHBondContact CA-O 3.49Å; L1162-Y1193 HydrophobicContact CD1-CD1 4.03Å; L1162-Y1193 HydrophobicContact CD1-CE1 3.34Å; L1162-Y1193 HydrophobicContact CD2-CE1 4.29Å; L1162-Y1193 HydrophobicContact CD2-CE2 4.4Å; L1162-Y1193 HydrophobicContact CG-CD1 3.87Å; L1162-Y1193 HydrophobicContact CG-CE1 3.48Å; L1162-Y1193 VanDerWaalsContact CG-CE1 3.48Å; L1162-Y1193 HydrophobicContact CG-CE2 4.25Å; L1162-Y1193 HydrophobicContact CG-CG 4.42Å; L1162-I1302 HydrophobicContact CD1-CB 4.09Å; L1162-I1302 HydrophobicContact CD1-CG2 3.57Å; L1162-I1302 HydrophobicContact CD2-CB 3.85Å; L1162-I1302 HydrophobicContact CD2-CG1 4.3Å; L1162-I1302 HydrophobicContact CD2-CG2 3.71Å; L1162-I1302 HydrophobicContact CG-CG2 4.31Å |
| 1163 | K | 85.4 | Confident | 77.6 | Confident | 116 Ų | 116 | 66 Ų | 66 | 50% | 0.504 | 33% | 0.329 | S | S | . | . | S | Bend | trans | -67.3 | -23.6 | 169.7 | -63.2 | -177.9 | 179.4 | 118.3 | 0 | 112 | I1192 Y1193 E1194 E1196 | K1163-I1192 HydrophobicContact CD-CG2 3.85Å; K1163-I1192 PolarHBondContact N-O 3.45Å; K1163-Y1193 WeakPolarHBondContact CE-O 3.4Å; K1163-Y1193 PolarHBondContact NZ-O 3.26Å; K1163-E1194 HydrophobicContact CG-CG 4.14Å; K1163-E1196 IonicContact NZ-OE2 3.16Å; K1163-E1196 PolarHBondContact NZ-OE2 3.21Å |
| 1164 | Q | 75.3 | Confident | 74.9 | Confident | 120 Ų | 120 | 72.1 Ų | 72.1 | 56% | 0.561 | 35% | 0.351 | S | S | * | . | trans | -125.9 | 112.5 | 168.9 | -71.2 | -179 | -63.9 | 0 | 0 | 110 | L1162 | L1162-Q1164 VanDerWaalsContact CB-O 3.31Å; L1162-Q1164 WeakPolarHBondContact CB-O 3.37Å; L1162-Q1164 PolarHBondContact O-N 3.04Å | ||
| 1165 | K | 69 | Low | 72.3 | Confident | 94 Ų | 94 | 70.4 Ų | 70.4 | 41% | 0.409 | 35% | 0.346 | S | S | . | . | trans | -80.6 | -16.3 | -179.2 | -70.5 | -164.1 | 168.8 | -163.4 | 0 | 114.6 | Q1301 I1302 E1304 | K1165-Q1301 WeakPolarHBondContact O-CA 3.5Å; K1165-I1302 PolarHBondContact O-N 3.21Å; K1165-E1304 IonicContact NZ-OE1 2.75Å; K1165-E1304 PolarHBondContact NZ-OE1 3.48Å | ||
| 1166 | T | 74.2 | Confident | 69.4 | Low | 74 Ų | 74 | 75.3 Ų | 75.3 | 45% | 0.454 | 37% | 0.37 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -139.2 | 130.7 | -167.9 | -31.8 | 0 | 0 | 0 | 0 | 112 | L1299 V1300 Q1301 | T1166-L1299 HydrophobicContact CG2-CD1 3.51Å; T1166-L1299 HydrophobicContact CG2-CD2 4.46Å; T1166-L1299 HydrophobicContact CG2-CG 3.86Å; T1166-V1300 WeakPolarHBondContact CA-O 3.41Å; T1166-Q1301 HydrophobicContact CG2-CG 4.18Å |
| 1167 | L | 73.1 | Confident | 66.6 | Low | 11 Ų | 11 | 76.6 Ų | 76.6 | 6% | 0.058 | 38% | 0.379 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.4 | 147.8 | 170 | -55.7 | 175.6 | 0 | 0 | 0 | 109.1 | Y1189 L1191 I1288 L1299 V1300 I1302 | L1167-Y1189 HydrophobicContact CD1-CD1 4.31Å; L1167-Y1189 HydrophobicContact CD1-CD2 4.15Å; L1167-Y1189 HydrophobicContact CD1-CG 3.78Å; L1167-Y1189 HydrophobicContact CD2-CD1 3.67Å; L1167-Y1189 HydrophobicContact CD2-CE1 4.29Å; L1167-Y1189 HydrophobicContact CD2-CG 4Å; L1167-Y1189 HydrophobicContact CG-CD1 4.4Å; L1167-Y1189 HydrophobicContact CG-CG 4.35Å; L1167-L1191 HydrophobicContact CD1-CD2 4.05Å; L1167-I1288 HydrophobicContact CD1-CB 4.29Å; L1167-I1288 HydrophobicContact CD1-CD1 4.32Å; L1167-L1299 CarbonylContact O-C 3.59Å; L1167-L1299 WeakPolarHBondContact O-CA 3.1Å; L1167-V1300 HydrophobicContact CB-CB 4.4Å; L1167-V1300 PolarHBondContact N-O 3.33Å; L1167-V1300 PolarHBondContact O-N 3.14Å; L1167-I1302 HydrophobicContact CD1-CD1 3.97Å; L1167-I1302 HydrophobicContact CG-CD1 3.81Å |
| 1168 | N | 69 | Low | 63.8 | Low | 72 Ų | 72 | 82 Ų | 82 | 39% | 0.385 | 41% | 0.414 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -141.2 | 129.9 | -178.1 | -169.8 | 6.2 | 0 | 0 | 0 | 110.4 | N1170 Y1189 L1299 | N1168-N1170 PolarHBondContact O-N 3.32Å; N1168-Y1189 PolarHBondContact O-OH 3.47Å; N1168-Y1189 VanDerWaalsContact O-OH 3.09Å; N1168-L1299 HydrophobicContact CB-CD1 3.92Å |
| 1169 | S | 64.7 | Low | 60.8 | Low | 2 Ų | 2 | 91 Ų | 91 | 1% | 0.014 | 46% | 0.456 | C | S | . | . | trans | -77.5 | 49 | -178.2 | 68.4 | 0 | 0 | 0 | 0 | 113.2 | Y1171 S1296 N1298 | S1169-Y1171 PolarHBondContact O-N 3.14Å; S1169-S1296 PolarHBondContact OG-O 3.26Å; S1169-N1298 PolarHBondContact N-O 3.34Å; S1169-N1298 VanDerWaalsContact N-O 3.14Å; S1169-N1298 PolarHBondContact OG-N 3.36Å | ||
| 1170 | N | 53.8 | Low | 58.2 | Low | 120 Ų | 120 | 95.8 Ų | 95.8 | 64% | 0.642 | 48% | 0.478 | S | S | * | . | trans | -79.6 | 67 | -169.9 | -145.7 | 8.9 | 0 | 0 | 0 | 111.9 | N1168 | N1168-N1170 PolarHBondContact O-N 3.32Š| ||
| 1171 | Y | 48.8 | Very low | 55.6 | Low | 95 Ų | 95 | 104.8 Ų | 104.8 | 37% | 0.373 | 52% | 0.52 | S | S | . | . | trans | -67.3 | 119.7 | 170.2 | -119.6 | -96.4 | 0 | 0 | 0 | 108.6 | S1169 N1173 P1293 | S1169-Y1171 PolarHBondContact O-N 3.14Å; Y1171-N1173 PolarHBondContact O-N 3.22Å; Y1171-P1293 HydrophobicContact CD2-CB 4.27Å; Y1171-P1293 HydrophobicContact CD2-CG 4.08Å; Y1171-P1293 HydrophobicContact CE2-CG 4.06Å | ||
| 1172 | P | 40.5 | Very low | 53.5 | Low | 107 Ų | 107 | 108.6 Ų | 108.6 | 70% | 0.695 | 55% | 0.547 | S | S | * | . | trans | -65.2 | 131.4 | 178.7 | 26.3 | -33.2 | 0 | 0 | 0 | 109.8 | R1174 | P1172-R1174 VanDerWaalsContact C-N 3.34Å; P1172-R1174 PolarHBondContact O-N 3.38Å | ||
| 1173 | N | 38.9 | Very low | 51.3 | Low | 126 Ų | 126 | 112.8 Ų | 112.8 | 67% | 0.674 | 57% | 0.569 | S | S | * | * | trans | -59.7 | 94.6 | 174 | -80.5 | 0.4 | 0 | 0 | 0 | 109.7 | Y1171 E1175 | Y1171-N1173 PolarHBondContact O-N 3.22Å; N1173-E1175 PolarHBondContact O-N 3.15Å; N1173-E1175 VanDerWaalsContact O-N 3.09Å | ||
| 1174 | R | 37.1 | Very low | 49.9 | Very low | 166 Ų | 166 | 111.1 Ų | 111.1 | 63% | 0.626 | 57% | 0.565 | S | S | * | * | trans | -85.6 | 74.1 | 171.7 | -131 | -175.7 | -173.9 | -136.7 | -1.2 | 109.1 | P1172 N1176 | P1172-R1174 VanDerWaalsContact C-N 3.34Å; P1172-R1174 PolarHBondContact O-N 3.38Å; R1174-N1176 PolarHBondContact O-N 3.28Å | ||
| 1175 | E | 38.6 | Very low | 49 | Very low | 163 Ų | 163 | 106.7 Ų | 106.7 | 76% | 0.762 | 55% | 0.552 | S | S | * | * | S | Bend | trans | -49.1 | 135.2 | 154 | -66 | 174.2 | -168.6 | 0 | 0 | 107.7 | N1173 | N1173-E1175 PolarHBondContact O-N 3.15Å; N1173-E1175 VanDerWaalsContact O-N 3.09Å |
| 1176 | N | 32.9 | Very low | 49.2 | Very low | 161 Ų | 161 | 105.1 Ų | 105.1 | 86% | 0.861 | 55% | 0.553 | S | S | * | * | trans | 65.2 | 62.5 | -168.1 | -54 | -35.6 | 0 | 0 | 0 | 115.9 | R1174 | R1174-N1176 PolarHBondContact O-N 3.28Š| ||
| 1177 | S | 33.8 | Very low | 49.2 | Very low | 70 Ų | 70 | 104.5 Ų | 104.5 | 49% | 0.49 | 54% | 0.544 | S | S | . | . | trans | -133.1 | 89 | 140.3 | 64 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 1178 | T | 37.6 | Very low | 49.7 | Very low | 135 Ų | 135 | 109.6 Ų | 109.6 | 83% | 0.828 | 57% | 0.566 | S | S | * | * | trans | -55.4 | 146.6 | 151.1 | 46.8 | 0 | 0 | 0 | 0 | 109 | ||||
| 1179 | E | 36.1 | Very low | 50.5 | Low | 191 Ų | 191 | 108.3 Ų | 108.3 | 89% | 0.893 | 56% | 0.556 | S | S | * | * | S | Bend | trans | 71.8 | 56.5 | -175.4 | -51.2 | -169.1 | 163.7 | 0 | 0 | 117.1 | ||
| 1180 | E | 40.3 | Very low | 51.6 | Low | 103 Ų | 103 | 114.1 Ų | 114.1 | 48% | 0.481 | 58% | 0.583 | S | S | . | * | trans | -157.3 | 39.5 | 143.3 | -131.7 | -158.5 | -173.1 | 0 | 0 | 115.9 | N1182 N1183 K1294 | E1180-N1182 PolarHBondContact O-N 3.03Å; E1180-N1182 VanDerWaalsContact O-N 3.13Å; E1180-N1183 HydrophobicContact CG-CB 3.98Å; E1180-N1183 PolarHBondContact O-N 3.28Å; E1180-N1183 WeakPolarHBondContact OE1-CB 3.18Å; E1180-N1183 PolarHBondContact OE1-ND2 3.24Å; E1180-K1294 IonicContact OE2-NZ 2.68Å; E1180-K1294 PolarHBondContact OE2-NZ 3.2Å | ||
| 1181 | E | 40.8 | Very low | 53.3 | Low | 191 Ų | 191 | 108.5 Ų | 108.5 | 89% | 0.893 | 55% | 0.553 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.5 | -17.1 | -172.2 | -115.2 | 178.3 | 142.1 | 0 | 0 | 115.8 | ||
| 1182 | N | 43.9 | Very low | 55.1 | Low | 159 Ų | 159 | 107.2 Ų | 107.2 | 85% | 0.85 | 55% | 0.552 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106.9 | -3.3 | -174.7 | -74 | -66.5 | 0 | 0 | 0 | 115 | E1180 L1184 | E1180-N1182 PolarHBondContact O-N 3.03Å; E1180-N1182 VanDerWaalsContact O-N 3.13Å; N1182-L1184 PolarHBondContact O-N 3.27Å |
| 1183 | N | 44.4 | Very low | 57.5 | Low | 93 Ų | 93 | 102.1 Ų | 102.1 | 50% | 0.497 | 52% | 0.519 | S | S | . | . | trans | -95.3 | 85.7 | -179 | -123.4 | -8.8 | 0 | 0 | 0 | 110.9 | E1180 G1185 K1294 | E1180-N1183 HydrophobicContact CG-CB 3.98Å; E1180-N1183 PolarHBondContact O-N 3.28Å; E1180-N1183 WeakPolarHBondContact OE1-CB 3.18Å; E1180-N1183 PolarHBondContact OE1-ND2 3.24Å; N1183-G1185 PolarHBondContact O-N 3.01Å; N1183-K1294 WeakPolarHBondContact O-CE 3.17Å; N1183-K1294 PolarHBondContact O-NZ 3.42Å | ||
| 1184 | L | 55.4 | Low | 59.8 | Low | 81 Ų | 81 | 100.3 Ų | 100.3 | 42% | 0.424 | 51% | 0.506 | S | S | . | . | trans | -70.4 | 72.1 | 162 | -94.8 | 55.7 | 0 | 0 | 0 | 108.6 | N1182 N1292 I1295 | N1182-L1184 PolarHBondContact O-N 3.27Å; L1184-N1292 WeakPolarHBondContact CB-OD1 3.45Å; L1184-N1292 HydrophobicContact CD2-CB 4.5Å; L1184-N1292 WeakPolarHBondContact CD2-OD1 3.4Å; L1184-N1292 HydrophobicContact CG-CB 4.44Å; L1184-I1295 HydrophobicContact CD1-CD1 4.01Å; L1184-I1295 HydrophobicContact CD2-CD1 3.95Å; L1184-I1295 HydrophobicContact CG-CD1 3.97Å | ||
| 1185 | G | 57.2 | Low | 62.2 | Low | 27 Ų | 27 | 92.5 Ų | 92.5 | 28% | 0.278 | 48% | 0.477 | S | S | . | . | trans | -64.1 | 151.1 | 177 | 0 | 0 | 0 | 0 | 0 | 111.6 | N1183 P1293 | N1183-G1185 PolarHBondContact O-N 3.01Å; G1185-P1293 WeakPolarHBondContact O-CD 3.26Å | ||
| 1186 | S | 71.6 | Confident | 64.4 | Low | 61 Ų | 61 | 88 Ų | 88 | 43% | 0.427 | 46% | 0.456 | S | S | . | . | trans | -99.9 | 163.7 | 171.2 | 59.9 | 0 | 0 | 0 | 0 | 111.6 | E1289 L1290 | S1186-E1289 WeakPolarHBondContact CB-OE1 3.14Å; S1186-E1289 PolarHBondContact OG-OE1 3.37Å; S1186-L1290 CarbonylContact C-O 3.6Å; S1186-L1290 VanDerWaalsContact CA-O 3.25Å; S1186-L1290 WeakPolarHBondContact CA-O 3.21Å; S1186-L1290 WeakPolarHBondContact CB-O 3.1Å | ||
| 1187 | Q | 75.6 | Confident | 67 | Low | 61 Ų | 61 | 82.7 Ų | 82.7 | 29% | 0.285 | 44% | 0.439 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.8 | 108.1 | 179 | -166.1 | 168.6 | -0.8 | 0 | 0 | 110.6 | Y1189 L1290 | Q1187-Y1189 HydrophobicContact CB-CE2 4.08Å; Q1187-Y1189 VanDerWaalsContact CD-OH 3.27Å; Q1187-Y1189 HydrophobicContact CG-CD2 4.46Å; Q1187-Y1189 HydrophobicContact CG-CE2 3.67Å; Q1187-Y1189 PolarHBondContact NE2-OH 3.25Å; Q1187-Y1189 WeakPolarHBondContact O-CD2 3.44Å; Q1187-L1290 PolarHBondContact N-O 3.46Å; Q1187-L1290 PolarHBondContact O-N 3.33Å |
| 1188 | F | 83.5 | Confident | 69.6 | Low | 118 Ų | 118 | 85 Ų | 85 | 52% | 0.518 | 45% | 0.446 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.2 | 138.9 | 178.7 | -173.6 | -85.8 | 0 | 0 | 0 | 111.6 | E1190 F1240 I1288 E1289 | F1188-E1190 HydrophobicContact CE1-CB 4.34Å; F1188-F1240 HydrophobicContact CD2-CD2 4.48Å; F1188-F1240 HydrophobicContact CD2-CE2 4.33Å; F1188-F1240 AromaticContact CE2-CD2 3.83Å; F1188-F1240 HydrophobicContact CE2-CD2 3.83Å; F1188-F1240 HydrophobicContact CE2-CE2 4.08Å; F1188-F1240 HydrophobicContact CE2-CG 4.35Å; F1188-I1288 CarbonylContact C-O 3.59Å; F1188-I1288 WeakPolarHBondContact CA-O 3.34Å; F1188-E1289 HydrophobicContact CD2-CB 4.2Å |
