| 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 | 50.5 | Low | 69.9 | Low | 232 Ų | 232 | 164.2 Ų | 164.2 | 100% | 1.143 | 79% | 0.786 | S | S | * | * | 0 | 139.1 | 0 | -67.3 | 178.6 | 171.9 | 0 | 0 | 109 | S3 | M1-S3 PolarHBondContact O-N 3.29Š| |||
| 2 | P | 58.3 | Low | 72 | Confident | 130 Ų | 130 | 156 Ų | 156 | 84% | 0.844 | 74% | 0.744 | S | S | * | * | trans | -73.9 | 117.2 | 176.8 | 29.4 | -32.3 | 0 | 0 | 0 | 110.5 | K4 | P2-K4 PolarHBondContact O-N 2.68Å; P2-K4 VanDerWaalsContact O-N 3.17Å | ||
| 3 | S | 62.2 | Low | 73.8 | Confident | 112 Ų | 112 | 150.6 Ų | 150.6 | 78% | 0.783 | 73% | 0.73 | S | S | * | * | trans | -63.7 | 115.3 | 178.6 | -34.2 | 0 | 0 | 0 | 0 | 110.1 | M1 K5 | M1-S3 PolarHBondContact O-N 3.29Å; S3-K5 PolarHBondContact O-N 2.99Å | ||
| 4 | K | 65.1 | Low | 75.3 | Confident | 216 Ų | 216 | 143.6 Ų | 143.6 | 94% | 0.939 | 70% | 0.703 | S | S | * | * | trans | -58.4 | 99.5 | 174.6 | -68.1 | 177.8 | -179.2 | 175.8 | 0 | 108.8 | P2 K6 | P2-K4 PolarHBondContact O-N 2.68Å; P2-K4 VanDerWaalsContact O-N 3.17Å; K4-K6 PolarHBondContact O-N 3.08Å | ||
| 5 | K | 63.5 | Low | 76.7 | Confident | 197 Ų | 197 | 138.6 Ų | 138.6 | 86% | 0.857 | 69% | 0.693 | S | S | * | * | trans | -58.1 | 123.2 | 178 | -73.5 | -179.8 | 179.3 | 175.2 | 0 | 108.6 | S3 K7 | S3-K5 PolarHBondContact O-N 2.99Å; K5-K7 PolarHBondContact O-N 2.88Å; K5-K7 VanDerWaalsContact O-N 3.1Å | ||
| 6 | K | 66.6 | Low | 78 | Confident | 187 Ų | 187 | 140.3 Ų | 140.3 | 81% | 0.813 | 69% | 0.689 | S | S | * | * | trans | -58.6 | 115.4 | -177.1 | -143 | 172.7 | -171.8 | 176.6 | 0 | 108.5 | K4 Y8 | K4-K6 PolarHBondContact O-N 3.08Å; K6-Y8 PolarHBondContact O-N 3.42Å; K6-Y8 VanDerWaalsContact O-N 3.12Å | ||
| 7 | K | 66.8 | Low | 79.2 | Confident | 192 Ų | 192 | 132.9 Ų | 132.9 | 84% | 0.835 | 65% | 0.653 | S | S | * | * | S | Bend | trans | -57.9 | -32 | -167 | -67.7 | -179 | 178.9 | 177.6 | 0 | 113 | K5 | K5-K7 PolarHBondContact O-N 2.88Å; K5-K7 VanDerWaalsContact O-N 3.1Å |
| 8 | Y | 70 | Confident | 80.2 | Confident | 166 Ų | 166 | 130.7 Ų | 130.7 | 65% | 0.651 | 64% | 0.639 | S | S | * | * | trans | -141.5 | 144.3 | 169.9 | -58.2 | -78.4 | 0 | 0 | 0 | 110 | K6 V36 | K6-Y8 PolarHBondContact O-N 3.42Å; K6-Y8 VanDerWaalsContact O-N 3.12Å; Y8-V36 HydrophobicContact CD1-CG1 4.46Å; Y8-V36 HydrophobicContact CG-CG1 4.07Å | ||
| 9 | N | 80.9 | Confident | 81.2 | Confident | 159 Ų | 159 | 131.8 Ų | 131.8 | 85% | 0.85 | 64% | 0.64 | S | S | * | * | trans | -98.5 | 90 | 173.1 | -167.5 | -4.6 | 0 | 0 | 0 | 109 | ||||
| 10 | A | 89.7 | Confident | 82 | Confident | 26 Ų | 26 | 130.3 Ų | 130.3 | 22% | 0.215 | 63% | 0.634 | C | S | . | * | trans | -99.8 | 134.7 | 176.8 | 0 | 0 | 0 | 0 | 0 | 110 | F12 P14 V36 | A10-F12 VanDerWaalsContact C-N 3.33Å; A10-P14 HydrophobicContact CB-CG 4.43Å; A10-V36 HydrophobicContact CB-CG1 4.49Å | ||
| 11 | R | 94.9 | Very high | 82.7 | Confident | 189 Ų | 189 | 125.8 Ų | 125.8 | 71% | 0.713 | 61% | 0.612 | S | S | * | * | S | Bend | trans | -64.1 | -37.7 | 176.2 | 178 | 67.2 | 77.8 | 169.5 | 9.9 | 112.3 | S39 E43 | R11-S39 PolarHBondContact N-OG 3.01Å; R11-E43 HydrophobicContact CB-CG 3.76Å; R11-E43 WeakPolarHBondContact CB-OE1 3.45Å; R11-E43 HydrophobicContact CG-CG 4.1Å |
| 12 | F | 95 | Very high | 84.9 | Confident | 66 Ų | 66 | 118.9 Ų | 118.9 | 29% | 0.289 | 58% | 0.577 | S | S | . | * | S | Bend | trans | -107.3 | 139.8 | -177.8 | -62.2 | -76.8 | 0 | 0 | 0 | 110.6 | A10 P14 I17 S39 L42 E43 L46 | A10-F12 VanDerWaalsContact C-N 3.33Å; F12-P14 VanDerWaalsContact O-CD 3.29Å; F12-P14 WeakPolarHBondContact O-CD 3.33Å; F12-I17 HydrophobicContact CB-CD1 3.85Å; F12-I17 HydrophobicContact CB-CG1 4.39Å; F12-S39 PolarHBondContact N-OG 3.19Å; F12-L42 HydrophobicContact CD2-CB 4.05Å; F12-L42 HydrophobicContact CD2-CD1 4.37Å; F12-L42 HydrophobicContact CE2-CB 3.78Å; F12-E43 HydrophobicContact CE2-CG 4.09Å; F12-L46 HydrophobicContact CE2-CD1 4.37Å; F12-L46 HydrophobicContact CZ-CD1 3.71Å |
| 13 | P | 95.7 | Very high | 86.8 | Confident | 86 Ų | 86 | 118.2 Ų | 118.2 | 56% | 0.558 | 57% | 0.571 | S | S | * | * | trans | -60.7 | 120.1 | 179.4 | -25 | 34.9 | 0 | 0 | 0 | 112.3 | A15 R16 I17 | P13-A15 PolarHBondContact O-N 3.49Å; P13-A15 VanDerWaalsContact O-N 3.15Å; P13-R16 HydrophobicContact CB-CB 4.23Å; P13-R16 PolarHBondContact O-N 3.18Å; P13-I17 PolarHBondContact O-N 3Å | ||