| 1189 | Y | 85.7 | Confident | 72.2 | Confident | 45 Ų | 45 | 78.9 Ų | 78.9 | 18% | 0.176 | 41% | 0.408 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.8 | 128.7 | 174.8 | -62.5 | -98.1 | 0 | 0 | 0 | 109.7 | L1167 N1168 Q1187 G1287 I1288 L1290 | L1167-Y1189 HydrophobicContact CD1-CD1 4.31Å; L1167-Y1189 HydrophobicContact CD1-CD2 4.15Å; L1167-Y1189 HydrophobicContact CD1-CG 3.78Å; L1167-Y1189 HydrophobicContact CD2-CD1 3.67Å; L1167-Y1189 HydrophobicContact CD2-CE1 4.29Å; L1167-Y1189 HydrophobicContact CD2-CG 4Å; L1167-Y1189 HydrophobicContact CG-CD1 4.4Å; L1167-Y1189 HydrophobicContact CG-CG 4.35Å; N1168-Y1189 PolarHBondContact O-OH 3.47Å; N1168-Y1189 VanDerWaalsContact O-OH 3.09Å; Q1187-Y1189 HydrophobicContact CB-CE2 4.08Å; Q1187-Y1189 VanDerWaalsContact CD-OH 3.27Å; Q1187-Y1189 HydrophobicContact CG-CD2 4.46Å; Q1187-Y1189 HydrophobicContact CG-CE2 3.67Å; Q1187-Y1189 PolarHBondContact NE2-OH 3.25Å; Q1187-Y1189 WeakPolarHBondContact O-CD2 3.44Å; Y1189-G1287 WeakPolarHBondContact O-CA 3.5Å; Y1189-I1288 PolarHBondContact N-O 3.45Å; Y1189-I1288 PolarHBondContact O-N 2.82Å; Y1189-L1290 HydrophobicContact CD2-CD1 4.36Å; Y1189-L1290 HydrophobicContact CD2-CG 4.18Å; Y1189-L1290 HydrophobicContact CE2-CD1 3.57Å; Y1189-L1290 HydrophobicContact CE2-CG 3.78Å |
| 1190 | E | 87.8 | Confident | 74.9 | Confident | 123 Ų | 123 | 70.1 Ų | 70.1 | 58% | 0.575 | 37% | 0.368 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -83.8 | 136.4 | 171.1 | -174.4 | 171.7 | -165.9 | 0 | 0 | 110.6 | F1188 R1286 | F1188-E1190 HydrophobicContact CE1-CB 4.34Å; E1190-R1286 CarbonylContact C-O 3.11Å; E1190-R1286 WeakPolarHBondContact CA-O 3.22Å |
| 1191 | L | 88.8 | Confident | 77.3 | Confident | 3 Ų | 3 | 69.9 Ų | 69.9 | 2% | 0.016 | 37% | 0.366 | C | S | . | . | trans | -98.9 | 120.5 | -179.5 | -61.6 | -177.5 | 0 | 0 | 0 | 110.5 | L1162 L1167 Y1193 I1285 R1286 I1288 I1302 | L1162-L1191 HydrophobicContact CD2-CB 3.86Å; L1162-L1191 HydrophobicContact CD2-CD1 4.17Å; L1162-L1191 HydrophobicContact CD2-CD2 3.78Å; L1162-L1191 HydrophobicContact CD2-CG 4.15Å; L1167-L1191 HydrophobicContact CD1-CD2 4.05Å; L1191-Y1193 HydrophobicContact CB-CE2 3.78Å; L1191-I1285 HydrophobicContact CD1-CB 4.26Å; L1191-I1285 HydrophobicContact CD1-CG2 3.99Å; L1191-I1285 WeakPolarHBondContact CD1-O 3.4Å; L1191-R1286 PolarHBondContact N-O 3.16Å; L1191-R1286 WeakPolarHBondContact O-CD 3.42Å; L1191-R1286 PolarHBondContact O-NH1 3.43Å; L1191-I1288 HydrophobicContact CD1-CD1 3.97Å; L1191-I1288 HydrophobicContact CD1-CG1 3.91Å; L1191-I1288 HydrophobicContact CD2-CD1 4.38Å; L1191-I1288 HydrophobicContact CD2-CG1 4.5Å; L1191-I1288 HydrophobicContact CG-CG1 4.37Å; L1191-I1302 HydrophobicContact CD1-CG1 4.23Å; L1191-I1302 HydrophobicContact CD1-CG2 4.16Å; L1191-I1302 HydrophobicContact CD2-CD1 3.93Å; L1191-I1302 HydrophobicContact CD2-CG1 3.98Å | ||
| 1192 | I | 87.7 | Confident | 79.9 | Confident | 67 Ų | 67 | 65.8 Ų | 65.8 | 34% | 0.344 | 34% | 0.343 | S | S | . | . | trans | -109.7 | 131.7 | -178.2 | -48.7 | 179.1 | 0 | 0 | 0 | 109.9 | L1162 K1163 E1196 | L1162-I1192 WeakPolarHBondContact CA-O 3.49Å; K1163-I1192 HydrophobicContact CD-CG2 3.85Å; K1163-I1192 PolarHBondContact N-O 3.45Å; I1192-E1196 WeakPolarHBondContact CG2-OE2 3.38Å | ||
| 1193 | Y | 90.2 | Very high | 82.3 | Confident | 1 Ų | 1 | 58.2 Ų | 58.2 | 0% | 0.004 | 30% | 0.303 | C | S | . | . | B | Isolated β-bridge | trans | -108 | 160.3 | -172.9 | -68 | -99.3 | 0 | 0 | 0 | 111.7 | I1160 R1161 L1162 K1163 L1191 L1195 Q1212 P1284 I1285 V1305 | I1160-Y1193 HydrophobicContact CG2-CD1 4.37Å; R1161-Y1193 CarbonylContact O-C 3.58Å; R1161-Y1193 WeakPolarHBondContact O-CA 3.37Å; L1162-Y1193 HydrophobicContact CD1-CD1 4.03Å; L1162-Y1193 HydrophobicContact CD1-CE1 3.34Å; L1162-Y1193 HydrophobicContact CD2-CE1 4.29Å; L1162-Y1193 HydrophobicContact CD2-CE2 4.4Å; L1162-Y1193 HydrophobicContact CG-CD1 3.87Å; L1162-Y1193 HydrophobicContact CG-CE1 3.48Å; L1162-Y1193 VanDerWaalsContact CG-CE1 3.48Å; L1162-Y1193 HydrophobicContact CG-CE2 4.25Å; L1162-Y1193 HydrophobicContact CG-CG 4.42Å; K1163-Y1193 WeakPolarHBondContact CE-O 3.4Å; K1163-Y1193 PolarHBondContact NZ-O 3.26Å; L1191-Y1193 HydrophobicContact CB-CE2 3.78Å; Y1193-L1195 VanDerWaalsContact C-N 3.29Å; Y1193-Q1212 PolarHBondContact OH-NE2 3.24Å; Y1193-P1284 HydrophobicContact CD1-CB 4.26Å; Y1193-P1284 HydrophobicContact CD2-CB 3.93Å; Y1193-P1284 HydrophobicContact CD2-CG 3.87Å; Y1193-P1284 HydrophobicContact CE1-CB 3.78Å; Y1193-P1284 HydrophobicContact CE2-CB 3.45Å; Y1193-P1284 VanDerWaalsContact CE2-CB 3.45Å; Y1193-P1284 HydrophobicContact CE2-CG 3.79Å; Y1193-P1284 HydrophobicContact CG-CB 4.33Å; Y1193-P1284 HydrophobicContact CG-CG 4.39Å; Y1193-I1285 VanDerWaalsContact CE2-O 3.28Å; Y1193-I1285 WeakPolarHBondContact CE2-O 3.44Å; Y1193-I1285 PolarHBondContact OH-O 2.89Å; Y1193-V1305 HydrophobicContact CD1-CG1 3.71Å; Y1193-V1305 HydrophobicContact CE1-CB 4.1Å; Y1193-V1305 HydrophobicContact CE1-CG1 3.58Å |
| 1194 | E | 87.1 | Confident | 84.7 | Confident | 87 Ų | 87 | 54.4 Ų | 54.4 | 41% | 0.407 | 28% | 0.282 | S | S | . | . | S | Bend | trans | -67.8 | -32.7 | 171.7 | -71.4 | 176.3 | -168.3 | 0 | 0 | 111.2 | R1161 K1163 | R1161-E1194 HydrophobicContact CB-CG 4Å; R1161-E1194 WeakPolarHBondContact CB-OE1 3.4Å; R1161-E1194 WeakPolarHBondContact CB-OE2 3.27Å; R1161-E1194 WeakPolarHBondContact CD-OE1 3.26Å; R1161-E1194 PolarHBondContact O-N 3.11Å; K1163-E1194 HydrophobicContact CG-CG 4.14Å |
| 1195 | L | 87.7 | Confident | 86.5 | Confident | 3 Ų | 3 | 55.7 Ų | 55.7 | 2% | 0.016 | 28% | 0.282 | C | S | . | . | S | Bend | trans | -101 | 123.4 | 173.4 | -165.4 | 62 | 0 | 0 | 0 | 112.1 | V1147 I1160 Y1193 Q1199 L1200 L1203 | V1147-L1195 HydrophobicContact CB-CD1 3.88Å; V1147-L1195 HydrophobicContact CG1-CD1 3.55Å; V1147-L1195 HydrophobicContact CG2-CD1 3.56Å; I1160-L1195 HydrophobicContact CB-CB 4.43Å; I1160-L1195 HydrophobicContact CD1-CB 4.09Å; I1160-L1195 HydrophobicContact CD1-CD2 3.71Å; I1160-L1195 HydrophobicContact CG1-CB 4.11Å; I1160-L1195 HydrophobicContact CG1-CD2 3.92Å; I1160-L1195 HydrophobicContact CG2-CB 3.47Å; I1160-L1195 VanDerWaalsContact CG2-CB 3.47Å; Y1193-L1195 VanDerWaalsContact C-N 3.29Å; L1195-Q1199 HydrophobicContact CD1-CB 3.44Å; L1195-Q1199 VanDerWaalsContact CD1-CB 3.44Å; L1195-Q1199 HydrophobicContact CD1-CG 4.49Å; L1195-Q1199 HydrophobicContact CG-CB 4.32Å; L1195-L1200 HydrophobicContact CD2-CB 4.31Å; L1195-L1200 HydrophobicContact CD2-CD1 4.13Å; L1195-L1200 HydrophobicContact CG-CB 4.03Å; L1195-L1200 HydrophobicContact CG-CD1 4.39Å; L1195-L1203 HydrophobicContact CD2-CB 4.21Å; L1195-L1203 HydrophobicContact CD2-CD2 3.58Å |
| 1196 | E | 85.5 | Confident | 88.2 | Confident | 68 Ų | 68 | 58 Ų | 58 | 32% | 0.318 | 29% | 0.285 | S | S | . | . | trans | -144 | 167.8 | 178.5 | -58.3 | -171.1 | 109.6 | 0 | 0 | 110.9 | K1163 I1192 R1286 | K1163-E1196 IonicContact NZ-OE2 3.16Å; K1163-E1196 PolarHBondContact NZ-OE2 3.21Å; I1192-E1196 WeakPolarHBondContact CG2-OE2 3.38Å; E1196-R1286 IonicContact OE1-CZ 2.71Å; E1196-R1286 VanDerWaalsContact OE1-CZ 3.22Å; E1196-R1286 IonicContact OE1-NH1 2.84Å; E1196-R1286 PolarHBondContact OE1-NH1 3Å; E1196-R1286 IonicContact OE1-NH2 2.93Å; E1196-R1286 PolarHBondContact OE1-NH2 3.02Å | ||
| 1197 | G | 87.1 | Confident | 89.4 | Confident | 49 Ų | 49 | 55.5 Ų | 55.5 | 51% | 0.505 | 27% | 0.268 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 64.3 | -142.4 | 177.2 | 0 | 0 | 0 | 0 | 0 | 114 | Q1199 L1200 E1201 | G1197-Q1199 PolarHBondContact O-N 3.39Å; G1197-L1200 WeakPolarHBondContact O-CB 3.43Å; G1197-L1200 PolarHBondContact O-N 3.14Å; G1197-L1200 VanDerWaalsContact O-N 3.1Å; G1197-E1201 PolarHBondContact O-N 3.15Å |
| 1198 | N | 87.7 | Confident | 90.2 | Very high | 119 Ų | 119 | 59.7 Ų | 59.7 | 64% | 0.636 | 29% | 0.292 | S | S | * | . | H | α-helix | trans | -55.5 | -48 | -172.5 | -69.1 | -2 | 0 | 0 | 0 | 112.9 | L1200 E1201 Y1202 | N1198-L1200 PolarHBondContact O-N 2.97Å; N1198-E1201 PolarHBondContact O-N 3.17Å; N1198-Y1202 WeakPolarHBondContact O-CD2 3.4Å; N1198-Y1202 PolarHBondContact O-N 3.14Å |
| 1199 | Q | 91.7 | Very high | 90.7 | Very high | 7 Ų | 7 | 56.9 Ų | 56.9 | 3% | 0.033 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -59.8 | -30.1 | -178.5 | -71.4 | -72.6 | 22.1 | 0 | 0 | 112.5 | D1137 P1138 N1139 D1145 L1195 G1197 L1203 | D1137-Q1199 PolarHBondContact OD1-NE2 2.94Å; P1138-Q1199 WeakPolarHBondContact CB-O 3.46Å; N1139-Q1199 VanDerWaalsContact CG-CD 3.47Å; N1139-Q1199 PolarHBondContact ND2-NE2 3.01Å; N1139-Q1199 PolarHBondContact ND2-OE1 3.45Å; D1145-Q1199 PolarHBondContact OD1-NE2 3.14Å; L1195-Q1199 HydrophobicContact CD1-CB 3.44Å; L1195-Q1199 VanDerWaalsContact CD1-CB 3.44Å; L1195-Q1199 HydrophobicContact CD1-CG 4.49Å; L1195-Q1199 HydrophobicContact CG-CB 4.32Å; G1197-Q1199 PolarHBondContact O-N 3.39Å; Q1199-L1203 WeakPolarHBondContact O-CB 3.36Å; Q1199-L1203 PolarHBondContact O-N 3Å; Q1199-L1203 VanDerWaalsContact O-N 3.1Å |
| 1200 | L | 92.5 | Very high | 91.1 | Very high | 7 Ų | 7 | 54.7 Ų | 54.7 | 4% | 0.037 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -72.3 | -42.6 | 173.4 | -178.2 | 62 | 0 | 0 | 0 | 112.6 | L1195 G1197 N1198 L1203 K1204 P1284 F1307 | L1195-L1200 HydrophobicContact CD2-CB 4.31Å; L1195-L1200 HydrophobicContact CD2-CD1 4.13Å; L1195-L1200 HydrophobicContact CG-CB 4.03Å; L1195-L1200 HydrophobicContact CG-CD1 4.39Å; G1197-L1200 WeakPolarHBondContact O-CB 3.43Å; G1197-L1200 PolarHBondContact O-N 3.14Å; G1197-L1200 VanDerWaalsContact O-N 3.1Å; N1198-L1200 PolarHBondContact O-N 2.97Å; L1200-L1203 PolarHBondContact O-N 3.11Å; L1200-K1204 WeakPolarHBondContact O-CG 3.39Å; L1200-K1204 PolarHBondContact O-N 3.22Å; L1200-P1284 HydrophobicContact CD2-CG 4.2Å; L1200-F1307 HydrophobicContact CD1-CE2 4.05Å; L1200-F1307 HydrophobicContact CD1-CZ 3.87Å |
| 1201 | E | 92.4 | Very high | 91.5 | Very high | 98 Ų | 98 | 49.5 Ų | 49.5 | 46% | 0.458 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -70.2 | -34.5 | 178.6 | -62.7 | -55 | 137.3 | 0 | 0 | 112.5 | G1197 N1198 K1204 Y1205 | G1197-E1201 PolarHBondContact O-N 3.15Å; N1198-E1201 PolarHBondContact O-N 3.17Å; E1201-K1204 WeakPolarHBondContact O-CB 3.41Å; E1201-K1204 PolarHBondContact O-N 3.31Å; E1201-K1204 IonicContact OE1-NZ 2.73Å; E1201-K1204 PolarHBondContact OE1-NZ 3.29Å; E1201-K1204 VanDerWaalsContact OE2-CD 3.25Å; E1201-K1204 WeakPolarHBondContact OE2-CD 3.47Å; E1201-K1204 IonicContact OE2-NZ 3.34Å; E1201-K1204 PolarHBondContact OE2-NZ 3.25Å; E1201-Y1205 PolarHBondContact O-N 3.07Å |
| 1202 | Y | 94.2 | Very high | 91.7 | Very high | 104 Ų | 104 | 49.5 Ų | 49.5 | 41% | 0.408 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -66.2 | -40 | 169.9 | -86.8 | -93.4 | 0 | 0 | 0 | 112.1 | P1138 N1139 N1198 K1204 Y1205 H1206 | P1138-Y1202 WeakPolarHBondContact O-CB 3.28Å; N1139-Y1202 HydrophobicContact CB-CD1 4.12Å; N1139-Y1202 HydrophobicContact CB-CD2 3.62Å; N1139-Y1202 HydrophobicContact CB-CE1 4.43Å; N1139-Y1202 HydrophobicContact CB-CE2 3.98Å; N1139-Y1202 HydrophobicContact CB-CG 3.69Å; N1198-Y1202 WeakPolarHBondContact O-CD2 3.4Å; N1198-Y1202 PolarHBondContact O-N 3.14Å; Y1202-K1204 VanDerWaalsContact C-N 3.33Å; Y1202-K1204 PolarHBondContact O-N 2.98Å; Y1202-Y1205 WeakPolarHBondContact O-CB 3.36Å; Y1202-Y1205 PolarHBondContact O-N 3.16Å; Y1202-Y1205 VanDerWaalsContact O-N 3.1Å; Y1202-H1206 PolarHBondContact O-CD2 3.11Å; Y1202-H1206 PolarHBondContact O-N 3.15Å |