| 14 | P | 95.3 | Very high | 88.5 | Confident | 53 Ų | 53 | 116.8 Ų | 116.8 | 34% | 0.344 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -55.7 | -35.2 | -179.2 | -30.6 | 38.3 | 0 | 0 | 0 | 113.7 | A10 F12 I17 K18 P35 V36 | A10-P14 HydrophobicContact CB-CG 4.43Å; F12-P14 VanDerWaalsContact O-CD 3.29Å; F12-P14 WeakPolarHBondContact O-CD 3.33Å; P14-I17 PolarHBondContact O-N 3.15Å; P14-K18 WeakPolarHBondContact O-CB 3.33Å; P14-K18 PolarHBondContact O-N 3.34Å; P14-P35 HydrophobicContact CB-CB 4.05Å; P14-P35 WeakPolarHBondContact O-CB 3.26Å; P14-V36 HydrophobicContact CB-CG2 4.46Å; P14-V36 HydrophobicContact CG-CG2 4.07Å |
| 15 | A | 96.4 | Very high | 90 | Very high | 68 Ų | 68 | 115.6 Ų | 115.6 | 56% | 0.562 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -65.4 | -36 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | P13 K18 K19 | P13-A15 PolarHBondContact O-N 3.49Å; P13-A15 VanDerWaalsContact O-N 3.15Å; A15-K18 PolarHBondContact O-N 2.94Å; A15-K19 WeakPolarHBondContact O-CG 3.11Å; A15-K19 PolarHBondContact O-N 2.89Å |
| 16 | R | 98 | Very high | 91.6 | Very high | 166 Ų | 166 | 114.5 Ų | 114.5 | 63% | 0.626 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -71.8 | -39.3 | 176.9 | -176 | 60.4 | 176.8 | -166.4 | 2.7 | 111.1 | P13 K19 I20 | P13-R16 HydrophobicContact CB-CB 4.23Å; P13-R16 PolarHBondContact O-N 3.18Å; R16-K19 PolarHBondContact O-N 2.8Å; R16-I20 HydrophobicContact CG-CD1 4.22Å; R16-I20 WeakPolarHBondContact O-CG1 3.37Å; R16-I20 PolarHBondContact O-N 2.65Å; R16-I20 VanDerWaalsContact O-N 3.11Å |
| 17 | I | 97.9 | Very high | 93 | Very high | 15 Ų | 15 | 108.4 Ų | 108.4 | 8% | 0.077 | 53% | 0.526 | C | S | . | . | H | α-helix | trans | -60.7 | -49.3 | 172.2 | -65.6 | 171.6 | 0 | 0 | 0 | 109.8 | F12 P13 P14 K19 I20 M21 P35 I38 L42 | F12-I17 HydrophobicContact CB-CD1 3.85Å; F12-I17 HydrophobicContact CB-CG1 4.39Å; P13-I17 PolarHBondContact O-N 3Å; P14-I17 PolarHBondContact O-N 3.15Å; I17-K19 VanDerWaalsContact C-N 3.34Å; I17-K19 PolarHBondContact O-N 3.34Å; I17-I20 PolarHBondContact O-N 3.18Å; I17-M21 HydrophobicContact CG2-CG 4.2Å; I17-M21 HydrophobicContact CG2-SD 3.93Å; I17-M21 WeakPolarHBondContact O-CG 3.42Å; I17-M21 PolarHBondContact O-N 3.45Å; I17-P35 HydrophobicContact CB-CB 4.09Å; I17-P35 VanDerWaalsContact CD1-O 3.27Å; I17-P35 WeakPolarHBondContact CD1-O 3.17Å; I17-P35 HydrophobicContact CG2-CB 3.9Å; I17-I38 HydrophobicContact CD1-CG2 4.4Å; I17-I38 HydrophobicContact CG2-CB 4.04Å; I17-I38 HydrophobicContact CG2-CD1 4.33Å; I17-I38 HydrophobicContact CG2-CG2 3.73Å; I17-L42 HydrophobicContact CD1-CD1 4.32Å |
| 18 | K | 97.7 | Very high | 94.3 | Very high | 92 Ų | 92 | 101.7 Ų | 101.7 | 40% | 0.4 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -56.2 | -45.6 | 177.5 | -170.3 | -173.8 | 178.3 | -168.9 | 0 | 112.1 | P14 A15 I20 M21 Q22 P35 | P14-K18 WeakPolarHBondContact O-CB 3.33Å; P14-K18 PolarHBondContact O-N 3.34Å; A15-K18 PolarHBondContact O-N 2.94Å; K18-I20 VanDerWaalsContact C-N 3.3Å; K18-I20 PolarHBondContact O-N 3.09Å; K18-M21 PolarHBondContact O-N 3.25Å; K18-Q22 VanDerWaalsContact CE-OE1 3.28Å; K18-Q22 WeakPolarHBondContact O-CG 3.5Å; K18-Q22 PolarHBondContact O-N 2.92Å; K18-P35 HydrophobicContact CB-CG 4.28Å |
| 19 | K | 97.6 | Very high | 95.5 | Very high | 152 Ų | 152 | 104.3 Ų | 104.3 | 66% | 0.661 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -60.3 | -35.9 | 176 | -75.9 | -174.1 | 178.4 | -170.1 | 0 | 113.2 | A15 R16 I17 | A15-K19 WeakPolarHBondContact O-CG 3.11Å; A15-K19 PolarHBondContact O-N 2.89Å; R16-K19 PolarHBondContact O-N 2.8Å; I17-K19 VanDerWaalsContact C-N 3.34Å; I17-K19 PolarHBondContact O-N 3.34Å |
| 20 | I | 97.8 | Very high | 96.2 | Very high | 101 Ų | 101 | 98.3 Ų | 98.3 | 52% | 0.518 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -75.9 | -38 | 176.3 | -65.7 | 165.3 | 0 | 0 | 0 | 111.3 | R16 I17 K18 Q22 T23 | R16-I20 HydrophobicContact CG-CD1 4.22Å; R16-I20 WeakPolarHBondContact O-CG1 3.37Å; R16-I20 PolarHBondContact O-N 2.65Å; R16-I20 VanDerWaalsContact O-N 3.11Å; I17-I20 PolarHBondContact O-N 3.18Å; K18-I20 VanDerWaalsContact C-N 3.3Å; K18-I20 PolarHBondContact O-N 3.09Å; I20-Q22 VanDerWaalsContact C-N 3.3Å; I20-Q22 PolarHBondContact O-N 3.15Å; I20-T23 PolarHBondContact O-N 3.46Å; I20-T23 PolarHBondContact O-OG1 3.36Å |
| 21 | M | 97.6 | Very high | 96.5 | Very high | 36 Ų | 36 | 100.2 Ų | 100.2 | 18% | 0.177 | 51% | 0.51 | C | S | . | . | H | α-helix | trans | -60.7 | -41.7 | 174.4 | -67.4 | 172.9 | 70.6 | 0 | 0 | 111.4 | I17 K18 T23 D24 I27 V30 V34 P35 I38 | I17-M21 HydrophobicContact CG2-CG 4.2Å; I17-M21 HydrophobicContact CG2-SD 3.93Å; I17-M21 WeakPolarHBondContact O-CG 3.42Å; I17-M21 PolarHBondContact O-N 3.45Å; K18-M21 PolarHBondContact O-N 3.25Å; M21-T23 PolarHBondContact O-N 3.16Å; M21-D24 PolarHBondContact O-N 3.32Å; M21-I27 HydrophobicContact CB-CG2 4.45Å; M21-V30 HydrophobicContact CE-CG1 3.81Å; M21-V30 HydrophobicContact CE-CG2 3.98Å; M21-V30 HydrophobicContact SD-CG1 4.27Å; M21-V34 HydrophobicContact CE-CG1 3.88Å; M21-P35 HydrophobicContact SD-CG 4.36Å; M21-I38 HydrophobicContact CE-CD1 3.74Å; M21-I38 HydrophobicContact CG-CD1 4.35Å; M21-I38 HydrophobicContact SD-CD1 3.47Å; M21-I38 WeakPolarHBondContact SD-CD1 3.47Å |