| 1203 | L | 94.4 | Very high | 91.9 | Very high | 0 Ų | 0 | 49.9 Ų | 49.9 | 0% | 0 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -63 | -39.1 | 174.6 | -177.6 | 58.5 | 0 | 0 | 0 | 112.3 | T1118 P1138 T1158 I1160 L1195 Q1199 L1200 Y1205 H1206 S1207 F1307 | T1118-L1203 HydrophobicContact CG2-CD1 3.97Å; P1138-L1203 HydrophobicContact CB-CB 3.99Å; P1138-L1203 HydrophobicContact CG-CB 3.99Å; P1138-L1203 HydrophobicContact CG-CD1 4.44Å; T1158-L1203 HydrophobicContact CG2-CD1 3.76Å; T1158-L1203 HydrophobicContact CG2-CD2 3.86Å; T1158-L1203 HydrophobicContact CG2-CG 4.48Å; I1160-L1203 HydrophobicContact CD1-CD2 3.95Å; I1160-L1203 HydrophobicContact CG1-CD2 3.91Å; L1195-L1203 HydrophobicContact CD2-CB 4.21Å; L1195-L1203 HydrophobicContact CD2-CD2 3.58Å; Q1199-L1203 WeakPolarHBondContact O-CB 3.36Å; Q1199-L1203 PolarHBondContact O-N 3Å; Q1199-L1203 VanDerWaalsContact O-N 3.1Å; L1200-L1203 PolarHBondContact O-N 3.11Å; L1203-Y1205 VanDerWaalsContact C-N 3.32Å; L1203-H1206 PolarHBondContact O-N 3.25Å; L1203-S1207 WeakPolarHBondContact O-CB 2.89Å; L1203-S1207 PolarHBondContact O-N 3.15Å; L1203-S1207 PolarHBondContact O-OG 2.74Å; L1203-F1307 HydrophobicContact CD1-CB 4.42Å; L1203-F1307 HydrophobicContact CD2-CB 4.45Å; L1203-F1307 HydrophobicContact CD2-CD2 3.55Å; L1203-F1307 HydrophobicContact CD2-CE2 4.04Å; L1203-F1307 HydrophobicContact CD2-CG 4.18Å; L1203-F1307 HydrophobicContact CG-CB 4.14Å; L1203-F1307 HydrophobicContact CG-CD2 3.97Å; L1203-F1307 HydrophobicContact CG-CG 4.1Å |
| 1204 | K | 94.5 | Very high | 91.9 | Very high | 13 Ų | 13 | 49.8 Ų | 49.8 | 6% | 0.057 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -64.5 | -32.6 | 171.6 | -72.1 | 170.1 | 172 | -179.4 | 0 | 113.3 | L1200 E1201 Y1202 N1242 T1280 F1283 F1307 | L1200-K1204 WeakPolarHBondContact O-CG 3.39Å; L1200-K1204 PolarHBondContact O-N 3.22Å; E1201-K1204 WeakPolarHBondContact O-CB 3.41Å; E1201-K1204 PolarHBondContact O-N 3.31Å; E1201-K1204 IonicContact OE1-NZ 2.73Å; E1201-K1204 PolarHBondContact OE1-NZ 3.29Å; E1201-K1204 VanDerWaalsContact OE2-CD 3.25Å; E1201-K1204 WeakPolarHBondContact OE2-CD 3.47Å; E1201-K1204 IonicContact OE2-NZ 3.34Å; E1201-K1204 PolarHBondContact OE2-NZ 3.25Å; Y1202-K1204 VanDerWaalsContact C-N 3.33Å; Y1202-K1204 PolarHBondContact O-N 2.98Å; K1204-N1242 PolarHBondContact NZ-ND2 3.15Å; K1204-T1280 PolarHBondContact O-OG1 3.31Å; K1204-F1283 WeakPolarHBondContact CE-O 3.5Å; K1204-F1283 PolarHBondContact NZ-O 2.91Å; K1204-F1307 HydrophobicContact CG-CD1 4.43Å; K1204-F1307 HydrophobicContact CG-CE1 3.82Å; K1204-F1307 HydrophobicContact CG-CZ 4.43Å |
| 1205 | Y | 93.7 | Very high | 92 | Very high | 108 Ų | 108 | 49.8 Ų | 49.8 | 42% | 0.424 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -72.4 | -37.6 | 176 | 170.6 | -114.1 | 0 | 0 | 0 | 111.9 | M1072 E1201 Y1202 L1203 S1207 | M1072-Y1205 HydrophobicContact CB-CE2 4.3Å; M1072-Y1205 HydrophobicContact CE-CD2 3.96Å; M1072-Y1205 HydrophobicContact CE-CE1 4.24Å; M1072-Y1205 HydrophobicContact CE-CE2 3.49Å; M1072-Y1205 VanDerWaalsContact CE-CE2 3.49Å; M1072-Y1205 HydrophobicContact CG-CD2 4.28Å; M1072-Y1205 HydrophobicContact CG-CE2 3.66Å; M1072-Y1205 HydrophobicContact SD-CD2 4.43Å; M1072-Y1205 HydrophobicContact SD-CE2 3.51Å; M1072-Y1205 VanDerWaalsContact SD-CE2 3.51Å; E1201-Y1205 PolarHBondContact O-N 3.07Å; Y1202-Y1205 WeakPolarHBondContact O-CB 3.36Å; Y1202-Y1205 PolarHBondContact O-N 3.16Å; Y1202-Y1205 VanDerWaalsContact O-N 3.1Å; L1203-Y1205 VanDerWaalsContact C-N 3.32Å; Y1205-S1207 PolarHBondContact O-N 3Å |
| 1206 | H | 93.4 | Very high | 91.8 | Very high | 75 Ų | 75 | 49.6 Ų | 49.6 | 35% | 0.347 | 25% | 0.245 | S | C | . | . | S | Bend | trans | -75.4 | 1.1 | 175.7 | -73 | -57.5 | 0 | 0 | 0 | 114.8 | T1118 P1138 Y1202 L1203 | T1118-H1206 HydrophobicContact CG2-CB 3.75Å; P1138-H1206 PolarHBondContact O-CD2 2.91Å; P1138-H1206 PolarHBondContact O-NE2 3.05Å; Y1202-H1206 PolarHBondContact O-CD2 3.11Å; Y1202-H1206 PolarHBondContact O-N 3.15Å; L1203-H1206 PolarHBondContact O-N 3.25Å |
| 1207 | S | 95.5 | Very high | 91.7 | Very high | 10 Ų | 10 | 47.2 Ų | 47.2 | 7% | 0.07 | 24% | 0.235 | C | C | . | . | trans | -134.1 | 142.9 | -174 | -53.3 | 0 | 0 | 0 | 0 | 111.9 | L1203 Y1205 T1280 F1307 Q1308 | L1203-S1207 WeakPolarHBondContact O-CB 2.89Å; L1203-S1207 PolarHBondContact O-N 3.15Å; L1203-S1207 PolarHBondContact O-OG 2.74Å; Y1205-S1207 PolarHBondContact O-N 3Å; S1207-T1280 WeakPolarHBondContact O-CG2 3.38Å; S1207-F1307 WeakPolarHBondContact OG-CB 3.41Å; S1207-Q1308 CarbonylContact C-O 3.56Å; S1207-Q1308 WeakPolarHBondContact CA-O 3.43Å; S1207-Q1308 WeakPolarHBondContact CB-O 3.26Å | ||
| 1208 | L | 93.2 | Very high | 91.2 | Very high | 149 Ų | 149 | 45.1 Ų | 45.1 | 78% | 0.78 | 21% | 0.212 | S | C | * | . | S | Bend | trans | -92.2 | -32.6 | 178.4 | -65.8 | 173.9 | 0 | 0 | 0 | 112.1 | Q1308 | L1208-Q1308 PolarHBondContact N-O 3.13Š|
| 1209 | I | 94.2 | Very high | 90.5 | Very high | 58 Ų | 58 | 41 Ų | 41 | 30% | 0.297 | 19% | 0.192 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -128.4 | 133.8 | -172.4 | -60.9 | 178.6 | 0 | 0 | 0 | 110.1 | K1277 G1278 F1307 Q1308 | I1209-K1277 HydrophobicContact CG2-CG 3.94Å; I1209-G1278 WeakPolarHBondContact CA-O 3.25Å; I1209-F1307 WeakPolarHBondContact O-CA 3.39Å; I1209-Q1308 PolarHBondContact N-O 3.43Å; I1209-Q1308 PolarHBondContact O-N 2.75Å |
| 1210 | G | 94.6 | Very high | 89.3 | Confident | 0 Ų | 0 | 43 Ų | 43 | 0% | 0 | 20% | 0.203 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -99.3 | 146.9 | 162.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | K1277 G1278 F1283 C1306 | G1210-K1277 WeakPolarHBondContact O-CA 3.34Å; G1210-G1278 PolarHBondContact N-O 2.77Å; G1210-G1278 PolarHBondContact O-N 2.77Å; G1210-G1278 VanDerWaalsContact O-N 3.08Å; G1210-F1283 VanDerWaalsContact C-CZ 3.42Å; G1210-F1283 WeakPolarHBondContact O-CE2 3.46Å; G1210-F1283 WeakPolarHBondContact O-CZ 3.4Å; G1210-C1306 CarbonylContact C-O 3.57Å; G1210-C1306 VanDerWaalsContact CA-O 3.3Å; G1210-C1306 WeakPolarHBondContact CA-O 3.35Å |
| 1211 | T | 95.2 | Very high | 88 | Confident | 14 Ų | 14 | 45.5 Ų | 45.5 | 9% | 0.086 | 21% | 0.214 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -133.3 | 132.1 | 174.9 | 34.8 | 0 | 0 | 0 | 0 | 109.1 | E1157 I1276 K1277 C1306 | E1157-T1211 PolarHBondContact OE1-OG1 2.92Å; T1211-I1276 CarbonylContact C-O 3.59Å; T1211-I1276 WeakPolarHBondContact CA-O 3.46Å; T1211-K1277 HydrophobicContact CG2-CB 4.07Å; T1211-K1277 HydrophobicContact CG2-CD 3.72Å; T1211-K1277 HydrophobicContact CG2-CG 3.66Å; T1211-C1306 PolarHBondContact N-O 2.87Å; T1211-C1306 PolarHBondContact O-N 3.15Å; T1211-C1306 VanDerWaalsContact OG1-CB 3.3Å; T1211-C1306 WeakPolarHBondContact OG1-CB 2.92Å; T1211-C1306 PolarHBondContact OG1-O 3.41Å |
| 1212 | Q | 93.7 | Very high | 86.2 | Confident | 2 Ų | 2 | 45.3 Ų | 45.3 | 1% | 0.009 | 22% | 0.223 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -145 | 142.6 | 170.8 | -165.2 | 165.5 | 9.3 | 0 | 0 | 110.1 | Y1193 I1276 F1283 I1285 G1303 V1305 | Y1193-Q1212 PolarHBondContact OH-NE2 3.24Å; Q1212-I1276 PolarHBondContact N-O 3.42Å; Q1212-I1276 WeakPolarHBondContact O-CD1 3.19Å; Q1212-I1276 PolarHBondContact O-N 3.23Å; Q1212-F1283 HydrophobicContact CB-CD1 4.08Å; Q1212-F1283 HydrophobicContact CB-CE1 3.76Å; Q1212-I1285 VanDerWaalsContact OE1-N 3.16Å; Q1212-G1303 PolarHBondContact NE2-O 2.69Å; Q1212-V1305 HydrophobicContact CB-CB 4.48Å; Q1212-V1305 HydrophobicContact CB-CG2 4.39Å; Q1212-V1305 HydrophobicContact CG-CB 4.21Å |
| 1213 | Q | 92 | Very high | 84.3 | Confident | 75 Ų | 75 | 47.1 Ų | 47.1 | 35% | 0.35 | 24% | 0.24 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -114.3 | 143.6 | 176 | -71.2 | -179.3 | -7.3 | 0 | 0 | 110.4 | Y1215 F1274 L1275 G1303 | Q1213-Y1215 PolarHBondContact OE1-OH 3.09Å; Q1213-F1274 VanDerWaalsContact CA-O 3.26Å; Q1213-F1274 WeakPolarHBondContact CA-O 3.39Å; Q1213-L1275 HydrophobicContact CG-CD1 3.81Å; Q1213-G1303 WeakPolarHBondContact O-CA 3.46Å; Q1213-G1303 PolarHBondContact O-N 3.29Å |
| 1214 | I | 90.1 | Very high | 82.2 | Confident | 0 Ų | 0 | 52.2 Ų | 52.2 | 0% | 0 | 26% | 0.263 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.9 | 136.2 | 178 | -57.8 | -178.1 | 0 | 0 | 0 | 107.9 | L1239 A1273 F1274 I1276 I1285 I1288 V1300 I1302 | I1214-L1239 HydrophobicContact CD1-CD1 4.05Å; I1214-L1239 HydrophobicContact CD1-CD2 3.62Å; I1214-L1239 HydrophobicContact CD1-CG 4.44Å; I1214-A1273 WeakPolarHBondContact O-CA 3.3Å; I1214-F1274 HydrophobicContact CB-CB 4.46Å; I1214-F1274 HydrophobicContact CB-CD2 4.34Å; I1214-F1274 HydrophobicContact CG2-CD2 4.43Å; I1214-F1274 PolarHBondContact N-O 3.27Å; I1214-F1274 WeakPolarHBondContact O-CD2 3.45Å; I1214-F1274 PolarHBondContact O-N 3.25Å; I1214-I1276 HydrophobicContact CD1-CD1 4.02Å; I1214-I1276 HydrophobicContact CG1-CD1 4.09Å; I1214-I1285 HydrophobicContact CD1-CG1 4.31Å; I1214-I1285 HydrophobicContact CD1-CG2 4.28Å; I1214-I1288 HydrophobicContact CD1-CD1 4.22Å; I1214-I1288 HydrophobicContact CG2-CD1 4.38Å; I1214-V1300 HydrophobicContact CG2-CG1 3.75Å; I1214-I1302 HydrophobicContact CG1-CG2 4.28Å |
| 1215 | Y | 88.2 | Confident | 80 | Confident | 86 Ų | 86 | 60.7 Ų | 60.7 | 34% | 0.337 | 30% | 0.295 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.3 | 138.3 | 177.3 | -47.7 | -84.6 | 0 | 0 | 0 | 110.2 | Q1213 S1272 A1273 V1300 Q1301 | Q1213-Y1215 PolarHBondContact OE1-OH 3.09Å; Y1215-S1272 WeakPolarHBondContact CA-O 3.42Å; Y1215-A1273 HydrophobicContact CD1-CB 3.7Å; Y1215-A1273 HydrophobicContact CE1-CB 4.04Å; Y1215-V1300 CarbonylContact O-C 3.58Å; Y1215-V1300 WeakPolarHBondContact O-CA 3.36Å; Y1215-Q1301 HydrophobicContact CD2-CB 4.42Å; Y1215-Q1301 PolarHBondContact N-O 3.47Å; Y1215-Q1301 PolarHBondContact O-N 3.41Å |
| 1216 | E | 84.5 | Confident | 77.6 | Confident | 0 Ų | 0 | 63 Ų | 63 | 0% | 0 | 31% | 0.314 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.5 | 103.7 | 179.1 | 175.2 | -170.1 | -159.3 | 0 | 0 | 107.9 | C1218 F1236 I1237 C1263 K1271 S1272 F1274 | E1216-C1218 HydrophobicContact CG-CB 4.19Å; E1216-F1236 WeakPolarHBondContact OE1-CB 3.46Å; E1216-I1237 HydrophobicContact CG-CG2 4.43Å; E1216-C1263 VanDerWaalsContact CD-SG 3.57Å; E1216-C1263 PolarHBondContact OE2-SG 3.37Å; E1216-K1271 CarbonylContact O-C 3.56Å; E1216-K1271 WeakPolarHBondContact O-CA 3.15Å; E1216-S1272 PolarHBondContact N-O 3.47Å; E1216-S1272 PolarHBondContact O-N 3.26Å; E1216-F1274 HydrophobicContact CB-CE2 3.86Å; E1216-F1274 WeakPolarHBondContact OE2-CZ 3.22Å |
| 1217 | D | 82 | Confident | 75.4 | Confident | 17 Ų | 17 | 64.5 Ų | 64.5 | 9% | 0.091 | 32% | 0.324 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -86.6 | 108.8 | 170.6 | -71.3 | 12.5 | 0 | 0 | 0 | 107.5 | K1270 K1271 N1298 L1299 | D1217-K1270 WeakPolarHBondContact CA-O 3.2Å; D1217-K1271 WeakPolarHBondContact OD1-CE 3.18Å; D1217-K1271 WeakPolarHBondContact OD1-CG 3.39Å; D1217-K1271 IonicContact OD1-NZ 2.64Å; D1217-K1271 PolarHBondContact OD1-NZ 3.43Å; D1217-K1271 IonicContact OD2-NZ 2.65Å; D1217-K1271 PolarHBondContact OD2-NZ 3.44Å; D1217-N1298 CarbonylContact O-C 3.59Å; D1217-N1298 WeakPolarHBondContact O-CA 2.99Å; D1217-L1299 HydrophobicContact CB-CB 4.11Å; D1217-L1299 WeakPolarHBondContact CB-O 3.14Å; D1217-L1299 PolarHBondContact N-O 3.01Å; D1217-L1299 PolarHBondContact O-N 3.11Å |