| 22 | Q | 96.8 | Very high | 96.5 | Very high | 88 Ų | 88 | 95.6 Ų | 95.6 | 41% | 0.411 | 51% | 0.513 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -84.1 | 17.9 | -178.2 | -60.8 | -172.2 | -71.7 | 0 | 0 | 113.7 | K18 I20 D24 G28 | K18-Q22 VanDerWaalsContact CE-OE1 3.28Å; K18-Q22 WeakPolarHBondContact O-CG 3.5Å; K18-Q22 PolarHBondContact O-N 2.92Å; I20-Q22 VanDerWaalsContact C-N 3.3Å; I20-Q22 PolarHBondContact O-N 3.15Å; Q22-D24 VanDerWaalsContact C-N 3.28Å; Q22-G28 PolarHBondContact NE2-O 3.23Å |
| 23 | T | 97.4 | Very high | 96.5 | Very high | 115 Ų | 115 | 95.1 Ų | 95.1 | 71% | 0.706 | 52% | 0.521 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.6 | -13.1 | 159.9 | 65.4 | 0 | 0 | 0 | 0 | 112.2 | I20 M21 | I20-T23 PolarHBondContact O-N 3.46Å; I20-T23 PolarHBondContact O-OG1 3.36Å; M21-T23 PolarHBondContact O-N 3.16Å |
| 24 | D | 97.3 | Very high | 96.6 | Very high | 82 Ų | 82 | 93.8 Ų | 93.8 | 44% | 0.439 | 51% | 0.511 | S | S | . | . | S | Bend | trans | -88.5 | 120.5 | 169.5 | -174.1 | -15.9 | 0 | 0 | 0 | 108.6 | M21 Q22 E26 I27 | M21-D24 PolarHBondContact O-N 3.32Å; Q22-D24 VanDerWaalsContact C-N 3.28Å; D24-E26 PolarHBondContact O-N 3.05Å; D24-E26 PolarHBondContact OD1-N 2.88Å; D24-E26 VanDerWaalsContact OD1-N 3.1Å; D24-I27 HydrophobicContact CB-CB 4.39Å; D24-I27 HydrophobicContact CB-CD1 3.88Å; D24-I27 HydrophobicContact CB-CG1 3.89Å; D24-I27 PolarHBondContact O-N 3.36Å; D24-I27 VanDerWaalsContact O-N 3.12Å |
| 25 | E | 97.1 | Very high | 96.6 | Very high | 192 Ų | 192 | 91.5 Ų | 91.5 | 90% | 0.897 | 50% | 0.496 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.8 | -24.6 | -176.1 | -62.1 | -176.4 | 173.8 | 0 | 0 | 112.3 | I27 | E25-I27 PolarHBondContact O-N 3.06Š|
| 26 | E | 97 | Very high | 96.6 | Very high | 174 Ų | 174 | 89.8 Ų | 89.8 | 81% | 0.813 | 48% | 0.479 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.4 | -10.1 | 177.1 | -59.4 | -65.3 | 145 | 0 | 0 | 112.4 | D24 G28 | D24-E26 PolarHBondContact O-N 3.05Å; D24-E26 PolarHBondContact OD1-N 2.88Å; D24-E26 VanDerWaalsContact OD1-N 3.1Å; E26-G28 PolarHBondContact O-N 3.28Å |
| 27 | I | 96.1 | Very high | 96.6 | Very high | 59 Ų | 59 | 87.4 Ų | 87.4 | 30% | 0.303 | 48% | 0.477 | S | S | . | . | trans | -95.5 | 92.1 | -177.1 | -60.1 | -172.7 | 0 | 0 | 0 | 111.7 | M21 D24 E25 V30 | M21-I27 HydrophobicContact CB-CG2 4.45Å; D24-I27 HydrophobicContact CB-CB 4.39Å; D24-I27 HydrophobicContact CB-CD1 3.88Å; D24-I27 HydrophobicContact CB-CG1 3.89Å; D24-I27 PolarHBondContact O-N 3.36Å; D24-I27 VanDerWaalsContact O-N 3.12Å; E25-I27 PolarHBondContact O-N 3.06Å; I27-V30 HydrophobicContact CG2-CG2 3.72Å | ||
| 28 | G | 93.3 | Very high | 96.6 | Very high | 50 Ų | 50 | 89.1 Ų | 89.1 | 52% | 0.515 | 49% | 0.486 | S | S | . | . | trans | -72.5 | -130.3 | 175.6 | 0 | 0 | 0 | 0 | 0 | 115.7 | Q22 E26 V30 | Q22-G28 PolarHBondContact NE2-O 3.23Å; E26-G28 PolarHBondContact O-N 3.28Å; G28-V30 PolarHBondContact O-N 2.96Å | ||
| 29 | K | 95.6 | Very high | 96.6 | Very high | 222 Ų | 222 | 84.7 Ų | 84.7 | 97% | 0.965 | 47% | 0.467 | S | S | * | . | trans | -74 | 110.7 | -175 | -69 | -176.1 | 179.8 | -179.9 | 0 | 111.8 | ||||
| 30 | V | 96.2 | Very high | 96.5 | Very high | 32 Ų | 32 | 84.3 Ų | 84.3 | 19% | 0.194 | 46% | 0.461 | C | S | . | . | trans | -89.8 | 129.2 | 178.6 | -177.3 | 0 | 0 | 0 | 0 | 111.9 | M21 I27 G28 V34 P35 | M21-V30 HydrophobicContact CE-CG1 3.81Å; M21-V30 HydrophobicContact CE-CG2 3.98Å; M21-V30 HydrophobicContact SD-CG1 4.27Å; I27-V30 HydrophobicContact CG2-CG2 3.72Å; G28-V30 PolarHBondContact O-N 2.96Å; V30-V34 HydrophobicContact CG1-CB 3.86Å; V30-V34 HydrophobicContact CG1-CG1 4.11Å; V30-P35 HydrophobicContact CG1-CG 4.15Å | ||
| 31 | A | 96.9 | Very high | 96.5 | Very high | 66 Ų | 66 | 82.1 Ų | 82.1 | 55% | 0.545 | 46% | 0.458 | S | S | . | . | trans | -68.8 | 142.2 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | A33 V34 P35 | A31-A33 PolarHBondContact O-N 3.06Å; A31-V34 HydrophobicContact CB-CG2 4.25Å; A31-V34 WeakPolarHBondContact O-CB 3.48Å; A31-V34 PolarHBondContact O-N 2.97Å; A31-P35 WeakPolarHBondContact O-CD 3.46Å | ||
| 32 | A | 93.8 | Very high | 96.5 | Very high | 93 Ų | 93 | 83.4 Ų | 83.4 | 77% | 0.769 | 47% | 0.465 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.4 | -25.5 | -170.2 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||