| 1218 | C | 77.5 | Confident | 72.5 | Confident | 5 Ų | 5 | 68.5 Ų | 68.5 | 3% | 0.034 | 35% | 0.352 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.4 | 133.2 | -166.5 | 49.4 | 0 | 0 | 0 | 0 | 111.1 | E1216 C1263 K1270 N1298 | E1216-C1218 HydrophobicContact CG-CB 4.19Å; C1218-C1263 HydrophobicContact CB-CB 4.01Å; C1218-C1263 WeakPolarHBondContact CB-SG 3.06Å; C1218-C1263 WeakPolarHBondContact SG-CA 3.4Å; C1218-C1263 WeakPolarHBondContact SG-CB 3.46Å; C1218-C1263 CovalentContact SG-SG 2.02Å; C1218-C1263 PolarHBondContact SG-SG 3.35Å; C1218-K1270 PolarHBondContact N-O 3.18Å; C1218-K1270 PolarHBondContact O-N 3.1Å; C1218-K1270 VanDerWaalsContact SG-CB 3.54Å; C1218-N1298 WeakPolarHBondContact CA-OD1 3.5Å; C1218-N1298 WeakPolarHBondContact CB-OD1 3.1Å |
| 1219 | S | 72.6 | Confident | 69.6 | Low | 32 Ų | 32 | 66.2 Ų | 66.2 | 22% | 0.224 | 35% | 0.348 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -135.7 | 107.4 | 179.9 | -169.2 | 0 | 0 | 0 | 0 | 110.1 | S1296 E1297 | S1219-S1296 CarbonylContact O-C 3.42Å; S1219-S1296 WeakPolarHBondContact O-CA 3.43Å; S1219-E1297 PolarHBondContact N-O 3.04Å; S1219-E1297 PolarHBondContact O-N 3.27Å |
| 1220 | I | 67 | Low | 66.6 | Low | 49 Ų | 49 | 67.7 Ų | 67.7 | 25% | 0.251 | 36% | 0.364 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -76.7 | 125.9 | 178.5 | -68.8 | 159.1 | 0 | 0 | 0 | 109 | F1236 P1266 | I1220-F1236 HydrophobicContact CD1-CZ 4.34Å; I1220-P1266 HydrophobicContact CD1-CB 4.32Å |
| 1221 | K | 64.3 | Low | 63.6 | Low | 60 Ų | 60 | 72.1 Ų | 72.1 | 26% | 0.261 | 40% | 0.395 | S | S | . | . | trans | -66.1 | 138.2 | 178.4 | -61.6 | -167.5 | 176 | -159.2 | 0 | 109.7 | D1223 H1224 I1295 E1297 | K1221-D1223 PolarHBondContact O-N 3.27Å; K1221-H1224 PolarHBondContact O-N 3Å; K1221-I1295 PolarHBondContact N-O 3.28Å; K1221-E1297 VanDerWaalsContact CE-CD 3.49Å; K1221-E1297 WeakPolarHBondContact CE-OE1 3.05Å; K1221-E1297 IonicContact NZ-OE1 3.27Å; K1221-E1297 PolarHBondContact NZ-OE1 3.16Å | ||
| 1222 | S | 54.5 | Low | 60.9 | Low | 95 Ų | 95 | 77.3 Ų | 77.3 | 66% | 0.664 | 43% | 0.432 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.3 | -29.9 | -165.5 | 41.4 | 0 | 0 | 0 | 0 | 115.2 | ||
| 1223 | D | 55.2 | Low | 58.6 | Low | 142 Ų | 142 | 81.9 Ų | 81.9 | 76% | 0.759 | 46% | 0.464 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.1 | -19 | -161.7 | -49.1 | -15.7 | 0 | 0 | 0 | 111.9 | K1221 R1225 | K1221-D1223 PolarHBondContact O-N 3.27Å; D1223-R1225 VanDerWaalsContact C-N 3.34Å; D1223-R1225 PolarHBondContact O-N 3.23Å |
| 1224 | H | 51.1 | Low | 56.7 | Low | 106 Ų | 106 | 80.9 Ų | 80.9 | 49% | 0.491 | 46% | 0.461 | S | S | . | . | trans | -94.7 | 41.2 | 179.8 | -83.7 | -65.3 | 0 | 0 | 0 | 113.8 | K1221 L1226 I1295 | K1221-H1224 PolarHBondContact O-N 3Å; H1224-L1226 PolarHBondContact O-N 3.42Å; H1224-I1295 HydrophobicContact CB-CG1 4.31Å; H1224-I1295 HydrophobicContact CB-CG2 3.87Å | ||
| 1225 | R | 46.9 | Very low | 55.3 | Low | 191 Ų | 191 | 82 Ų | 82 | 72% | 0.721 | 47% | 0.467 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.4 | 8.9 | -172.8 | -139.8 | -179.8 | -168.9 | -160.6 | 4.4 | 116.3 | D1223 | D1223-R1225 VanDerWaalsContact C-N 3.34Å; D1223-R1225 PolarHBondContact O-N 3.23Å |
| 1226 | L | 43.7 | Very low | 54.5 | Low | 158 Ų | 158 | 79.2 Ų | 79.2 | 83% | 0.827 | 46% | 0.456 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -104.9 | -8.8 | -166.9 | -73.3 | 171.6 | 0 | 0 | 0 | 116 | H1224 S1228 | H1224-L1226 PolarHBondContact O-N 3.42Å; L1226-S1228 PolarHBondContact O-N 3.42Å; L1226-S1228 VanDerWaalsContact O-N 3.11Å |
| 1227 | L | 47.2 | Very low | 54.4 | Low | 106 Ų | 106 | 79.4 Ų | 79.4 | 56% | 0.555 | 46% | 0.458 | S | S | * | . | trans | -82.6 | 24.8 | -179.3 | -68.2 | 176.6 | 0 | 0 | 0 | 114.6 | S1229 I1295 | L1227-S1229 PolarHBondContact O-N 3.22Å; L1227-I1295 HydrophobicContact CD1-CD1 3.74Å | ||
| 1228 | S | 35.4 | Very low | 54.6 | Low | 94 Ų | 94 | 81.6 Ų | 81.6 | 66% | 0.657 | 47% | 0.466 | S | S | * | . | trans | -81.6 | 13.4 | -173.3 | -169.2 | 0 | 0 | 0 | 0 | 114.6 | L1226 | L1226-S1228 PolarHBondContact O-N 3.42Å; L1226-S1228 VanDerWaalsContact O-N 3.11Å | ||
| 1229 | S | 30.6 | Very low | 55.3 | Low | 100 Ų | 100 | 81.5 Ų | 81.5 | 70% | 0.699 | 47% | 0.465 | S | S | * | . | trans | -137.4 | 54.7 | -163.6 | 63.5 | 0 | 0 | 0 | 0 | 114.4 | L1227 | L1227-S1229 PolarHBondContact O-N 3.22Š| ||
| 1230 | S | 31.3 | Very low | 56.2 | Low | 90 Ų | 90 | 81.4 Ų | 81.4 | 63% | 0.629 | 46% | 0.461 | S | S | * | . | S | Bend | trans | -149.2 | 149.8 | 162.2 | -81 | 0 | 0 | 0 | 0 | 111.6 | ||
| 1231 | S | 32.5 | Very low | 57.4 | Low | 93 Ų | 93 | 79.1 Ų | 79.1 | 65% | 0.65 | 45% | 0.449 | S | S | * | . | trans | -61.6 | 130.5 | -166.4 | 47.9 | 0 | 0 | 0 | 0 | 116.6 | S1233 | S1231-S1233 VanDerWaalsContact C-N 3.3Å; S1231-S1233 PolarHBondContact O-N 3.27Å | ||
| 1232 | S | 38.1 | Very low | 58.5 | Low | 123 Ų | 123 | 78.7 Ų | 78.7 | 86% | 0.86 | 45% | 0.45 | S | S | * | . | S | Bend | trans | 63.7 | -18.2 | 138.4 | -50.3 | 0 | 0 | 0 | 0 | 121.9 | ||
| 1233 | S | 44.9 | Very low | 60 | Low | 97 Ų | 97 | 78.9 Ų | 78.9 | 68% | 0.678 | 44% | 0.443 | S | S | * | . | trans | -140.4 | 37 | -174.8 | 52.6 | 0 | 0 | 0 | 0 | 114.5 | S1231 L1235 | S1231-S1233 VanDerWaalsContact C-N 3.3Å; S1231-S1233 PolarHBondContact O-N 3.27Å; S1233-L1235 VanDerWaalsContact C-N 3.26Å; S1233-L1235 PolarHBondContact O-N 3.18Å | ||
| 1234 | N | 53.5 | Low | 61.5 | Low | 55 Ų | 55 | 74.7 Ų | 74.7 | 29% | 0.294 | 43% | 0.434 | S | S | . | . | trans | -71.9 | 75.1 | 175.2 | -64.6 | -10.9 | 0 | 0 | 0 | 112.1 | ||||
| 1235 | L | 61 | Low | 63.4 | Low | 22 Ų | 22 | 73.1 Ų | 73.1 | 12% | 0.115 | 43% | 0.429 | C | S | . | . | trans | -97 | 137.2 | 162.9 | -131.3 | 73.7 | 0 | 0 | 0 | 109.2 | S1233 I1237 Y1256 F1274 | S1233-L1235 VanDerWaalsContact C-N 3.26Å; S1233-L1235 PolarHBondContact O-N 3.18Å; L1235-I1237 HydrophobicContact CD2-CG1 3.76Å; L1235-I1237 HydrophobicContact CG-CG1 4.27Å; L1235-I1237 PolarHBondContact O-N 3.04Å; L1235-Y1256 HydrophobicContact CD2-CE2 4.34Å; L1235-F1274 HydrophobicContact CD1-CE1 3.65Å; L1235-F1274 HydrophobicContact CD1-CZ 3.73Å; L1235-F1274 HydrophobicContact CD2-CD1 4.34Å; L1235-F1274 HydrophobicContact CD2-CE1 3.6Å; L1235-F1274 HydrophobicContact CD2-CE2 4.48Å; L1235-F1274 HydrophobicContact CD2-CZ 3.68Å; L1235-F1274 HydrophobicContact CG-CE1 4.07Å; L1235-F1274 HydrophobicContact CG-CZ 3.89Å | ||
| 1236 | F | 71.4 | Confident | 65.5 | Low | 28 Ų | 28 | 68 Ų | 68 | 12% | 0.123 | 41% | 0.413 | C | S | . | . | S | Bend | trans | -89.9 | 11.8 | 176.1 | -55.8 | -84.5 | 0 | 0 | 0 | 112.4 | E1216 I1220 C1263 L1291 N1298 | E1216-F1236 WeakPolarHBondContact OE1-CB 3.46Å; I1220-F1236 HydrophobicContact CD1-CZ 4.34Å; F1236-C1263 HydrophobicContact CD2-CB 4.37Å; F1236-C1263 HydrophobicContact CE2-CB 4.33Å; F1236-L1291 PolarHBondContact O-N 3.11Å; F1236-N1298 WeakPolarHBondContact CB-ND2 3.21Å |
| 1237 | I | 81.2 | Confident | 67.7 | Low | 5 Ų | 5 | 60.7 Ų | 60.7 | 3% | 0.026 | 38% | 0.375 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.4 | 145.4 | 177.6 | 72.1 | 178.3 | 0 | 0 | 0 | 111.8 | E1216 L1235 L1239 F1274 I1288 E1289 L1290 V1300 | E1216-I1237 HydrophobicContact CG-CG2 4.43Å; L1235-I1237 HydrophobicContact CD2-CG1 3.76Å; L1235-I1237 HydrophobicContact CG-CG1 4.27Å; L1235-I1237 PolarHBondContact O-N 3.04Å; I1237-L1239 HydrophobicContact CD1-CD2 3.94Å; I1237-L1239 HydrophobicContact CD1-CG 4.41Å; I1237-L1239 HydrophobicContact CG1-CD2 4.44Å; I1237-F1274 HydrophobicContact CD1-CD2 3.87Å; I1237-F1274 HydrophobicContact CD1-CE2 3.51Å; I1237-F1274 HydrophobicContact CD1-CZ 4.25Å; I1237-F1274 HydrophobicContact CG1-CE2 4.36Å; I1237-I1288 HydrophobicContact CB-CG2 4.32Å; I1237-E1289 CarbonylContact C-O 3.59Å; I1237-E1289 WeakPolarHBondContact CA-O 3.04Å; I1237-L1290 HydrophobicContact CG2-CD2 3.64Å; I1237-V1300 HydrophobicContact CG2-CG2 4.08Å |
| 1238 | K | 87.5 | Confident | 69.6 | Low | 63 Ų | 63 | 58 Ų | 58 | 27% | 0.274 | 37% | 0.365 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.7 | 148.6 | 158.2 | -67.2 | 168.3 | 166.7 | -119.1 | 0 | 109.7 | F1240 E1246 I1288 E1289 L1291 | K1238-F1240 HydrophobicContact CB-CE2 3.77Å; K1238-F1240 HydrophobicContact CB-CZ 4.08Å; K1238-F1240 HydrophobicContact CD-CZ 4.33Å; K1238-E1246 WeakPolarHBondContact CE-OE1 3.41Å; K1238-E1246 IonicContact NZ-OE1 3.97Å; K1238-E1246 PolarHBondContact NZ-OE1 3.39Å; K1238-E1246 IonicContact NZ-OE2 3.28Å; K1238-E1246 PolarHBondContact NZ-OE2 3.22Å; K1238-I1288 WeakPolarHBondContact O-CA 3.34Å; K1238-E1289 HydrophobicContact CB-CB 4.24Å; K1238-E1289 VanDerWaalsContact CD-OE2 3.3Å; K1238-E1289 WeakPolarHBondContact CD-OE2 3.48Å; K1238-E1289 PolarHBondContact N-O 3.1Å; K1238-E1289 PolarHBondContact O-N 3.49Å; K1238-L1291 HydrophobicContact CD-CD2 4.29Å; K1238-L1291 HydrophobicContact CG-CD1 4.23Å |
| 1239 | L | 90.9 | Very high | 71.8 | Confident | 2 Ų | 2 | 59.5 Ų | 59.5 | 1% | 0.01 | 36% | 0.357 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.7 | 132.9 | -176.8 | -58.9 | 177.4 | 0 | 0 | 0 | 109.8 | I1214 I1237 L1247 I1276 I1285 I1288 | I1214-L1239 HydrophobicContact CD1-CD1 4.05Å; I1214-L1239 HydrophobicContact CD1-CD2 3.62Å; I1214-L1239 HydrophobicContact CD1-CG 4.44Å; I1237-L1239 HydrophobicContact CD1-CD2 3.94Å; I1237-L1239 HydrophobicContact CD1-CG 4.41Å; I1237-L1239 HydrophobicContact CG1-CD2 4.44Å; L1239-L1247 HydrophobicContact CB-CB 4.32Å; L1239-L1247 HydrophobicContact CB-CD1 4.16Å; L1239-L1247 PolarHBondContact O-N 3.27Å; L1239-I1276 HydrophobicContact CD1-CD1 4.23Å; L1239-I1276 HydrophobicContact CD1-CG1 4.5Å; L1239-I1285 HydrophobicContact CB-CG2 4.49Å; L1239-I1288 HydrophobicContact CD2-CD1 4.04Å; L1239-I1288 HydrophobicContact CD2-CG1 3.84Å; L1239-I1288 HydrophobicContact CD2-CG2 4.35Å |
| 1240 | F | 92.3 | Very high | 74.2 | Confident | 30 Ų | 30 | 60.9 Ų | 60.9 | 13% | 0.132 | 36% | 0.356 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.3 | 129.1 | -176.6 | -60.7 | -94.2 | 0 | 0 | 0 | 111.8 | F1188 K1238 N1245 E1246 I1285 R1286 G1287 E1289 | F1188-F1240 HydrophobicContact CD2-CD2 4.48Å; F1188-F1240 HydrophobicContact CD2-CE2 4.33Å; F1188-F1240 AromaticContact CE2-CD2 3.83Å; F1188-F1240 HydrophobicContact CE2-CD2 3.83Å; F1188-F1240 HydrophobicContact CE2-CE2 4.08Å; F1188-F1240 HydrophobicContact CE2-CG 4.35Å; K1238-F1240 HydrophobicContact CB-CE2 3.77Å; K1238-F1240 HydrophobicContact CB-CZ 4.08Å; K1238-F1240 HydrophobicContact CD-CZ 4.33Å; F1240-N1245 WeakPolarHBondContact CA-O 3.04Å; F1240-E1246 HydrophobicContact CD1-CB 4.14Å; F1240-E1246 HydrophobicContact CE1-CB 3.86Å; F1240-E1246 HydrophobicContact CE1-CG 4.22Å; F1240-E1246 HydrophobicContact CZ-CG 4.48Å; F1240-I1285 CarbonylContact O-C 3.58Å; F1240-I1285 WeakPolarHBondContact O-CA 3.32Å; F1240-I1285 WeakPolarHBondContact O-CG2 3.43Å; F1240-R1286 PolarHBondContact O-N 3.34Å; F1240-G1287 PolarHBondContact N-O 2.9Å; F1240-G1287 PolarHBondContact O-N 3.27Å; F1240-E1289 HydrophobicContact CE2-CB 3.78Å; F1240-E1289 HydrophobicContact CZ-CB 4.5Å |
| 1241 | T | 92.4 | Very high | 76.8 | Confident | 1 Ų | 1 | 60.3 Ų | 60.3 | 1% | 0.006 | 34% | 0.344 | C | S | . | . | trans | -64.8 | 170.5 | 176.8 | 56.9 | 0 | 0 | 0 | 0 | 112.6 | N1243 G1244 N1245 L1247 L1254 R1282 | T1241-N1243 WeakPolarHBondContact CB-OD1 3.28Å; T1241-N1243 PolarHBondContact O-N 3.08Å; T1241-N1243 PolarHBondContact OG1-OD1 3.3Å; T1241-G1244 PolarHBondContact O-N 3.46Å; T1241-N1245 PolarHBondContact N-O 3.19Å; T1241-N1245 WeakPolarHBondContact OG1-CB 3.4Å; T1241-N1245 PolarHBondContact OG1-N 3.48Å; T1241-N1245 PolarHBondContact OG1-O 2.65Å; T1241-L1247 HydrophobicContact CG2-CD1 4.37Å; T1241-L1247 HydrophobicContact CG2-CD2 3.48Å; T1241-L1247 VanDerWaalsContact CG2-CD2 3.48Å; T1241-L1247 HydrophobicContact CG2-CG 3.84Å; T1241-L1254 HydrophobicContact CG2-CD2 4.47Å; T1241-R1282 WeakPolarHBondContact CA-O 3.43Å; T1241-R1282 WeakPolarHBondContact CB-O 3.04Å; T1241-R1282 HydrophobicContact CG2-CB 3.85Å; T1241-R1282 HydrophobicContact CG2-CG 4.43Å; T1241-R1282 WeakPolarHBondContact CG2-O 3.03Å | ||