| 33 | A | 95.4 | Very high | 96.5 | Very high | 56 Ų | 56 | 81.2 Ų | 81.2 | 46% | 0.463 | 46% | 0.455 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -76.3 | -25.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | A31 V36 I37 | A31-A33 PolarHBondContact O-N 3.06Å; A33-V36 WeakPolarHBondContact O-CB 3.48Å; A33-V36 PolarHBondContact O-N 2.92Å; A33-I37 WeakPolarHBondContact O-CG1 3.2Å; A33-I37 PolarHBondContact O-N 3.4Å |
| 34 | V | 96.9 | Very high | 96.5 | Very high | 57 Ų | 57 | 80.3 Ų | 80.3 | 35% | 0.345 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -64.4 | -48 | -171.5 | 175.7 | 0 | 0 | 0 | 0 | 112.2 | M21 V30 A31 V36 I37 I38 | M21-V34 HydrophobicContact CE-CG1 3.88Å; V30-V34 HydrophobicContact CG1-CB 3.86Å; V30-V34 HydrophobicContact CG1-CG1 4.11Å; A31-V34 HydrophobicContact CB-CG2 4.25Å; A31-V34 WeakPolarHBondContact O-CB 3.48Å; A31-V34 PolarHBondContact O-N 2.97Å; V34-V36 PolarHBondContact O-N 3.03Å; V34-I37 PolarHBondContact O-N 3.04Å; V34-I37 VanDerWaalsContact O-N 3.17Å; V34-I38 HydrophobicContact CG1-CD1 3.76Å; V34-I38 HydrophobicContact CG1-CG1 4.43Å; V34-I38 WeakPolarHBondContact O-CG1 3.23Å; V34-I38 PolarHBondContact O-N 3.46Å |
| 35 | P | 96.8 | Very high | 96.6 | Very high | 6 Ų | 6 | 79.1 Ų | 79.1 | 4% | 0.039 | 44% | 0.436 | C | S | . | . | H | α-helix | trans | -63.5 | -28.2 | 176.7 | -22.8 | 35.2 | 0 | 0 | 0 | 113.4 | P14 I17 K18 M21 V30 A31 S39 | P14-P35 HydrophobicContact CB-CB 4.05Å; P14-P35 WeakPolarHBondContact O-CB 3.26Å; I17-P35 HydrophobicContact CB-CB 4.09Å; I17-P35 VanDerWaalsContact CD1-O 3.27Å; I17-P35 WeakPolarHBondContact CD1-O 3.17Å; I17-P35 HydrophobicContact CG2-CB 3.9Å; K18-P35 HydrophobicContact CB-CG 4.28Å; M21-P35 HydrophobicContact SD-CG 4.36Å; V30-P35 HydrophobicContact CG1-CG 4.15Å; A31-P35 WeakPolarHBondContact O-CD 3.46Å; P35-S39 PolarHBondContact O-N 2.95Å |
| 36 | V | 96.2 | Very high | 96.6 | Very high | 31 Ų | 31 | 73.2 Ų | 73.2 | 19% | 0.188 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -69.8 | -41.7 | 175.9 | -178.9 | 0 | 0 | 0 | 0 | 110.8 | Y8 A10 P14 A33 V34 S39 R40 | Y8-V36 HydrophobicContact CD1-CG1 4.46Å; Y8-V36 HydrophobicContact CG-CG1 4.07Å; A10-V36 HydrophobicContact CB-CG1 4.49Å; P14-V36 HydrophobicContact CB-CG2 4.46Å; P14-V36 HydrophobicContact CG-CG2 4.07Å; A33-V36 WeakPolarHBondContact O-CB 3.48Å; A33-V36 PolarHBondContact O-N 2.92Å; V34-V36 PolarHBondContact O-N 3.03Å; V36-S39 WeakPolarHBondContact O-CB 3.39Å; V36-S39 PolarHBondContact O-N 2.94Å; V36-R40 PolarHBondContact O-N 3.44Å |
| 37 | I | 96.8 | Very high | 96.6 | Very high | 116 Ų | 116 | 70.9 Ų | 70.9 | 60% | 0.595 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -65.9 | -42.8 | 175.1 | -65.3 | 165.9 | 0 | 0 | 0 | 110.4 | A33 V34 S39 R40 A41 | A33-I37 WeakPolarHBondContact O-CG1 3.2Å; A33-I37 PolarHBondContact O-N 3.4Å; V34-I37 PolarHBondContact O-N 3.04Å; V34-I37 VanDerWaalsContact O-N 3.17Å; I37-S39 VanDerWaalsContact C-N 3.33Å; I37-S39 PolarHBondContact O-N 3.05Å; I37-R40 PolarHBondContact O-N 3.12Å; I37-A41 PolarHBondContact O-N 3.34Å |
| 38 | I | 97.6 | Very high | 96.7 | Very high | 51 Ų | 51 | 70.1 Ų | 70.1 | 26% | 0.262 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -61.4 | -39.7 | 176.6 | -67.7 | 166.5 | 0 | 0 | 0 | 111.2 | I17 M21 V34 R40 A41 L42 | I17-I38 HydrophobicContact CD1-CG2 4.4Å; I17-I38 HydrophobicContact CG2-CB 4.04Å; I17-I38 HydrophobicContact CG2-CD1 4.33Å; I17-I38 HydrophobicContact CG2-CG2 3.73Å; M21-I38 HydrophobicContact CE-CD1 3.74Å; M21-I38 HydrophobicContact CG-CD1 4.35Å; M21-I38 HydrophobicContact SD-CD1 3.47Å; M21-I38 WeakPolarHBondContact SD-CD1 3.47Å; V34-I38 HydrophobicContact CG1-CD1 3.76Å; V34-I38 HydrophobicContact CG1-CG1 4.43Å; V34-I38 WeakPolarHBondContact O-CG1 3.23Å; V34-I38 PolarHBondContact O-N 3.46Å; I38-R40 PolarHBondContact O-N 2.95Å; I38-A41 PolarHBondContact O-N 3.03Å; I38-A41 VanDerWaalsContact O-N 3.16Å; I38-L42 HydrophobicContact CG2-CD1 4Å; I38-L42 HydrophobicContact CG2-CG 4.2Å; I38-L42 WeakPolarHBondContact O-CB 3.44Å; I38-L42 WeakPolarHBondContact O-CG 3.35Å; I38-L42 PolarHBondContact O-N 3.42Å |
| 39 | S | 97.6 | Very high | 96.9 | Very high | 0 Ų | 0 | 68.6 Ų | 68.6 | 0% | 0 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -53 | -43 | 171.9 | 176.2 | 0 | 0 | 0 | 0 | 111.7 | R11 F12 P35 V36 I37 L42 E43 | R11-S39 PolarHBondContact N-OG 3.01Å; F12-S39 PolarHBondContact N-OG 3.19Å; P35-S39 PolarHBondContact O-N 2.95Å; V36-S39 WeakPolarHBondContact O-CB 3.39Å; V36-S39 PolarHBondContact O-N 2.94Å; I37-S39 VanDerWaalsContact C-N 3.33Å; I37-S39 PolarHBondContact O-N 3.05Å; S39-L42 PolarHBondContact O-N 3.21Å; S39-E43 WeakPolarHBondContact O-CG 3.5Å; S39-E43 PolarHBondContact O-N 2.81Å |