| 1242 | N | 87.8 | Confident | 79 | Confident | 52 Ų | 52 | 61.2 Ų | 61.2 | 28% | 0.278 | 35% | 0.347 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60.1 | -20.5 | 179.4 | 96.6 | -54.5 | 0 | 0 | 0 | 114.5 | K1204 A1281 R1282 F1283 P1284 R1286 | K1204-N1242 PolarHBondContact NZ-ND2 3.15Å; N1242-A1281 PolarHBondContact OD1-O 3.39Å; N1242-A1281 VanDerWaalsContact OD1-O 3.08Å; N1242-R1282 PolarHBondContact N-O 3.34Å; N1242-F1283 WeakPolarHBondContact CB-O 3.23Å; N1242-P1284 WeakPolarHBondContact CA-O 3.2Å; N1242-P1284 WeakPolarHBondContact CB-O 3.48Å; N1242-P1284 PolarHBondContact N-O 3.42Å; N1242-R1286 HydrophobicContact CB-CG 4.12Å |
| 1243 | N | 85.4 | Confident | 81 | Confident | 98 Ų | 98 | 64.3 Ų | 64.3 | 52% | 0.524 | 34% | 0.342 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -104.5 | 19.5 | 176.7 | 62.3 | -0.4 | 0 | 0 | 0 | 113.1 | T1241 N1245 | T1241-N1243 WeakPolarHBondContact CB-OD1 3.28Å; T1241-N1243 PolarHBondContact O-N 3.08Å; T1241-N1243 PolarHBondContact OG1-OD1 3.3Å; N1243-N1245 VanDerWaalsContact C-N 3.34Å; N1243-N1245 VanDerWaalsContact CG-ND2 3.25Å; N1243-N1245 PolarHBondContact ND2-ND2 3.24Å; N1243-N1245 PolarHBondContact O-N 3.15Å; N1243-N1245 PolarHBondContact OD1-ND2 3Å |
| 1244 | G | 86.5 | Confident | 82.9 | Confident | 54 Ų | 54 | 61.2 Ų | 61.2 | 56% | 0.557 | 32% | 0.317 | S | S | * | . | S | Bend | trans | 77.2 | 8.8 | 169.5 | 0 | 0 | 0 | 0 | 0 | 116 | T1241 | T1241-G1244 PolarHBondContact O-N 3.46Š|
| 1245 | N | 90.6 | Very high | 84.5 | Confident | 73 Ų | 73 | 59.4 Ų | 59.4 | 39% | 0.39 | 31% | 0.312 | S | S | . | . | P | Polyproline II helix | trans | -80.3 | 134.6 | 176.6 | -64.7 | -76 | 0 | 0 | 0 | 110.4 | F1240 T1241 N1243 L1247 L1254 | F1240-N1245 WeakPolarHBondContact CA-O 3.04Å; T1241-N1245 PolarHBondContact N-O 3.19Å; T1241-N1245 WeakPolarHBondContact OG1-CB 3.4Å; T1241-N1245 PolarHBondContact OG1-N 3.48Å; T1241-N1245 PolarHBondContact OG1-O 2.65Å; N1243-N1245 VanDerWaalsContact C-N 3.34Å; N1243-N1245 VanDerWaalsContact CG-ND2 3.25Å; N1243-N1245 PolarHBondContact ND2-ND2 3.24Å; N1243-N1245 PolarHBondContact O-N 3.15Å; N1243-N1245 PolarHBondContact OD1-ND2 3Å; N1245-L1247 PolarHBondContact O-N 3.41Å; N1245-L1254 HydrophobicContact CB-CD1 4.02Å |
| 1246 | E | 91.3 | Very high | 85.8 | Confident | 84 Ų | 84 | 59.8 Ų | 59.8 | 39% | 0.393 | 31% | 0.312 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -69.1 | 127.6 | 172.4 | -172.1 | 175.1 | 154.2 | 0 | 0 | 110.2 | K1238 F1240 | K1238-E1246 WeakPolarHBondContact CE-OE1 3.41Å; K1238-E1246 IonicContact NZ-OE1 3.97Å; K1238-E1246 PolarHBondContact NZ-OE1 3.39Å; K1238-E1246 IonicContact NZ-OE2 3.28Å; K1238-E1246 PolarHBondContact NZ-OE2 3.22Å; F1240-E1246 HydrophobicContact CD1-CB 4.14Å; F1240-E1246 HydrophobicContact CE1-CB 3.86Å; F1240-E1246 HydrophobicContact CE1-CG 4.22Å; F1240-E1246 HydrophobicContact CZ-CG 4.48Å |
| 1247 | L | 90.3 | Very high | 86.6 | Confident | 4 Ų | 4 | 64.2 Ų | 64.2 | 2% | 0.021 | 33% | 0.333 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -81.5 | 139.8 | 170.3 | -63.9 | 175.7 | 0 | 0 | 0 | 109.9 | L1239 T1241 N1245 L1254 Y1256 I1276 I1285 | L1239-L1247 HydrophobicContact CB-CB 4.32Å; L1239-L1247 HydrophobicContact CB-CD1 4.16Å; L1239-L1247 PolarHBondContact O-N 3.27Å; T1241-L1247 HydrophobicContact CG2-CD1 4.37Å; T1241-L1247 HydrophobicContact CG2-CD2 3.48Å; T1241-L1247 VanDerWaalsContact CG2-CD2 3.48Å; T1241-L1247 HydrophobicContact CG2-CG 3.84Å; N1245-L1247 PolarHBondContact O-N 3.41Å; L1247-L1254 WeakPolarHBondContact CA-O 3.14Å; L1247-L1254 WeakPolarHBondContact CB-O 3.31Å; L1247-L1254 HydrophobicContact CD2-CB 3.99Å; L1247-L1254 HydrophobicContact CD2-CD2 4.17Å; L1247-L1254 VanDerWaalsContact CD2-O 3.26Å; L1247-L1254 WeakPolarHBondContact CD2-O 3.18Å; L1247-Y1256 HydrophobicContact CB-CD1 3.93Å; L1247-Y1256 HydrophobicContact CB-CE1 4.43Å; L1247-I1276 HydrophobicContact CD1-CG1 3.92Å; L1247-I1276 HydrophobicContact CD1-CG2 3.78Å; L1247-I1285 HydrophobicContact CD1-CD1 3.5Å |
| 1248 | S | 86.8 | Confident | 86.8 | Confident | 49 Ų | 49 | 66 Ų | 66 | 34% | 0.343 | 34% | 0.342 | S | S | . | . | trans | -138.8 | 134.6 | -179.6 | 176.9 | 0 | 0 | 0 | 0 | 110.4 | D1250 H1251 L1254 G1255 | S1248-D1250 VanDerWaalsContact C-N 3.27Å; S1248-D1250 PolarHBondContact O-N 3.16Å; S1248-H1251 WeakPolarHBondContact O-CB 3.47Å; S1248-H1251 PolarHBondContact O-N 3.17Å; S1248-L1254 PolarHBondContact N-O 2.9Å; S1248-G1255 WeakPolarHBondContact O-CA 3.27Å | ||
| 1249 | Y | 81.2 | Confident | 86.7 | Confident | 127 Ų | 127 | 67.4 Ų | 67.4 | 50% | 0.498 | 35% | 0.352 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -50.2 | -44.6 | -175.9 | 176.1 | -102.6 | 0 | 0 | 0 | 112.9 | H1251 Y1256 I1258 | Y1249-H1251 VanDerWaalsContact C-N 3.32Å; Y1249-H1251 PolarHBondContact O-N 3.17Å; Y1249-Y1256 HydrophobicContact CD2-CE2 4.35Å; Y1249-Y1256 WeakPolarHBondContact CD2-O 3.47Å; Y1249-I1258 HydrophobicContact CD2-CD1 3.66Å; Y1249-I1258 HydrophobicContact CD2-CG1 3.72Å; Y1249-I1258 HydrophobicContact CE2-CD1 3.94Å; Y1249-I1258 HydrophobicContact CE2-CG1 3.94Å; Y1249-I1258 HydrophobicContact CG-CD1 4.25Å |
| 1250 | D | 82 | Confident | 86.3 | Confident | 128 Ų | 128 | 71.2 Ų | 71.2 | 68% | 0.684 | 37% | 0.369 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.7 | -3 | -176.3 | -56.1 | -67.2 | 0 | 0 | 0 | 114.3 | S1248 | S1248-D1250 VanDerWaalsContact C-N 3.27Å; S1248-D1250 PolarHBondContact O-N 3.16Å |
| 1251 | H | 84.6 | Confident | 85.6 | Confident | 78 Ų | 78 | 72.8 Ų | 72.8 | 36% | 0.361 | 38% | 0.379 | S | S | . | . | trans | -86.2 | 122.8 | -173.2 | -167.4 | -30.2 | 0 | 0 | 0 | 111.9 | S1248 Y1249 Y1253 L1254 G1255 | S1248-H1251 WeakPolarHBondContact O-CB 3.47Å; S1248-H1251 PolarHBondContact O-N 3.17Å; Y1249-H1251 VanDerWaalsContact C-N 3.32Å; Y1249-H1251 PolarHBondContact O-N 3.17Å; H1251-Y1253 VanDerWaalsContact C-N 3.31Å; H1251-Y1253 PolarHBondContact ND1-N 3.36Å; H1251-Y1253 PolarHBondContact O-N 3.36Å; H1251-Y1253 VanDerWaalsContact O-N 3.12Å; H1251-L1254 HydrophobicContact CB-CB 4.12Å; H1251-L1254 PolarHBondContact O-N 2.75Å; H1251-G1255 WeakPolarHBondContact O-CA 3.38Å; H1251-G1255 PolarHBondContact O-N 3.45Å | ||
| 1252 | P | 79.5 | Confident | 85 | Confident | 112 Ų | 112 | 75.5 Ų | 75.5 | 73% | 0.727 | 39% | 0.394 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.6 | -29.9 | -174.7 | 19 | -33 | 0 | 0 | 0 | 115.8 | ||
| 1253 | Y | 79.1 | Confident | 84.3 | Confident | 188 Ų | 188 | 73.2 Ų | 73.2 | 74% | 0.737 | 38% | 0.382 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -110.5 | -21 | -178.7 | -56.5 | -69.6 | 0 | 0 | 0 | 114 | H1251 R1282 | H1251-Y1253 VanDerWaalsContact C-N 3.31Å; H1251-Y1253 PolarHBondContact ND1-N 3.36Å; H1251-Y1253 PolarHBondContact O-N 3.36Å; H1251-Y1253 VanDerWaalsContact O-N 3.12Å; Y1253-R1282 WeakPolarHBondContact O-CD 3.38Å; Y1253-R1282 PolarHBondContact O-NH1 3.36Å |
| 1254 | L | 85.8 | Confident | 83.4 | Confident | 32 Ų | 32 | 73.1 Ų | 73.1 | 17% | 0.168 | 38% | 0.378 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -112.2 | 24.1 | 176.7 | -62 | 178.7 | 0 | 0 | 0 | 112 | T1241 N1245 L1247 S1248 H1251 R1282 | T1241-L1254 HydrophobicContact CG2-CD2 4.47Å; N1245-L1254 HydrophobicContact CB-CD1 4.02Å; L1247-L1254 WeakPolarHBondContact CA-O 3.14Å; L1247-L1254 WeakPolarHBondContact CB-O 3.31Å; L1247-L1254 HydrophobicContact CD2-CB 3.99Å; L1247-L1254 HydrophobicContact CD2-CD2 4.17Å; L1247-L1254 VanDerWaalsContact CD2-O 3.26Å; L1247-L1254 WeakPolarHBondContact CD2-O 3.18Å; S1248-L1254 PolarHBondContact N-O 2.9Å; H1251-L1254 HydrophobicContact CB-CB 4.12Å; H1251-L1254 PolarHBondContact O-N 2.75Å; L1254-R1282 HydrophobicContact CD2-CG 4.43Å |
| 1255 | G | 86.1 | Confident | 82.2 | Confident | 18 Ų | 18 | 76.5 Ų | 76.5 | 19% | 0.186 | 38% | 0.377 | C | S | . | . | trans | -71.9 | 147.6 | 179.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | S1248 H1251 R1282 | S1248-G1255 WeakPolarHBondContact O-CA 3.27Å; H1251-G1255 WeakPolarHBondContact O-CA 3.38Å; H1251-G1255 PolarHBondContact O-N 3.45Å; G1255-R1282 PolarHBondContact O-NH1 3.1Å | ||
| 1256 | Y | 89.4 | Confident | 80.6 | Confident | 30 Ų | 30 | 75.9 Ų | 75.9 | 12% | 0.118 | 38% | 0.378 | C | S | . | . | trans | -125 | 147.7 | 162.2 | 60.9 | -96.3 | 0 | 0 | 0 | 109.2 | L1235 L1247 Y1249 I1258 F1274 | L1235-Y1256 HydrophobicContact CD2-CE2 4.34Å; L1247-Y1256 HydrophobicContact CB-CD1 3.93Å; L1247-Y1256 HydrophobicContact CB-CE1 4.43Å; Y1249-Y1256 HydrophobicContact CD2-CE2 4.35Å; Y1249-Y1256 WeakPolarHBondContact CD2-O 3.47Å; Y1256-I1258 HydrophobicContact CD2-CG1 3.99Å; Y1256-I1258 HydrophobicContact CE2-CD1 4.07Å; Y1256-I1258 HydrophobicContact CE2-CG1 3.73Å; Y1256-F1274 HydrophobicContact CD2-CD1 4.07Å; Y1256-F1274 AromaticContact CE2-CD1 4Å; Y1256-F1274 HydrophobicContact CE2-CD1 4Å; Y1256-F1274 HydrophobicContact CE2-CE1 4.45Å | ||
| 1257 | E | 88.4 | Confident | 79.1 | Confident | 121 Ų | 121 | 74.9 Ų | 74.9 | 57% | 0.565 | 38% | 0.384 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -92.2 | 142.8 | 173.8 | 179.8 | 176.5 | -167.4 | 0 | 0 | 109.6 | F1274 L1275 | E1257-F1274 CarbonylContact O-C 3.56Å; E1257-F1274 WeakPolarHBondContact O-CA 3.3Å; E1257-L1275 HydrophobicContact CB-CB 4.32Å; E1257-L1275 PolarHBondContact N-O 3.24Å; E1257-L1275 PolarHBondContact O-N 3.24Å |
| 1258 | I | 85.3 | Confident | 77.7 | Confident | 43 Ų | 43 | 77.3 Ų | 77.3 | 22% | 0.221 | 41% | 0.409 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.7 | 98.8 | 176 | -50.4 | 170.9 | 0 | 0 | 0 | 108 | Y1249 Y1256 Q1260 N1261 A1273 F1274 | Y1249-I1258 HydrophobicContact CD2-CD1 3.66Å; Y1249-I1258 HydrophobicContact CD2-CG1 3.72Å; Y1249-I1258 HydrophobicContact CE2-CD1 3.94Å; Y1249-I1258 HydrophobicContact CE2-CG1 3.94Å; Y1249-I1258 HydrophobicContact CG-CD1 4.25Å; Y1256-I1258 HydrophobicContact CD2-CG1 3.99Å; Y1256-I1258 HydrophobicContact CE2-CD1 4.07Å; Y1256-I1258 HydrophobicContact CE2-CG1 3.73Å; I1258-Q1260 VanDerWaalsContact CG2-O 3.31Å; I1258-Q1260 WeakPolarHBondContact CG2-O 3.43Å; I1258-Q1260 PolarHBondContact O-N 3Å; I1258-N1261 HydrophobicContact CG2-CB 3.82Å; I1258-A1273 CarbonylContact C-O 3.49Å; I1258-F1274 HydrophobicContact CB-CD1 4.47Å; I1258-F1274 HydrophobicContact CG1-CD1 4.03Å; I1258-F1274 HydrophobicContact CG1-CE1 4.14Å; I1258-F1274 HydrophobicContact CG2-CD1 4.14Å; I1258-F1274 HydrophobicContact CG2-CE1 3.92Å |
| 1259 | I | 84.8 | Confident | 76.8 | Confident | 91 Ų | 91 | 81 Ų | 81 | 47% | 0.467 | 42% | 0.424 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -61.6 | -39 | 178.6 | -53.8 | 165.1 | 0 | 0 | 0 | 110.1 | A1273 L1275 | I1259-A1273 HydrophobicContact CB-CB 4.21Å; I1259-A1273 PolarHBondContact N-O 3.33Å; I1259-L1275 HydrophobicContact CD1-CB 3.94Å; I1259-L1275 HydrophobicContact CG1-CB 3.98Å |