| 40 | R | 96.9 | Very high | 97 | Very high | 144 Ų | 144 | 62.1 Ų | 62.1 | 54% | 0.543 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -73.5 | -35.8 | -179.4 | -174.3 | 55.9 | 175.9 | -175 | 1.6 | 112.5 | V36 I37 I38 L42 E43 L44 | V36-R40 PolarHBondContact O-N 3.44Å; I37-R40 PolarHBondContact O-N 3.12Å; I38-R40 PolarHBondContact O-N 2.95Å; R40-L42 VanDerWaalsContact C-N 3.35Å; R40-E43 IonicContact CZ-OE2 3.84Å; R40-E43 IonicContact NH1-OE2 2.78Å; R40-E43 PolarHBondContact NH1-OE2 2.88Å; R40-E43 PolarHBondContact O-N 3.05Å; R40-L44 PolarHBondContact O-N 3.23Å |
| 41 | A | 97.6 | Very high | 97.1 | Very high | 55 Ų | 55 | 64.2 Ų | 64.2 | 46% | 0.455 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -63.7 | -40.9 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | I37 I38 E43 L44 F45 | I37-A41 PolarHBondContact O-N 3.34Å; I38-A41 PolarHBondContact O-N 3.03Å; I38-A41 VanDerWaalsContact O-N 3.16Å; A41-E43 PolarHBondContact O-N 3.45Å; A41-L44 PolarHBondContact O-N 3.26Å; A41-F45 WeakPolarHBondContact O-CB 3.3Å; A41-F45 PolarHBondContact O-N 3.38Å |
| 42 | L | 98 | Very high | 97.1 | Very high | 62 Ų | 62 | 62.9 Ų | 62.9 | 33% | 0.325 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -62.9 | -37.7 | 175.7 | -71.7 | 171.4 | 0 | 0 | 0 | 112.7 | F12 I17 I38 S39 R40 L46 | F12-L42 HydrophobicContact CD2-CB 4.05Å; F12-L42 HydrophobicContact CD2-CD1 4.37Å; F12-L42 HydrophobicContact CE2-CB 3.78Å; I17-L42 HydrophobicContact CD1-CD1 4.32Å; I38-L42 HydrophobicContact CG2-CD1 4Å; I38-L42 HydrophobicContact CG2-CG 4.2Å; I38-L42 WeakPolarHBondContact O-CB 3.44Å; I38-L42 WeakPolarHBondContact O-CG 3.35Å; I38-L42 PolarHBondContact O-N 3.42Å; S39-L42 PolarHBondContact O-N 3.21Å; R40-L42 VanDerWaalsContact C-N 3.35Å; L42-L46 WeakPolarHBondContact O-CB 3.46Å; L42-L46 VanDerWaalsContact O-CG 3.26Å; L42-L46 WeakPolarHBondContact O-CG 3.43Å; L42-L46 PolarHBondContact O-N 3.36Å |
| 43 | E | 96.9 | Very high | 97.2 | Very high | 43 Ų | 43 | 58.4 Ų | 58.4 | 20% | 0.201 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -58.2 | -50.5 | 172.6 | -71.5 | 166.9 | -126 | 0 | 0 | 111.5 | R11 F12 S39 R40 A41 L46 E47 | R11-E43 HydrophobicContact CB-CG 3.76Å; R11-E43 WeakPolarHBondContact CB-OE1 3.45Å; R11-E43 HydrophobicContact CG-CG 4.1Å; F12-E43 HydrophobicContact CE2-CG 4.09Å; S39-E43 WeakPolarHBondContact O-CG 3.5Å; S39-E43 PolarHBondContact O-N 2.81Å; R40-E43 IonicContact CZ-OE2 3.84Å; R40-E43 IonicContact NH1-OE2 2.78Å; R40-E43 PolarHBondContact NH1-OE2 2.88Å; R40-E43 PolarHBondContact O-N 3.05Å; A41-E43 PolarHBondContact O-N 3.45Å; E43-L46 PolarHBondContact O-N 3.36Å; E43-E47 WeakPolarHBondContact O-CB 3.44Å; E43-E47 PolarHBondContact O-N 2.89Å |
| 44 | L | 97.3 | Very high | 97.3 | Very high | 95 Ų | 95 | 58.5 Ų | 58.5 | 50% | 0.497 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -67.5 | -37.3 | -179.4 | -63.1 | 173.5 | 0 | 0 | 0 | 112.5 | R40 A41 S48 | R40-L44 PolarHBondContact O-N 3.23Å; A41-L44 PolarHBondContact O-N 3.26Å; L44-S48 WeakPolarHBondContact O-CB 3.34Å; L44-S48 PolarHBondContact O-N 3.28Å |
| 45 | F | 97.8 | Very high | 97.3 | Very high | 57 Ų | 57 | 61.2 Ų | 61.2 | 25% | 0.25 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -64.1 | -47.8 | 175.6 | 164 | -105.4 | 0 | 0 | 0 | 111.6 | A41 E47 S48 L49 F80 F82 L83 | A41-F45 WeakPolarHBondContact O-CB 3.3Å; A41-F45 PolarHBondContact O-N 3.38Å; F45-E47 PolarHBondContact O-N 3.47Å; F45-S48 PolarHBondContact O-N 2.82Å; F45-L49 HydrophobicContact CE1-CD2 4.36Å; F45-L49 HydrophobicContact CZ-CD2 3.95Å; F45-L49 WeakPolarHBondContact O-CB 3.46Å; F45-L49 PolarHBondContact O-N 3.16Å; F45-F80 HydrophobicContact CD2-CE1 4.23Å; F45-F80 AromaticContact CE2-CD1 3.95Å; F45-F80 HydrophobicContact CE2-CD1 3.95Å; F45-F80 AromaticContact CE2-CE1 3.85Å; F45-F80 HydrophobicContact CE2-CE1 3.85Å; F45-F82 HydrophobicContact CD2-CZ 4.48Å; F45-F82 HydrophobicContact CE2-CE1 4.17Å; F45-F82 AromaticContact CE2-CZ 3.67Å; F45-F82 HydrophobicContact CE2-CZ 3.67Å; F45-F82 AromaticContact CZ-CZ 3.82Å; F45-F82 HydrophobicContact CZ-CZ 3.82Å; F45-L83 HydrophobicContact CE2-CD1 4.47Å; F45-L83 HydrophobicContact CZ-CD1 4Å |
| 46 | L | 97.8 | Very high | 97.3 | Very high | 68 Ų | 68 | 61.8 Ų | 61.8 | 36% | 0.356 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -64.5 | -39.1 | 177.3 | -71.4 | 170.7 | 0 | 0 | 0 | 111.8 | F12 L42 E43 S48 L49 L50 | F12-L46 HydrophobicContact CE2-CD1 4.37Å; F12-L46 HydrophobicContact CZ-CD1 3.71Å; L42-L46 WeakPolarHBondContact O-CB 3.46Å; L42-L46 VanDerWaalsContact O-CG 3.26Å; L42-L46 WeakPolarHBondContact O-CG 3.43Å; L42-L46 PolarHBondContact O-N 3.36Å; E43-L46 PolarHBondContact O-N 3.36Å; L46-S48 PolarHBondContact O-N 2.89Å; L46-L49 PolarHBondContact O-N 3.4Å; L46-L50 VanDerWaalsContact O-CB 3.23Å; L46-L50 WeakPolarHBondContact O-CB 3.4Å; L46-L50 WeakPolarHBondContact O-CG 3.48Å; L46-L50 PolarHBondContact O-N 3.32Å |
| 47 | E | 97.6 | Very high | 97.3 | Very high | 126 Ų | 126 | 60.7 Ų | 60.7 | 59% | 0.589 | 32% | 0.315 | S | S | * | . | H | α-helix | trans | -59.5 | -44.9 | 173.5 | -173.9 | 177.8 | 164 | 0 | 0 | 111.6 | E43 F45 T51 | E43-E47 WeakPolarHBondContact O-CB 3.44Å; E43-E47 PolarHBondContact O-N 2.89Å; F45-E47 PolarHBondContact O-N 3.47Å; E47-T51 WeakPolarHBondContact O-CB 3.48Å; E47-T51 PolarHBondContact O-N 3.02Å; E47-T51 PolarHBondContact O-OG1 3.05Å |
| 48 | S | 97.9 | Very high | 97.2 | Very high | 42 Ų | 42 | 61 Ų | 61 | 29% | 0.294 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -64.4 | -49.5 | 177.4 | -172.8 | 0 | 0 | 0 | 0 | 112.4 | L44 F45 L46 T51 K52 | L44-S48 WeakPolarHBondContact O-CB 3.34Å; L44-S48 PolarHBondContact O-N 3.28Å; F45-S48 PolarHBondContact O-N 2.82Å; L46-S48 PolarHBondContact O-N 2.89Å; S48-T51 PolarHBondContact O-N 3.26Å; S48-K52 WeakPolarHBondContact O-CG 3.41Å; S48-K52 PolarHBondContact O-N 3.14Å |
| 49 | L | 97.8 | Very high | 97 | Very high | 18 Ų | 18 | 62.6 Ų | 62.6 | 9% | 0.094 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -61.1 | -48.5 | 179.2 | 178.4 | 62.6 | 0 | 0 | 0 | 111.7 | F45 L46 K52 A53 L70 I74 F80 | F45-L49 HydrophobicContact CE1-CD2 4.36Å; F45-L49 HydrophobicContact CZ-CD2 3.95Å; F45-L49 WeakPolarHBondContact O-CB 3.46Å; F45-L49 PolarHBondContact O-N 3.16Å; L46-L49 PolarHBondContact O-N 3.4Å; L49-K52 PolarHBondContact O-N 3.2Å; L49-A53 VanDerWaalsContact O-CB 3.29Å; L49-A53 WeakPolarHBondContact O-CB 3.29Å; L49-A53 PolarHBondContact O-N 3.28Å; L49-L70 HydrophobicContact CD1-CD2 4.44Å; L49-L70 HydrophobicContact CG-CD2 4.41Å; L49-I74 HydrophobicContact CD1-CG1 4.34Å; L49-F80 HydrophobicContact CB-CE1 4.47Å; L49-F80 HydrophobicContact CB-CE2 4.44Å; L49-F80 HydrophobicContact CB-CZ 4.03Å; L49-F80 HydrophobicContact CD1-CD2 3.86Å; L49-F80 HydrophobicContact CD1-CE2 3.67Å; L49-F80 HydrophobicContact CD1-CG 4.41Å; L49-F80 HydrophobicContact CD1-CZ 4.06Å |
| 50 | L | 97.4 | Very high | 96.7 | Very high | 87 Ų | 87 | 66.3 Ų | 66.3 | 46% | 0.455 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -66.7 | -38.5 | 180 | -68 | 172.8 | 0 | 0 | 0 | 111.7 | L46 C54 M65 | L46-L50 VanDerWaalsContact O-CB 3.23Å; L46-L50 WeakPolarHBondContact O-CB 3.4Å; L46-L50 WeakPolarHBondContact O-CG 3.48Å; L46-L50 PolarHBondContact O-N 3.32Å; L50-C54 WeakPolarHBondContact O-CB 3.36Å; L50-C54 PolarHBondContact O-N 3.32Å; L50-M65 HydrophobicContact CD2-CE 3.75Å |
| 51 | T | 97.8 | Very high | 96.6 | Very high | 76 Ų | 76 | 66.8 Ų | 66.8 | 47% | 0.466 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -62.2 | -43.7 | 176.4 | -64.9 | 0 | 0 | 0 | 0 | 111.7 | E47 S48 Q55 | E47-T51 WeakPolarHBondContact O-CB 3.48Å; E47-T51 PolarHBondContact O-N 3.02Å; E47-T51 PolarHBondContact O-OG1 3.05Å; S48-T51 PolarHBondContact O-N 3.26Å; T51-Q55 WeakPolarHBondContact O-CG 3.43Å; T51-Q55 PolarHBondContact O-N 2.96Å; T51-Q55 PolarHBondContact O-NE2 2.71Å |
| 52 | K | 97.3 | Very high | 96.4 | Very high | 37 Ų | 37 | 65.7 Ų | 65.7 | 16% | 0.161 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -71.4 | -45.3 | 178.3 | -70.1 | 169.6 | 169.2 | -166.9 | 0 | 111.9 | S48 L49 C54 Q55 V56 C73 E77 F80 | S48-K52 WeakPolarHBondContact O-CG 3.41Å; S48-K52 PolarHBondContact O-N 3.14Å; L49-K52 PolarHBondContact O-N 3.2Å; K52-C54 VanDerWaalsContact C-N 3.27Å; K52-C54 PolarHBondContact O-N 3.12Å; K52-Q55 WeakPolarHBondContact O-CB 3.45Å; K52-Q55 PolarHBondContact O-N 2.94Å; K52-V56 PolarHBondContact O-N 2.9Å; K52-V56 VanDerWaalsContact O-N 3.12Å; K52-C73 WeakPolarHBondContact CB-SG 3.15Å; K52-E77 HydrophobicContact CD-CG 4.02Å; K52-E77 WeakPolarHBondContact CD-OE1 3.43Å; K52-E77 WeakPolarHBondContact CE-OE1 3.46Å; K52-E77 IonicContact NZ-OE1 3.14Å; K52-E77 PolarHBondContact NZ-OE1 3.2Å; K52-E77 VanDerWaalsContact NZ-OE1 3.14Å; K52-E77 IonicContact NZ-OE2 2.71Å; K52-E77 PolarHBondContact NZ-OE2 3.15Å; K52-F80 HydrophobicContact CB-CE2 4.43Å; K52-F80 HydrophobicContact CD-CE2 3.58Å; K52-F80 HydrophobicContact CD-CZ 3.76Å |