| 1260 | Q | 83.1 | Confident | 76.6 | Confident | 82 Ų | 82 | 77.8 Ų | 77.8 | 38% | 0.383 | 41% | 0.413 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -147.7 | 129.9 | -176 | -173.8 | 174.5 | -29.8 | 0 | 0 | 109.2 | I1258 N1262 K1271 S1272 A1273 | I1258-Q1260 VanDerWaalsContact CG2-O 3.31Å; I1258-Q1260 WeakPolarHBondContact CG2-O 3.43Å; I1258-Q1260 PolarHBondContact O-N 3Å; Q1260-N1262 PolarHBondContact NE2-ND2 3.13Å; Q1260-K1271 PolarHBondContact NE2-O 3.16Å; Q1260-S1272 CarbonylContact O-C 3.58Å; Q1260-S1272 WeakPolarHBondContact O-CA 3.49Å; Q1260-S1272 WeakPolarHBondContact O-CB 3.26Å; Q1260-A1273 HydrophobicContact CB-CB 4.02Å; Q1260-A1273 PolarHBondContact N-O 3.04Å; Q1260-A1273 PolarHBondContact O-N 3.13Å |
| 1261 | N | 78.1 | Confident | 76.5 | Confident | 63 Ų | 63 | 76 Ų | 76 | 34% | 0.337 | 40% | 0.399 | S | S | . | . | trans | -127.2 | 93.4 | 174.8 | -170.1 | -16.2 | 0 | 0 | 0 | 110 | I1258 | I1258-N1261 HydrophobicContact CG2-CB 3.82Š| ||
| 1262 | N | 78.8 | Confident | 76.5 | Confident | 59 Ų | 59 | 72.3 Ų | 72.3 | 32% | 0.316 | 38% | 0.382 | S | S | . | . | trans | -107.1 | -15.3 | 175.4 | -65.8 | -8.7 | 0 | 0 | 0 | 112.8 | Q1260 H1264 F1265 K1270 K1271 S1272 | Q1260-N1262 PolarHBondContact NE2-ND2 3.13Å; N1262-H1264 PolarHBondContact O-N 3.11Å; N1262-H1264 VanDerWaalsContact O-N 3.12Å; N1262-F1265 PolarHBondContact O-N 3.28Å; N1262-K1270 HydrophobicContact CB-CB 3.84Å; N1262-K1270 HydrophobicContact CB-CD 4.14Å; N1262-K1270 HydrophobicContact CB-CG 4.3Å; N1262-K1270 VanDerWaalsContact O-CG 3.3Å; N1262-K1270 WeakPolarHBondContact O-CG 3.47Å; N1262-K1271 WeakPolarHBondContact CB-O 3.45Å; N1262-S1272 PolarHBondContact N-OG 3.08Å | ||
| 1263 | C | 74.2 | Confident | 76.9 | Confident | 3 Ų | 3 | 67.2 Ų | 67.2 | 2% | 0.02 | 35% | 0.35 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -63.1 | -16.4 | 179.7 | -59.7 | 0 | 0 | 0 | 0 | 113.8 | E1216 C1218 F1236 F1265 S1272 | E1216-C1263 VanDerWaalsContact CD-SG 3.57Å; E1216-C1263 PolarHBondContact OE2-SG 3.37Å; C1218-C1263 HydrophobicContact CB-CB 4.01Å; C1218-C1263 WeakPolarHBondContact CB-SG 3.06Å; C1218-C1263 WeakPolarHBondContact SG-CA 3.4Å; C1218-C1263 WeakPolarHBondContact SG-CB 3.46Å; C1218-C1263 CovalentContact SG-SG 2.02Å; C1218-C1263 PolarHBondContact SG-SG 3.35Å; F1236-C1263 HydrophobicContact CD2-CB 4.37Å; F1236-C1263 HydrophobicContact CE2-CB 4.33Å; C1263-F1265 PolarHBondContact O-N 3.24Å; C1263-S1272 PolarHBondContact N-OG 3.04Å; C1263-S1272 PolarHBondContact SG-OG 3.33Å |
| 1264 | H | 65.5 | Low | 77.4 | Confident | 97 Ų | 97 | 58.3 Ų | 58.3 | 45% | 0.449 | 32% | 0.315 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -67.5 | -11 | 175.3 | -159.2 | 65.7 | 0 | 0 | 0 | 114.4 | N1262 | N1262-H1264 PolarHBondContact O-N 3.11Å; N1262-H1264 VanDerWaalsContact O-N 3.12Å |
| 1265 | F | 61.4 | Low | 77.7 | Confident | 124 Ų | 124 | 58.3 Ų | 58.3 | 54% | 0.544 | 32% | 0.315 | S | S | . | . | S | Bend | trans | -103.9 | 119.4 | -177.2 | -67.1 | -77.4 | 0 | 0 | 0 | 112.9 | N1262 C1263 A1267 | N1262-F1265 PolarHBondContact O-N 3.28Å; C1263-F1265 PolarHBondContact O-N 3.24Å; F1265-A1267 VanDerWaalsContact C-N 3.26Å; F1265-A1267 PolarHBondContact O-N 3.14Å |
| 1266 | P | 56.8 | Low | 78 | Confident | 61 Ų | 61 | 57.4 Ų | 57.4 | 40% | 0.396 | 31% | 0.306 | S | S | . | . | S | Bend | trans | -81.4 | 39.8 | -166.5 | 35.1 | -39.6 | 0 | 0 | 0 | 115.3 | I1220 | I1220-P1266 HydrophobicContact CD1-CB 4.32Š|
| 1267 | A | 60.1 | Low | 78.2 | Confident | 63 Ų | 63 | 61.3 Ų | 61.3 | 52% | 0.521 | 32% | 0.324 | S | S | . | . | S | Bend | trans | -155.2 | 112.9 | -177.5 | 0 | 0 | 0 | 0 | 0 | 115 | F1265 K1270 | F1265-A1267 VanDerWaalsContact C-N 3.26Å; F1265-A1267 PolarHBondContact O-N 3.14Å; A1267-K1270 WeakPolarHBondContact O-CE 3.46Å; A1267-K1270 PolarHBondContact O-NZ 3.42Å |
| 1268 | G | 60.7 | Low | 78.4 | Confident | 54 Ų | 54 | 56.6 Ų | 56.6 | 56% | 0.557 | 31% | 0.307 | S | S | * | . | S | Bend | trans | 82.5 | 167.3 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | K1270 | G1268-K1270 WeakPolarHBondContact O-CG 3.41Å; G1268-K1270 PolarHBondContact O-N 3.39Å |
| 1269 | L | 67.8 | Low | 78.7 | Confident | 126 Ų | 126 | 57.7 Ų | 57.7 | 66% | 0.66 | 32% | 0.319 | S | S | * | . | trans | -61.7 | 130.8 | -179.7 | -147.7 | 110.9 | 0 | 0 | 0 | 110.7 | ||||
| 1270 | K | 77.3 | Confident | 79.1 | Confident | 61 Ų | 61 | 54.1 Ų | 54.1 | 27% | 0.265 | 30% | 0.301 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.8 | 164.9 | -180 | -57.4 | -59 | 170 | -159.2 | 0 | 110.7 | D1217 C1218 N1262 A1267 G1268 | D1217-K1270 WeakPolarHBondContact CA-O 3.2Å; C1218-K1270 PolarHBondContact N-O 3.18Å; C1218-K1270 PolarHBondContact O-N 3.1Å; C1218-K1270 VanDerWaalsContact SG-CB 3.54Å; N1262-K1270 HydrophobicContact CB-CB 3.84Å; N1262-K1270 HydrophobicContact CB-CD 4.14Å; N1262-K1270 HydrophobicContact CB-CG 4.3Å; N1262-K1270 VanDerWaalsContact O-CG 3.3Å; N1262-K1270 WeakPolarHBondContact O-CG 3.47Å; A1267-K1270 WeakPolarHBondContact O-CE 3.46Å; A1267-K1270 PolarHBondContact O-NZ 3.42Å; G1268-K1270 WeakPolarHBondContact O-CG 3.41Å; G1268-K1270 PolarHBondContact O-N 3.39Å |
| 1271 | K | 81 | Confident | 79.4 | Confident | 90 Ų | 90 | 52.8 Ų | 52.8 | 39% | 0.391 | 30% | 0.304 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -132.1 | 123.2 | 174.9 | -64.3 | -171.4 | 164.7 | -89.9 | 0 | 109.7 | E1216 D1217 Q1260 N1262 | E1216-K1271 CarbonylContact O-C 3.56Å; E1216-K1271 WeakPolarHBondContact O-CA 3.15Å; D1217-K1271 WeakPolarHBondContact OD1-CE 3.18Å; D1217-K1271 WeakPolarHBondContact OD1-CG 3.39Å; D1217-K1271 IonicContact OD1-NZ 2.64Å; D1217-K1271 PolarHBondContact OD1-NZ 3.43Å; D1217-K1271 IonicContact OD2-NZ 2.65Å; D1217-K1271 PolarHBondContact OD2-NZ 3.44Å; Q1260-K1271 PolarHBondContact NE2-O 3.16Å; N1262-K1271 WeakPolarHBondContact CB-O 3.45Å |
| 1272 | S | 83.8 | Confident | 80 | Confident | 0 Ų | 0 | 51.1 Ų | 51.1 | 0% | 0 | 29% | 0.293 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -104 | 153.3 | 162 | -68.4 | 0 | 0 | 0 | 0 | 110.2 | Y1215 E1216 Q1260 N1262 C1263 | Y1215-S1272 WeakPolarHBondContact CA-O 3.42Å; E1216-S1272 PolarHBondContact N-O 3.47Å; E1216-S1272 PolarHBondContact O-N 3.26Å; Q1260-S1272 CarbonylContact O-C 3.58Å; Q1260-S1272 WeakPolarHBondContact O-CA 3.49Å; Q1260-S1272 WeakPolarHBondContact O-CB 3.26Å; N1262-S1272 PolarHBondContact N-OG 3.08Å; C1263-S1272 PolarHBondContact N-OG 3.04Å; C1263-S1272 PolarHBondContact SG-OG 3.33Å |
| 1273 | A | 87.6 | Confident | 80.7 | Confident | 6 Ų | 6 | 48.3 Ų | 48.3 | 5% | 0.05 | 28% | 0.278 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -141.2 | 128.2 | -176.3 | 0 | 0 | 0 | 0 | 0 | 110.8 | I1214 Y1215 I1258 I1259 Q1260 | I1214-A1273 WeakPolarHBondContact O-CA 3.3Å; Y1215-A1273 HydrophobicContact CD1-CB 3.7Å; Y1215-A1273 HydrophobicContact CE1-CB 4.04Å; I1258-A1273 CarbonylContact C-O 3.49Å; I1259-A1273 HydrophobicContact CB-CB 4.21Å; I1259-A1273 PolarHBondContact N-O 3.33Å; Q1260-A1273 HydrophobicContact CB-CB 4.02Å; Q1260-A1273 PolarHBondContact N-O 3.04Å; Q1260-A1273 PolarHBondContact O-N 3.13Å |
| 1274 | F | 89.9 | Confident | 81.6 | Confident | 0 Ų | 0 | 48.2 Ų | 48.2 | 0% | 0 | 28% | 0.277 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.3 | 137.3 | -172.9 | -50.1 | -70.5 | 0 | 0 | 0 | 110.2 | Q1213 I1214 E1216 L1235 I1237 Y1256 E1257 I1258 | Q1213-F1274 VanDerWaalsContact CA-O 3.26Å; Q1213-F1274 WeakPolarHBondContact CA-O 3.39Å; I1214-F1274 HydrophobicContact CB-CB 4.46Å; I1214-F1274 HydrophobicContact CB-CD2 4.34Å; I1214-F1274 HydrophobicContact CG2-CD2 4.43Å; I1214-F1274 PolarHBondContact N-O 3.27Å; I1214-F1274 WeakPolarHBondContact O-CD2 3.45Å; I1214-F1274 PolarHBondContact O-N 3.25Å; E1216-F1274 HydrophobicContact CB-CE2 3.86Å; E1216-F1274 WeakPolarHBondContact OE2-CZ 3.22Å; L1235-F1274 HydrophobicContact CD1-CE1 3.65Å; L1235-F1274 HydrophobicContact CD1-CZ 3.73Å; L1235-F1274 HydrophobicContact CD2-CD1 4.34Å; L1235-F1274 HydrophobicContact CD2-CE1 3.6Å; L1235-F1274 HydrophobicContact CD2-CE2 4.48Å; L1235-F1274 HydrophobicContact CD2-CZ 3.68Å; L1235-F1274 HydrophobicContact CG-CE1 4.07Å; L1235-F1274 HydrophobicContact CG-CZ 3.89Å; I1237-F1274 HydrophobicContact CD1-CD2 3.87Å; I1237-F1274 HydrophobicContact CD1-CE2 3.51Å; I1237-F1274 HydrophobicContact CD1-CZ 4.25Å; I1237-F1274 HydrophobicContact CG1-CE2 4.36Å; Y1256-F1274 HydrophobicContact CD2-CD1 4.07Å; Y1256-F1274 AromaticContact CE2-CD1 4Å; Y1256-F1274 HydrophobicContact CE2-CD1 4Å; Y1256-F1274 HydrophobicContact CE2-CE1 4.45Å; E1257-F1274 CarbonylContact O-C 3.56Å; E1257-F1274 WeakPolarHBondContact O-CA 3.3Å; I1258-F1274 HydrophobicContact CB-CD1 4.47Å; I1258-F1274 HydrophobicContact CG1-CD1 4.03Å; I1258-F1274 HydrophobicContact CG1-CE1 4.14Å; I1258-F1274 HydrophobicContact CG2-CD1 4.14Å; I1258-F1274 HydrophobicContact CG2-CE1 3.92Å |
| 1275 | L | 92.3 | Very high | 82.9 | Confident | 32 Ų | 32 | 43.6 Ų | 43.6 | 17% | 0.168 | 26% | 0.256 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.9 | 114.3 | 173 | 175.2 | 58.8 | 0 | 0 | 0 | 109.5 | Q1213 E1257 I1259 | Q1213-L1275 HydrophobicContact CG-CD1 3.81Å; E1257-L1275 HydrophobicContact CB-CB 4.32Å; E1257-L1275 PolarHBondContact N-O 3.24Å; E1257-L1275 PolarHBondContact O-N 3.24Å; I1259-L1275 HydrophobicContact CD1-CB 3.94Å; I1259-L1275 HydrophobicContact CG1-CB 3.98Å |
| 1276 | I | 92.9 | Very high | 84.4 | Confident | 0 Ų | 0 | 40.4 Ų | 40.4 | 0% | 0 | 24% | 0.24 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -98.3 | 118.8 | 170.7 | -47.7 | 83.1 | 0 | 0 | 0 | 106.6 | T1211 Q1212 I1214 L1239 L1247 F1283 I1285 | T1211-I1276 CarbonylContact C-O 3.59Å; T1211-I1276 WeakPolarHBondContact CA-O 3.46Å; Q1212-I1276 PolarHBondContact N-O 3.42Å; Q1212-I1276 WeakPolarHBondContact O-CD1 3.19Å; Q1212-I1276 PolarHBondContact O-N 3.23Å; I1214-I1276 HydrophobicContact CD1-CD1 4.02Å; I1214-I1276 HydrophobicContact CG1-CD1 4.09Å; L1239-I1276 HydrophobicContact CD1-CD1 4.23Å; L1239-I1276 HydrophobicContact CD1-CG1 4.5Å; L1247-I1276 HydrophobicContact CD1-CG1 3.92Å; L1247-I1276 HydrophobicContact CD1-CG2 3.78Å; I1276-F1283 HydrophobicContact CB-CE1 3.96Å; I1276-F1283 HydrophobicContact CB-CZ 4.12Å; I1276-F1283 HydrophobicContact CG2-CE1 3.81Å; I1276-F1283 HydrophobicContact CG2-CZ 3.68Å; I1276-F1283 WeakPolarHBondContact O-CZ 3.47Å; I1276-I1285 HydrophobicContact CD1-CG1 4.49Å; I1276-I1285 HydrophobicContact CG1-CD1 4.37Å; I1276-I1285 HydrophobicContact CG2-CD1 4.38Å |
| 1277 | K | 92.9 | Very high | 86 | Confident | 112 Ų | 112 | 37.5 Ų | 37.5 | 49% | 0.487 | 22% | 0.222 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -136.1 | 138.7 | 176.3 | -177.2 | 167.3 | -172.4 | 171.7 | 0 | 111.1 | I1209 G1210 T1211 R1282 | I1209-K1277 HydrophobicContact CG2-CG 3.94Å; G1210-K1277 WeakPolarHBondContact O-CA 3.34Å; T1211-K1277 HydrophobicContact CG2-CB 4.07Å; T1211-K1277 HydrophobicContact CG2-CD 3.72Å; T1211-K1277 HydrophobicContact CG2-CG 3.66Å; K1277-R1282 PolarHBondContact O-NH2 3.31Å |
| 1278 | G | 91.6 | Very high | 87.4 | Confident | 22 Ų | 22 | 34.5 Ų | 34.5 | 23% | 0.227 | 20% | 0.197 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | 151.9 | -154.7 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113 | I1209 G1210 T1280 | I1209-G1278 WeakPolarHBondContact CA-O 3.25Å; G1210-G1278 PolarHBondContact N-O 2.77Å; G1210-G1278 PolarHBondContact O-N 2.77Å; G1210-G1278 VanDerWaalsContact O-N 3.08Å; G1278-T1280 PolarHBondContact O-N 3.42Å |
| 1279 | S | 92.1 | Very high | 88.6 | Confident | 65 Ų | 65 | 33.8 Ų | 33.8 | 46% | 0.455 | 18% | 0.179 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -54.3 | 135.9 | -177.5 | 177 | 0 | 0 | 0 | 0 | 113.4 | A1281 R1282 F1283 | S1279-A1281 PolarHBondContact O-N 3.37Å; S1279-A1281 PolarHBondContact OG-N 3.06Å; S1279-R1282 PolarHBondContact O-N 3.13Å; S1279-R1282 VanDerWaalsContact O-N 3.13Å; S1279-F1283 VanDerWaalsContact O-CD2 3.28Å; S1279-F1283 WeakPolarHBondContact O-CD2 3.48Å |