| 53 | A | 96.9 | Very high | 96.2 | Very high | 0 Ų | 0 | 72.7 Ų | 72.7 | 0% | 0 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -66.5 | -28.7 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113 | L49 V56 T57 M65 L70 C73 | L49-A53 VanDerWaalsContact O-CB 3.29Å; L49-A53 WeakPolarHBondContact O-CB 3.29Å; L49-A53 PolarHBondContact O-N 3.28Å; A53-V56 PolarHBondContact O-N 3.38Å; A53-T57 WeakPolarHBondContact O-CB 3.41Å; A53-T57 PolarHBondContact O-N 3.5Å; A53-T57 PolarHBondContact O-OG1 3.1Å; A53-M65 HydrophobicContact CB-SD 3.48Å; A53-M65 WeakPolarHBondContact CB-SD 3.18Å; A53-L70 HydrophobicContact CB-CD2 3.66Å; A53-L70 HydrophobicContact CB-CG 4.37Å; A53-C73 HydrophobicContact CB-CB 3.97Å; A53-C73 PolarHBondContact N-SG 3.49Å; A53-C73 VanDerWaalsContact N-SG 3.36Å |
| 54 | C | 97.2 | Very high | 96.1 | Very high | 57 Ų | 57 | 75.7 Ų | 75.7 | 39% | 0.385 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -68.3 | -35.1 | 170.5 | -169.5 | 0 | 0 | 0 | 0 | 112.3 | L50 K52 T57 Q58 | L50-C54 WeakPolarHBondContact O-CB 3.36Å; L50-C54 PolarHBondContact O-N 3.32Å; K52-C54 VanDerWaalsContact C-N 3.27Å; K52-C54 PolarHBondContact O-N 3.12Å; C54-T57 PolarHBondContact O-N 3.5Å; C54-Q58 WeakPolarHBondContact O-CB 3.48Å; C54-Q58 VanDerWaalsContact O-CG 3.31Å; C54-Q58 WeakPolarHBondContact O-CG 3.37Å; C54-Q58 PolarHBondContact O-N 3.26Å; C54-Q58 PolarHBondContact O-NE2 3.4Å; C54-Q58 PolarHBondContact SG-NE2 3.01Å |
| 55 | Q | 96.8 | Very high | 96 | Very high | 115 Ų | 115 | 74.6 Ų | 74.6 | 54% | 0.537 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -65.6 | -43.1 | 172.6 | -70.8 | 169 | 62.2 | 0 | 0 | 111.5 | T51 K52 T57 Q58 S59 | T51-Q55 WeakPolarHBondContact O-CG 3.43Å; T51-Q55 PolarHBondContact O-N 2.96Å; T51-Q55 PolarHBondContact O-NE2 2.71Å; K52-Q55 WeakPolarHBondContact O-CB 3.45Å; K52-Q55 PolarHBondContact O-N 2.94Å; Q55-T57 VanDerWaalsContact C-N 3.33Å; Q55-T57 PolarHBondContact O-N 3.49Å; Q55-Q58 PolarHBondContact O-N 3.33Å; Q55-S59 PolarHBondContact O-N 2.69Å; Q55-S59 PolarHBondContact O-OG 2.96Å |
| 56 | V | 95.4 | Very high | 95.9 | Very high | 18 Ų | 18 | 74.9 Ų | 74.9 | 11% | 0.109 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -61.2 | -40.6 | 173.7 | 177.3 | 0 | 0 | 0 | 0 | 111.7 | K52 A53 S59 R60 H69 Q72 C73 L76 | K52-V56 PolarHBondContact O-N 2.9Å; K52-V56 VanDerWaalsContact O-N 3.12Å; A53-V56 PolarHBondContact O-N 3.38Å; V56-S59 PolarHBondContact O-OG 3.26Å; V56-S59 VanDerWaalsContact O-OG 3.05Å; V56-R60 WeakPolarHBondContact O-CG 3.31Å; V56-R60 PolarHBondContact O-N 3.31Å; V56-H69 HydrophobicContact CG1-CB 4.24Å; V56-Q72 HydrophobicContact CG1-CB 4.07Å; V56-Q72 HydrophobicContact CG1-CG 3.89Å; V56-C73 HydrophobicContact CG2-CB 4.12Å; V56-L76 HydrophobicContact CG2-CD1 4.39Å |
| 57 | T | 96.1 | Very high | 95.8 | Very high | 8 Ų | 8 | 76 Ų | 76 | 5% | 0.049 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -62 | -43.9 | 175.3 | -60.3 | 0 | 0 | 0 | 0 | 111.3 | A53 C54 Q55 A62 M65 H69 | A53-T57 WeakPolarHBondContact O-CB 3.41Å; A53-T57 PolarHBondContact O-N 3.5Å; A53-T57 PolarHBondContact O-OG1 3.1Å; C54-T57 PolarHBondContact O-N 3.5Å; Q55-T57 VanDerWaalsContact C-N 3.33Å; Q55-T57 PolarHBondContact O-N 3.49Å; T57-A62 HydrophobicContact CG2-CB 3.96Å; T57-A62 WeakPolarHBondContact O-CB 3.45Å; T57-A62 PolarHBondContact O-N 2.9Å; T57-M65 HydrophobicContact CG2-CB 4.33Å; T57-M65 WeakPolarHBondContact OG1-CG 3.04Å; T57-H69 PolarHBondContact OG1-ND1 3.32Å |
| 58 | Q | 96 | Very high | 95.7 | Very high | 121 Ų | 121 | 71.1 Ų | 71.1 | 57% | 0.565 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | -71.4 | -37.7 | -179.8 | -75 | 173.4 | 78.2 | 0 | 0 | 113.5 | C54 Q55 R60 N61 | C54-Q58 WeakPolarHBondContact O-CB 3.48Å; C54-Q58 VanDerWaalsContact O-CG 3.31Å; C54-Q58 WeakPolarHBondContact O-CG 3.37Å; C54-Q58 PolarHBondContact O-N 3.26Å; C54-Q58 PolarHBondContact O-NE2 3.4Å; C54-Q58 PolarHBondContact SG-NE2 3.01Å; Q55-Q58 PolarHBondContact O-N 3.33Å; Q58-R60 PolarHBondContact O-N 3.11Å; Q58-N61 WeakPolarHBondContact O-CA 3.46Å; Q58-N61 PolarHBondContact O-N 3.07Å |
| 59 | S | 94.1 | Very high | 95.6 | Very high | 86 Ų | 86 | 69.2 Ų | 69.2 | 60% | 0.601 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -65.8 | -28.4 | 178.3 | 67.6 | 0 | 0 | 0 | 0 | 112.4 | Q55 V56 N61 | Q55-S59 PolarHBondContact O-N 2.69Å; Q55-S59 PolarHBondContact O-OG 2.96Å; V56-S59 PolarHBondContact O-OG 3.26Å; V56-S59 VanDerWaalsContact O-OG 3.05Å; S59-N61 PolarHBondContact O-N 3.38Å |
| 60 | R | 90.5 | Very high | 95.6 | Very high | 78 Ų | 78 | 70.6 Ų | 70.6 | 29% | 0.294 | 38% | 0.38 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -83.7 | 11.3 | 170.3 | -62.5 | -68.3 | -176.7 | 177.8 | -3.3 | 113.8 | V56 Q58 A62 M93 G95 E96 G97 | V56-R60 WeakPolarHBondContact O-CG 3.31Å; V56-R60 PolarHBondContact O-N 3.31Å; Q58-R60 PolarHBondContact O-N 3.11Å; R60-A62 PolarHBondContact O-N 3.4Å; R60-M93 HydrophobicContact CB-CE 3.86Å; R60-M93 HydrophobicContact CB-SD 4.48Å; R60-M93 HydrophobicContact CG-CE 3.91Å; R60-M93 HydrophobicContact CG-SD 3.89Å; R60-G95 PolarHBondContact NH1-O 3.15Å; R60-E96 PolarHBondContact NH1-O 3.08Å; R60-G97 PolarHBondContact NH2-O 3.43Å |