| 1280 | T | 93.3 | Very high | 89.3 | Confident | 17 Ų | 17 | 27.8 Ų | 27.8 | 10% | 0.104 | 15% | 0.148 | C | C | . | . | G | 310 helix | trans | -55.7 | -27.2 | 176.8 | 53.6 | 0 | 0 | 0 | 0 | 113.7 | K1204 S1207 G1278 R1282 F1283 F1307 | K1204-T1280 PolarHBondContact O-OG1 3.31Å; S1207-T1280 WeakPolarHBondContact O-CG2 3.38Å; G1278-T1280 PolarHBondContact O-N 3.42Å; T1280-R1282 PolarHBondContact O-N 2.98Å; T1280-R1282 VanDerWaalsContact O-N 3.12Å; T1280-F1283 PolarHBondContact O-N 3.38Å; T1280-F1307 HydrophobicContact CG2-CD1 3.97Å |
| 1281 | A | 89.8 | Confident | 89.2 | Confident | 54 Ų | 54 | 26.9 Ų | 26.9 | 45% | 0.446 | 15% | 0.146 | S | C | . | . | G | 310 helix | trans | -66.6 | -7.6 | 177.2 | 0 | 0 | 0 | 0 | 0 | 114.9 | N1242 S1279 | N1242-A1281 PolarHBondContact OD1-O 3.39Å; N1242-A1281 VanDerWaalsContact OD1-O 3.08Å; S1279-A1281 PolarHBondContact O-N 3.37Å; S1279-A1281 PolarHBondContact OG-N 3.06Å |
| 1282 | R | 90.9 | Very high | 88.6 | Confident | 27 Ų | 27 | 24.6 Ų | 24.6 | 10% | 0.102 | 14% | 0.138 | C | C | . | . | G | 310 helix | trans | -93.6 | -11.7 | 172.1 | -58 | -176.9 | -51 | 159.3 | 22.5 | 112.9 | T1241 N1242 Y1253 L1254 G1255 K1277 S1279 T1280 | T1241-R1282 WeakPolarHBondContact CA-O 3.43Å; T1241-R1282 WeakPolarHBondContact CB-O 3.04Å; T1241-R1282 HydrophobicContact CG2-CB 3.85Å; T1241-R1282 HydrophobicContact CG2-CG 4.43Å; T1241-R1282 WeakPolarHBondContact CG2-O 3.03Å; N1242-R1282 PolarHBondContact N-O 3.34Å; Y1253-R1282 WeakPolarHBondContact O-CD 3.38Å; Y1253-R1282 PolarHBondContact O-NH1 3.36Å; L1254-R1282 HydrophobicContact CD2-CG 4.43Å; G1255-R1282 PolarHBondContact O-NH1 3.1Å; K1277-R1282 PolarHBondContact O-NH2 3.31Å; S1279-R1282 PolarHBondContact O-N 3.13Å; S1279-R1282 VanDerWaalsContact O-N 3.13Å; T1280-R1282 PolarHBondContact O-N 2.98Å; T1280-R1282 VanDerWaalsContact O-N 3.12Å |
| 1283 | F | 93.6 | Very high | 87.5 | Confident | 0 Ų | 0 | 24.7 Ų | 24.7 | 0% | 0 | 14% | 0.139 | C | C | . | . | trans | -108.6 | 159.6 | -170.4 | -66.2 | -86.4 | 0 | 0 | 0 | 112.1 | K1204 G1210 Q1212 N1242 I1276 S1279 T1280 V1305 F1307 | K1204-F1283 WeakPolarHBondContact CE-O 3.5Å; K1204-F1283 PolarHBondContact NZ-O 2.91Å; G1210-F1283 VanDerWaalsContact C-CZ 3.42Å; G1210-F1283 WeakPolarHBondContact O-CE2 3.46Å; G1210-F1283 WeakPolarHBondContact O-CZ 3.4Å; Q1212-F1283 HydrophobicContact CB-CD1 4.08Å; Q1212-F1283 HydrophobicContact CB-CE1 3.76Å; N1242-F1283 WeakPolarHBondContact CB-O 3.23Å; I1276-F1283 HydrophobicContact CB-CE1 3.96Å; I1276-F1283 HydrophobicContact CB-CZ 4.12Å; I1276-F1283 HydrophobicContact CG2-CE1 3.81Å; I1276-F1283 HydrophobicContact CG2-CZ 3.68Å; I1276-F1283 WeakPolarHBondContact O-CZ 3.47Å; S1279-F1283 VanDerWaalsContact O-CD2 3.28Å; S1279-F1283 WeakPolarHBondContact O-CD2 3.48Å; T1280-F1283 PolarHBondContact O-N 3.38Å; F1283-V1305 HydrophobicContact CB-CG2 4.05Å; F1283-V1305 HydrophobicContact CD1-CG2 3.93Å; F1283-V1305 HydrophobicContact CG-CG2 4.32Å; F1283-F1307 HydrophobicContact CB-CE1 3.99Å; F1283-F1307 HydrophobicContact CB-CZ 4.22Å | ||
| 1284 | P | 92.6 | Very high | 86 | Confident | 1 Ų | 1 | 27.8 Ų | 27.8 | 1% | 0.006 | 15% | 0.151 | C | C | . | . | S | Bend | cis | -63.5 | 165.3 | -13.9 | 27.4 | -34.9 | 0 | 0 | 0 | 112.9 | Y1193 L1200 N1242 R1286 V1305 | Y1193-P1284 HydrophobicContact CD1-CB 4.26Å; Y1193-P1284 HydrophobicContact CD2-CB 3.93Å; Y1193-P1284 HydrophobicContact CD2-CG 3.87Å; Y1193-P1284 HydrophobicContact CE1-CB 3.78Å; Y1193-P1284 HydrophobicContact CE2-CB 3.45Å; Y1193-P1284 VanDerWaalsContact CE2-CB 3.45Å; Y1193-P1284 HydrophobicContact CE2-CG 3.79Å; Y1193-P1284 HydrophobicContact CG-CB 4.33Å; Y1193-P1284 HydrophobicContact CG-CG 4.39Å; L1200-P1284 HydrophobicContact CD2-CG 4.2Å; N1242-P1284 WeakPolarHBondContact CA-O 3.2Å; N1242-P1284 WeakPolarHBondContact CB-O 3.48Å; N1242-P1284 PolarHBondContact N-O 3.42Å; P1284-R1286 PolarHBondContact O-N 3.29Å; P1284-V1305 HydrophobicContact CB-CB 4.48Å; P1284-V1305 HydrophobicContact CB-CG1 4.22Å; P1284-V1305 HydrophobicContact CB-CG2 4.35Å |
| 1285 | I | 93.2 | Very high | 84.6 | Confident | 0 Ų | 0 | 28.2 Ų | 28.2 | 0% | 0 | 15% | 0.153 | C | C | . | . | trans | -63.7 | 124.3 | 161.6 | -56.4 | -49.8 | 0 | 0 | 0 | 107.4 | L1191 Y1193 Q1212 I1214 L1239 F1240 L1247 I1276 | L1191-I1285 HydrophobicContact CD1-CB 4.26Å; L1191-I1285 HydrophobicContact CD1-CG2 3.99Å; L1191-I1285 WeakPolarHBondContact CD1-O 3.4Å; Y1193-I1285 VanDerWaalsContact CE2-O 3.28Å; Y1193-I1285 WeakPolarHBondContact CE2-O 3.44Å; Y1193-I1285 PolarHBondContact OH-O 2.89Å; Q1212-I1285 VanDerWaalsContact OE1-N 3.16Å; I1214-I1285 HydrophobicContact CD1-CG1 4.31Å; I1214-I1285 HydrophobicContact CD1-CG2 4.28Å; L1239-I1285 HydrophobicContact CB-CG2 4.49Å; F1240-I1285 CarbonylContact O-C 3.58Å; F1240-I1285 WeakPolarHBondContact O-CA 3.32Å; F1240-I1285 WeakPolarHBondContact O-CG2 3.43Å; L1247-I1285 HydrophobicContact CD1-CD1 3.5Å; I1276-I1285 HydrophobicContact CD1-CG1 4.49Å; I1276-I1285 HydrophobicContact CG1-CD1 4.37Å; I1276-I1285 HydrophobicContact CG2-CD1 4.38Å | ||
| 1286 | R | 91.4 | Very high | 83.2 | Confident | 57 Ų | 57 | 26.7 Ų | 26.7 | 22% | 0.215 | 15% | 0.145 | C | C | . | . | trans | -104.9 | -24.2 | -175.8 | -91.3 | -65.3 | -165 | -167.8 | 4.2 | 114 | E1190 L1191 E1196 F1240 N1242 P1284 | E1190-R1286 CarbonylContact C-O 3.11Å; E1190-R1286 WeakPolarHBondContact CA-O 3.22Å; L1191-R1286 PolarHBondContact N-O 3.16Å; L1191-R1286 WeakPolarHBondContact O-CD 3.42Å; L1191-R1286 PolarHBondContact O-NH1 3.43Å; E1196-R1286 IonicContact OE1-CZ 2.71Å; E1196-R1286 VanDerWaalsContact OE1-CZ 3.22Å; E1196-R1286 IonicContact OE1-NH1 2.84Å; E1196-R1286 PolarHBondContact OE1-NH1 3Å; E1196-R1286 IonicContact OE1-NH2 2.93Å; E1196-R1286 PolarHBondContact OE1-NH2 3.02Å; F1240-R1286 PolarHBondContact O-N 3.34Å; N1242-R1286 HydrophobicContact CB-CG 4.12Å; P1284-R1286 PolarHBondContact O-N 3.29Å | ||
| 1287 | G | 90.9 | Very high | 82 | Confident | 1 Ų | 1 | 31 Ų | 31 | 1% | 0.01 | 17% | 0.165 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -130.9 | 143.2 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | Y1189 F1240 | Y1189-G1287 WeakPolarHBondContact O-CA 3.5Å; F1240-G1287 PolarHBondContact N-O 2.9Å; F1240-G1287 PolarHBondContact O-N 3.27Å |
| 1288 | I | 89.5 | Confident | 80.9 | Confident | 0 Ų | 0 | 25.7 Ų | 25.7 | 0% | 0 | 14% | 0.142 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -127.3 | 127 | 162.9 | -58.5 | -173.7 | 0 | 0 | 0 | 107.9 | L1167 F1188 Y1189 L1191 I1214 I1237 K1238 L1239 L1290 V1300 I1302 | L1167-I1288 HydrophobicContact CD1-CB 4.29Å; L1167-I1288 HydrophobicContact CD1-CD1 4.32Å; F1188-I1288 CarbonylContact C-O 3.59Å; F1188-I1288 WeakPolarHBondContact CA-O 3.34Å; Y1189-I1288 PolarHBondContact N-O 3.45Å; Y1189-I1288 PolarHBondContact O-N 2.82Å; L1191-I1288 HydrophobicContact CD1-CD1 3.97Å; L1191-I1288 HydrophobicContact CD1-CG1 3.91Å; L1191-I1288 HydrophobicContact CD2-CD1 4.38Å; L1191-I1288 HydrophobicContact CD2-CG1 4.5Å; L1191-I1288 HydrophobicContact CG-CG1 4.37Å; I1214-I1288 HydrophobicContact CD1-CD1 4.22Å; I1214-I1288 HydrophobicContact CG2-CD1 4.38Å; I1237-I1288 HydrophobicContact CB-CG2 4.32Å; K1238-I1288 WeakPolarHBondContact O-CA 3.34Å; L1239-I1288 HydrophobicContact CD2-CD1 4.04Å; L1239-I1288 HydrophobicContact CD2-CG1 3.84Å; L1239-I1288 HydrophobicContact CD2-CG2 4.35Å; I1288-L1290 HydrophobicContact CG2-CD2 3.93Å; I1288-V1300 HydrophobicContact CD1-CG1 3.92Å; I1288-I1302 HydrophobicContact CD1-CD1 4.29Å; I1288-I1302 HydrophobicContact CD1-CG1 3.71Å |
| 1289 | E | 86.3 | Confident | 80.2 | Confident | 39 Ų | 39 | 27.4 Ų | 27.4 | 18% | 0.182 | 15% | 0.146 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -107.8 | 115.6 | 172.6 | -178.7 | -179.2 | -163.4 | 0 | 0 | 109 | S1186 F1188 I1237 K1238 F1240 L1291 | S1186-E1289 WeakPolarHBondContact CB-OE1 3.14Å; S1186-E1289 PolarHBondContact OG-OE1 3.37Å; F1188-E1289 HydrophobicContact CD2-CB 4.2Å; I1237-E1289 CarbonylContact C-O 3.59Å; I1237-E1289 WeakPolarHBondContact CA-O 3.04Å; K1238-E1289 HydrophobicContact CB-CB 4.24Å; K1238-E1289 VanDerWaalsContact CD-OE2 3.3Å; K1238-E1289 WeakPolarHBondContact CD-OE2 3.48Å; K1238-E1289 PolarHBondContact N-O 3.1Å; K1238-E1289 PolarHBondContact O-N 3.49Å; F1240-E1289 HydrophobicContact CE2-CB 3.78Å; F1240-E1289 HydrophobicContact CZ-CB 4.5Å; E1289-L1291 HydrophobicContact CG-CD2 4.21Å |
| 1290 | L | 81.6 | Confident | 79.8 | Confident | 0 Ų | 0 | 24.3 Ų | 24.3 | 0% | 0 | 12% | 0.124 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -80.3 | 121.3 | 172.9 | -53.7 | -172.8 | 0 | 0 | 0 | 109.1 | S1186 Q1187 Y1189 I1237 I1288 V1300 | S1186-L1290 CarbonylContact C-O 3.6Å; S1186-L1290 VanDerWaalsContact CA-O 3.25Å; S1186-L1290 WeakPolarHBondContact CA-O 3.21Å; S1186-L1290 WeakPolarHBondContact CB-O 3.1Å; Q1187-L1290 PolarHBondContact N-O 3.46Å; Q1187-L1290 PolarHBondContact O-N 3.33Å; Y1189-L1290 HydrophobicContact CD2-CD1 4.36Å; Y1189-L1290 HydrophobicContact CD2-CG 4.18Å; Y1189-L1290 HydrophobicContact CE2-CD1 3.57Å; Y1189-L1290 HydrophobicContact CE2-CG 3.78Å; I1237-L1290 HydrophobicContact CG2-CD2 3.64Å; I1288-L1290 HydrophobicContact CG2-CD2 3.93Å; L1290-V1300 HydrophobicContact CD2-CG2 3.73Å |
| 1291 | L | 75.7 | Confident | 79.5 | Confident | 42 Ų | 42 | 26.9 Ų | 26.9 | 22% | 0.22 | 14% | 0.135 | C | C | . | . | S | Bend | trans | -90.1 | 136.8 | 174.7 | -55.6 | 179.7 | 0 | 0 | 0 | 109.3 | F1236 K1238 E1289 | F1236-L1291 PolarHBondContact O-N 3.11Å; K1238-L1291 HydrophobicContact CD-CD2 4.29Å; K1238-L1291 HydrophobicContact CG-CD1 4.23Å; E1289-L1291 HydrophobicContact CG-CD2 4.21Å |
| 1292 | N | 69.2 | Low | 79.4 | Confident | 41 Ų | 41 | 24.7 Ų | 24.7 | 22% | 0.219 | 12% | 0.116 | C | C | . | . | trans | 58.2 | 43.3 | 173.1 | -46.6 | -26.4 | 0 | 0 | 0 | 116.1 | L1184 K1294 I1295 S1296 | L1184-N1292 WeakPolarHBondContact CB-OD1 3.45Å; L1184-N1292 HydrophobicContact CD2-CB 4.5Å; L1184-N1292 WeakPolarHBondContact CD2-OD1 3.4Å; L1184-N1292 HydrophobicContact CG-CB 4.44Å; N1292-K1294 PolarHBondContact O-N 3.28Å; N1292-K1294 VanDerWaalsContact O-N 3.08Å; N1292-I1295 HydrophobicContact CB-CD1 4.34Å; N1292-I1295 PolarHBondContact O-N 3.48Å; N1292-S1296 PolarHBondContact O-N 2.89Å; N1292-S1296 PolarHBondContact O-OG 3.32Å | ||
| 1293 | P | 61 | Low | 79.3 | Confident | 3 Ų | 3 | 24.2 Ų | 24.2 | 2% | 0.019 | 12% | 0.119 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -64.8 | -13 | -179.9 | 31.6 | -36.9 | 0 | 0 | 0 | 114 | Y1171 G1185 I1295 | Y1171-P1293 HydrophobicContact CD2-CB 4.27Å; Y1171-P1293 HydrophobicContact CD2-CG 4.08Å; Y1171-P1293 HydrophobicContact CE2-CG 4.06Å; G1185-P1293 WeakPolarHBondContact O-CD 3.26Å; P1293-I1295 VanDerWaalsContact C-N 3.3Å |
| 1294 | K | 56.4 | Low | 79.2 | Confident | 70 Ų | 70 | 26.1 Ų | 26.1 | 30% | 0.304 | 13% | 0.128 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -66.3 | -29.2 | 169.1 | -71.5 | -179.2 | 174.8 | 173.9 | 0 | 112.6 | E1180 N1183 N1292 | E1180-K1294 IonicContact OE2-NZ 2.68Å; E1180-K1294 PolarHBondContact OE2-NZ 3.2Å; N1183-K1294 WeakPolarHBondContact O-CE 3.17Å; N1183-K1294 PolarHBondContact O-NZ 3.42Å; N1292-K1294 PolarHBondContact O-N 3.28Å; N1292-K1294 VanDerWaalsContact O-N 3.08Å |
| 1295 | I | 59.2 | Low | 79.3 | Confident | 10 Ų | 10 | 26.1 Ų | 26.1 | 5% | 0.051 | 13% | 0.128 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -102 | -24.3 | -169.7 | -69.5 | 160.4 | 0 | 0 | 0 | 112.5 | L1184 K1221 H1224 L1227 N1292 P1293 | L1184-I1295 HydrophobicContact CD1-CD1 4.01Å; L1184-I1295 HydrophobicContact CD2-CD1 3.95Å; L1184-I1295 HydrophobicContact CG-CD1 3.97Å; K1221-I1295 PolarHBondContact N-O 3.28Å; H1224-I1295 HydrophobicContact CB-CG1 4.31Å; H1224-I1295 HydrophobicContact CB-CG2 3.87Å; L1227-I1295 HydrophobicContact CD1-CD1 3.74Å; N1292-I1295 HydrophobicContact CB-CD1 4.34Å; N1292-I1295 PolarHBondContact O-N 3.48Å; P1293-I1295 VanDerWaalsContact C-N 3.3Å |
| 1296 | S | 62.4 | Low | 79.5 | Confident | 0 Ų | 0 | 26.3 Ų | 26.3 | 0% | 0 | 13% | 0.129 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -135.1 | 133.3 | -175 | 49.8 | 0 | 0 | 0 | 0 | 111.4 | S1169 S1219 N1292 N1298 | S1169-S1296 PolarHBondContact OG-O 3.26Å; S1219-S1296 CarbonylContact O-C 3.42Å; S1219-S1296 WeakPolarHBondContact O-CA 3.43Å; N1292-S1296 PolarHBondContact O-N 2.89Å; N1292-S1296 PolarHBondContact O-OG 3.32Å; S1296-N1298 WeakPolarHBondContact CB-OD1 3.02Å; S1296-N1298 PolarHBondContact O-N 3.17Å; S1296-N1298 PolarHBondContact OG-ND2 3.38Å |
| 1297 | E | 67.7 | Low | 79.8 | Confident | 91 Ų | 91 | 23.6 Ų | 23.6 | 43% | 0.425 | 12% | 0.119 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -82.6 | 105.4 | 163.8 | -93.5 | 161.9 | -153.4 | 0 | 0 | 107.9 | S1219 K1221 | S1219-E1297 PolarHBondContact N-O 3.04Å; S1219-E1297 PolarHBondContact O-N 3.27Å; K1221-E1297 VanDerWaalsContact CE-CD 3.49Å; K1221-E1297 WeakPolarHBondContact CE-OE1 3.05Å; K1221-E1297 IonicContact NZ-OE1 3.27Å; K1221-E1297 PolarHBondContact NZ-OE1 3.16Å |
| 1298 | N | 70.2 | Confident | 79.9 | Confident | 0 Ų | 0 | 27 Ų | 27 | 0% | 0 | 14% | 0.135 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -114.2 | 116.7 | -178.5 | -63.6 | -23.7 | 0 | 0 | 0 | 109.4 | S1169 D1217 C1218 F1236 S1296 | S1169-N1298 PolarHBondContact N-O 3.34Å; S1169-N1298 VanDerWaalsContact N-O 3.14Å; S1169-N1298 PolarHBondContact OG-N 3.36Å; D1217-N1298 CarbonylContact O-C 3.59Å; D1217-N1298 WeakPolarHBondContact O-CA 2.99Å; C1218-N1298 WeakPolarHBondContact CA-OD1 3.5Å; C1218-N1298 WeakPolarHBondContact CB-OD1 3.1Å; F1236-N1298 WeakPolarHBondContact CB-ND2 3.21Å; S1296-N1298 WeakPolarHBondContact CB-OD1 3.02Å; S1296-N1298 PolarHBondContact O-N 3.17Å; S1296-N1298 PolarHBondContact OG-ND2 3.38Å |
| 1299 | L | 77.6 | Confident | 79.4 | Confident | 57 Ų | 57 | 28.4 Ų | 28.4 | 30% | 0.298 | 14% | 0.142 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -103.7 | 102.5 | 173 | -178.3 | 81.9 | 0 | 0 | 0 | 107.9 | T1166 L1167 N1168 D1217 | T1166-L1299 HydrophobicContact CG2-CD1 3.51Å; T1166-L1299 HydrophobicContact CG2-CD2 4.46Å; T1166-L1299 HydrophobicContact CG2-CG 3.86Å; L1167-L1299 CarbonylContact O-C 3.59Å; L1167-L1299 WeakPolarHBondContact O-CA 3.1Å; N1168-L1299 HydrophobicContact CB-CD1 3.92Å; D1217-L1299 HydrophobicContact CB-CB 4.11Å; D1217-L1299 WeakPolarHBondContact CB-O 3.14Å; D1217-L1299 PolarHBondContact N-O 3.01Å; D1217-L1299 PolarHBondContact O-N 3.11Å |
| 1300 | V | 83.6 | Confident | 79.1 | Confident | 0 Ų | 0 | 27.8 Ų | 27.8 | 0% | 0 | 14% | 0.139 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -92.9 | 122 | -178.8 | 179.4 | 0 | 0 | 0 | 0 | 109.5 | T1166 L1167 I1214 Y1215 I1237 I1288 L1290 I1302 | T1166-V1300 WeakPolarHBondContact CA-O 3.41Å; L1167-V1300 HydrophobicContact CB-CB 4.4Å; L1167-V1300 PolarHBondContact N-O 3.33Å; L1167-V1300 PolarHBondContact O-N 3.14Å; I1214-V1300 HydrophobicContact CG2-CG1 3.75Å; Y1215-V1300 CarbonylContact O-C 3.58Å; Y1215-V1300 WeakPolarHBondContact O-CA 3.36Å; I1237-V1300 HydrophobicContact CG2-CG2 4.08Å; I1288-V1300 HydrophobicContact CD1-CG1 3.92Å; L1290-V1300 HydrophobicContact CD2-CG2 3.73Å; V1300-I1302 HydrophobicContact CG1-CD1 4.3Å; V1300-I1302 HydrophobicContact CG1-CG1 4.37Å |
| 1301 | Q | 87.2 | Confident | 78.9 | Confident | 72 Ų | 72 | 29.3 Ų | 29.3 | 34% | 0.336 | 15% | 0.147 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -103.6 | 118.5 | 174.8 | -62.5 | 178 | 14.6 | 0 | 0 | 108.7 | K1165 T1166 Y1215 | K1165-Q1301 WeakPolarHBondContact O-CA 3.5Å; T1166-Q1301 HydrophobicContact CG2-CG 4.18Å; Y1215-Q1301 HydrophobicContact CD2-CB 4.42Å; Y1215-Q1301 PolarHBondContact N-O 3.47Å; Y1215-Q1301 PolarHBondContact O-N 3.41Å |
| 1302 | I | 88 | Confident | 79.1 | Confident | 8 Ų | 8 | 28.6 Ų | 28.6 | 4% | 0.041 | 14% | 0.143 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -95.5 | 121.3 | -178.8 | -52.9 | 88.3 | 0 | 0 | 0 | 109 | L1162 K1165 L1167 L1191 I1214 I1288 V1300 | L1162-I1302 HydrophobicContact CD1-CB 4.09Å; L1162-I1302 HydrophobicContact CD1-CG2 3.57Å; L1162-I1302 HydrophobicContact CD2-CB 3.85Å; L1162-I1302 HydrophobicContact CD2-CG1 4.3Å; L1162-I1302 HydrophobicContact CD2-CG2 3.71Å; L1162-I1302 HydrophobicContact CG-CG2 4.31Å; K1165-I1302 PolarHBondContact O-N 3.21Å; L1167-I1302 HydrophobicContact CD1-CD1 3.97Å; L1167-I1302 HydrophobicContact CG-CD1 3.81Å; L1191-I1302 HydrophobicContact CD1-CG1 4.23Å; L1191-I1302 HydrophobicContact CD1-CG2 4.16Å; L1191-I1302 HydrophobicContact CD2-CD1 3.93Å; L1191-I1302 HydrophobicContact CD2-CG1 3.98Å; I1214-I1302 HydrophobicContact CG1-CG2 4.28Å; I1288-I1302 HydrophobicContact CD1-CD1 4.29Å; I1288-I1302 HydrophobicContact CD1-CG1 3.71Å; V1300-I1302 HydrophobicContact CG1-CD1 4.3Å; V1300-I1302 HydrophobicContact CG1-CG1 4.37Å |
| 1303 | G | 88.3 | Confident | 79.7 | Confident | 17 Ų | 17 | 27.8 Ų | 27.8 | 18% | 0.175 | 14% | 0.138 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -74 | 158.9 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q1212 Q1213 | Q1212-G1303 PolarHBondContact NE2-O 2.69Å; Q1213-G1303 WeakPolarHBondContact O-CA 3.46Å; Q1213-G1303 PolarHBondContact O-N 3.29Å |
| 1304 | E | 92.3 | Very high | 81 | Confident | 40 Ų | 40 | 29.5 Ų | 29.5 | 19% | 0.187 | 15% | 0.146 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -61.6 | 141.3 | 177.8 | -57.2 | -174 | 177.7 | 0 | 0 | 110.2 | Y1133 C1159 I1160 R1161 K1165 | Y1133-E1304 PolarHBondContact OH-OE1 3.41Å; Y1133-E1304 PolarHBondContact OH-OE2 2.77Å; Y1133-E1304 VanDerWaalsContact OH-OE2 3.05Å; C1159-E1304 HydrophobicContact CB-CB 4.43Å; I1160-E1304 WeakPolarHBondContact O-CA 3.14Å; I1160-E1304 WeakPolarHBondContact O-CB 2.95Å; R1161-E1304 VanDerWaalsContact CG-CD 3.47Å; R1161-E1304 HydrophobicContact CG-CG 4.04Å; R1161-E1304 WeakPolarHBondContact CG-OE1 2.92Å; R1161-E1304 IonicContact NE-OE1 3.22Å; R1161-E1304 PolarHBondContact NE-OE1 2.8Å; R1161-E1304 VanDerWaalsContact NE-OE1 3.16Å; K1165-E1304 IonicContact NZ-OE1 2.75Å; K1165-E1304 PolarHBondContact NZ-OE1 3.48Å |
| 1305 | V | 94.7 | Very high | 82.7 | Confident | 0 Ų | 0 | 26.6 Ų | 26.6 | 0% | 0 | 14% | 0.135 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -87 | 125 | 176.9 | 60.8 | 0 | 0 | 0 | 0 | 108.9 | C1159 I1160 Y1193 Q1212 F1283 P1284 F1307 | C1159-V1305 CarbonylContact C-O 3.55Å; C1159-V1305 VanDerWaalsContact CA-O 3.32Å; C1159-V1305 WeakPolarHBondContact CA-O 3.3Å; I1160-V1305 HydrophobicContact CB-CG1 3.81Å; I1160-V1305 HydrophobicContact CG2-CG1 4.45Å; I1160-V1305 PolarHBondContact N-O 2.75Å; I1160-V1305 PolarHBondContact O-N 3.11Å; Y1193-V1305 HydrophobicContact CD1-CG1 3.71Å; Y1193-V1305 HydrophobicContact CE1-CB 4.1Å; Y1193-V1305 HydrophobicContact CE1-CG1 3.58Å; Q1212-V1305 HydrophobicContact CB-CB 4.48Å; Q1212-V1305 HydrophobicContact CB-CG2 4.39Å; Q1212-V1305 HydrophobicContact CG-CB 4.21Å; F1283-V1305 HydrophobicContact CB-CG2 4.05Å; F1283-V1305 HydrophobicContact CD1-CG2 3.93Å; F1283-V1305 HydrophobicContact CG-CG2 4.32Å; P1284-V1305 HydrophobicContact CB-CB 4.48Å; P1284-V1305 HydrophobicContact CB-CG1 4.22Å; P1284-V1305 HydrophobicContact CB-CG2 4.35Å; V1305-F1307 HydrophobicContact CB-CE2 4.48Å; V1305-F1307 HydrophobicContact CG1-CE2 3.93Å; V1305-F1307 HydrophobicContact CG1-CZ 4.42Å; V1305-F1307 HydrophobicContact CG2-CE1 4.49Å; V1305-F1307 HydrophobicContact CG2-CE2 3.85Å; V1305-F1307 HydrophobicContact CG2-CZ 3.79Å |
| 1306 | C | 96.4 | Very high | 84.6 | Confident | 5 Ų | 5 | 27.8 Ų | 27.8 | 3% | 0.034 | 14% | 0.141 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -113 | 145 | -175.3 | -63.1 | 0 | 0 | 0 | 0 | 111 | K1152 E1157 T1158 C1159 G1210 T1211 | K1152-C1306 PolarHBondContact NZ-SG 2.77Å; E1157-C1306 HydrophobicContact CB-CB 4.19Å; E1157-C1306 HydrophobicContact CG-CB 4.28Å; T1158-C1306 CarbonylContact O-C 3.54Å; T1158-C1306 WeakPolarHBondContact O-CA 3.33Å; C1159-C1306 HydrophobicContact CB-CB 4.13Å; C1159-C1306 WeakPolarHBondContact CB-SG 3.44Å; C1159-C1306 WeakPolarHBondContact SG-CB 2.89Å; C1159-C1306 CovalentContact SG-SG 2.04Å; C1159-C1306 PolarHBondContact SG-SG 3.47Å; G1210-C1306 CarbonylContact C-O 3.57Å; G1210-C1306 VanDerWaalsContact CA-O 3.3Å; G1210-C1306 WeakPolarHBondContact CA-O 3.35Å; T1211-C1306 PolarHBondContact N-O 2.87Å; T1211-C1306 PolarHBondContact O-N 3.15Å; T1211-C1306 VanDerWaalsContact OG1-CB 3.3Å; T1211-C1306 WeakPolarHBondContact OG1-CB 2.92Å; T1211-C1306 PolarHBondContact OG1-O 3.41Å |
| 1307 | F | 96.8 | Very high | 86.4 | Confident | 0 Ų | 0 | 30.2 Ų | 30.2 | 0% | 0 | 15% | 0.153 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -129 | 136 | -178 | -61.8 | -86 | 0 | 0 | 0 | 110.3 | E1157 T1158 I1160 L1200 L1203 K1204 S1207 I1209 T1280 F1283 V1305 | E1157-F1307 CarbonylContact C-O 3.47Å; E1157-F1307 WeakPolarHBondContact CA-O 3.41Å; T1158-F1307 PolarHBondContact N-O 2.97Å; T1158-F1307 PolarHBondContact O-N 3.36Å; I1160-F1307 HydrophobicContact CG1-CD2 4.44Å; I1160-F1307 HydrophobicContact CG1-CE2 4.25Å; L1200-F1307 HydrophobicContact CD1-CE2 4.05Å; L1200-F1307 HydrophobicContact CD1-CZ 3.87Å; L1203-F1307 HydrophobicContact CD1-CB 4.42Å; L1203-F1307 HydrophobicContact CD2-CB 4.45Å; L1203-F1307 HydrophobicContact CD2-CD2 3.55Å; L1203-F1307 HydrophobicContact CD2-CE2 4.04Å; L1203-F1307 HydrophobicContact CD2-CG 4.18Å; L1203-F1307 HydrophobicContact CG-CB 4.14Å; L1203-F1307 HydrophobicContact CG-CD2 3.97Å; L1203-F1307 HydrophobicContact CG-CG 4.1Å; K1204-F1307 HydrophobicContact CG-CD1 4.43Å; K1204-F1307 HydrophobicContact CG-CE1 3.82Å; K1204-F1307 HydrophobicContact CG-CZ 4.43Å; S1207-F1307 WeakPolarHBondContact OG-CB 3.41Å; I1209-F1307 WeakPolarHBondContact O-CA 3.39Å; T1280-F1307 HydrophobicContact CG2-CD1 3.97Å; F1283-F1307 HydrophobicContact CB-CE1 3.99Å; F1283-F1307 HydrophobicContact CB-CZ 4.22Å; V1305-F1307 HydrophobicContact CB-CE2 4.48Å; V1305-F1307 HydrophobicContact CG1-CE2 3.93Å; V1305-F1307 HydrophobicContact CG1-CZ 4.42Å; V1305-F1307 HydrophobicContact CG2-CE1 4.49Å; V1305-F1307 HydrophobicContact CG2-CE2 3.85Å; V1305-F1307 HydrophobicContact CG2-CZ 3.79Å |
| 1308 | Q | 94 | Very high | 88.1 | Confident | 72 Ų | 72 | 24.6 Ų | 24.6 | 34% | 0.336 | 13% | 0.128 | S | C | . | . | trans | -137.6 | 0 | -170.5 | -170.2 | -175.3 | 41.5 | 0 | 0 | 112.9 | T1155 E1157 S1207 L1208 I1209 | T1155-Q1308 PolarHBondContact O-NE2 3.44Å; E1157-Q1308 HydrophobicContact CG-CB 4.19Å; E1157-Q1308 HydrophobicContact CG-CG 4.48Å; S1207-Q1308 CarbonylContact C-O 3.56Å; S1207-Q1308 WeakPolarHBondContact CA-O 3.43Å; S1207-Q1308 WeakPolarHBondContact CB-O 3.26Å; L1208-Q1308 PolarHBondContact N-O 3.13Å; I1209-Q1308 PolarHBondContact N-O 3.43Å; I1209-Q1308 PolarHBondContact O-N 2.75Å |
Retrieved 1,308 of 1,308 residues in 234.7 ms
(Link to these results)