| 61 | N | 93.9 | Very high | 95.5 | Very high | 154 Ų | 154 | 67.2 Ų | 67.2 | 82% | 0.824 | 36% | 0.362 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53.6 | 20.2 | -175.9 | -55.2 | 117.7 | 0 | 0 | 0 | 115 | Q58 S59 | Q58-N61 WeakPolarHBondContact O-CA 3.46Å; Q58-N61 PolarHBondContact O-N 3.07Å; S59-N61 PolarHBondContact O-N 3.38Å |
| 62 | A | 93.2 | Very high | 95.4 | Very high | 31 Ų | 31 | 66.3 Ų | 66.3 | 26% | 0.256 | 35% | 0.353 | S | S | . | . | trans | -83.7 | 148.7 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111 | T57 R60 | T57-A62 HydrophobicContact CG2-CB 3.96Å; T57-A62 WeakPolarHBondContact O-CB 3.45Å; T57-A62 PolarHBondContact O-N 2.9Å; R60-A62 PolarHBondContact O-N 3.4Å | ||
| 63 | K | 94.1 | Very high | 95.4 | Very high | 209 Ų | 209 | 64.6 Ų | 64.6 | 91% | 0.909 | 35% | 0.345 | S | S | * | . | S | Bend | trans | -98.6 | -15.4 | 175 | -64.8 | 179 | -178.1 | 176.7 | 0 | 113.3 | ||
| 64 | T | 95 | Very high | 95.4 | Very high | 106 Ų | 106 | 65 Ų | 65 | 65% | 0.65 | 35% | 0.347 | S | S | * | . | S | Bend | trans | -122.1 | 128 | -176.4 | -54.5 | 0 | 0 | 0 | 0 | 108.2 | H69 | T64-H69 PolarHBondContact O-CE1 3.43Š|
| 65 | M | 96 | Very high | 95.3 | Very high | 73 Ų | 73 | 66.2 Ų | 66.2 | 36% | 0.36 | 35% | 0.347 | S | S | . | . | trans | -76.9 | 128.6 | 175 | -174.3 | 168.2 | 63.6 | 0 | 0 | 110.1 | L50 A53 T57 H69 L70 | L50-M65 HydrophobicContact CD2-CE 3.75Å; A53-M65 HydrophobicContact CB-SD 3.48Å; A53-M65 WeakPolarHBondContact CB-SD 3.18Å; T57-M65 HydrophobicContact CG2-CB 4.33Å; T57-M65 WeakPolarHBondContact OG1-CG 3.04Å; M65-H69 HydrophobicContact CG-CB 4.19Å; M65-L70 HydrophobicContact SD-CD2 4.3Å; M65-L70 HydrophobicContact SD-CG 4.29Å | ||
| 66 | T | 95.9 | Very high | 95.2 | Very high | 62 Ų | 62 | 66.3 Ų | 66.3 | 38% | 0.38 | 35% | 0.351 | S | S | . | . | trans | -109 | 168.1 | 176.6 | 63.2 | 0 | 0 | 0 | 0 | 110.4 | S68 H69 L70 | T66-S68 PolarHBondContact O-N 2.88Å; T66-H69 PolarHBondContact N-ND1 3Å; T66-H69 PolarHBondContact O-N 3.28Å; T66-H69 VanDerWaalsContact O-N 3.16Å; T66-L70 PolarHBondContact O-N 3.26Å | ||
| 67 | T | 95.4 | Very high | 95.2 | Very high | 92 Ų | 92 | 68.2 Ų | 68.2 | 56% | 0.564 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -59.9 | -34.3 | 174.3 | 46.1 | 0 | 0 | 0 | 0 | 112.4 | H69 L70 K71 | T67-H69 PolarHBondContact O-N 2.86Å; T67-L70 WeakPolarHBondContact O-CB 3.17Å; T67-L70 PolarHBondContact O-N 2.95Å; T67-L70 VanDerWaalsContact O-N 3.15Å; T67-K71 PolarHBondContact O-N 3.45Å |
| 68 | S | 95.9 | Very high | 95.2 | Very high | 23 Ų | 23 | 75.5 Ų | 75.5 | 16% | 0.161 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -66.6 | -31.8 | 175.6 | -50.9 | 0 | 0 | 0 | 0 | 113.1 | T66 L70 Q72 P91 | T66-S68 PolarHBondContact O-N 2.88Å; S68-L70 VanDerWaalsContact C-N 3.35Å; S68-Q72 WeakPolarHBondContact O-CB 3.4Å; S68-Q72 PolarHBondContact O-N 3.42Å; S68-P91 PolarHBondContact OG-O 3.21Å |
| 69 | H | 95.9 | Very high | 95.2 | Very high | 3 Ų | 3 | 76.4 Ų | 76.4 | 1% | 0.014 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -66.5 | -37.4 | 170.5 | -58.6 | 156.1 | 0 | 0 | 0 | 111.9 | V56 T57 T64 M65 T66 T67 C73 M93 | V56-H69 HydrophobicContact CG1-CB 4.24Å; T57-H69 PolarHBondContact OG1-ND1 3.32Å; T64-H69 PolarHBondContact O-CE1 3.43Å; M65-H69 HydrophobicContact CG-CB 4.19Å; T66-H69 PolarHBondContact N-ND1 3Å; T66-H69 PolarHBondContact O-N 3.28Å; T66-H69 VanDerWaalsContact O-N 3.16Å; T67-H69 PolarHBondContact O-N 2.86Å; H69-C73 VanDerWaalsContact O-CB 3.3Å; H69-C73 WeakPolarHBondContact O-CB 3.23Å; H69-C73 PolarHBondContact O-N 3Å; H69-M93 PolarHBondContact CD2-SD 3.25Å; H69-M93 WeakPolarHBondContact NE2-CE 3.44Å |
| 70 | L | 96.4 | Very high | 95.4 | Very high | 47 Ų | 47 | 72.6 Ų | 72.6 | 25% | 0.246 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -67 | -43.9 | 176 | -78 | 162.8 | 0 | 0 | 0 | 111.3 | L49 A53 M65 T66 T67 S68 C73 I74 | L49-L70 HydrophobicContact CD1-CD2 4.44Å; L49-L70 HydrophobicContact CG-CD2 4.41Å; A53-L70 HydrophobicContact CB-CD2 3.66Å; A53-L70 HydrophobicContact CB-CG 4.37Å; M65-L70 HydrophobicContact SD-CD2 4.3Å; M65-L70 HydrophobicContact SD-CG 4.29Å; T66-L70 PolarHBondContact O-N 3.26Å; T67-L70 WeakPolarHBondContact O-CB 3.17Å; T67-L70 PolarHBondContact O-N 2.95Å; T67-L70 VanDerWaalsContact O-N 3.15Å; S68-L70 VanDerWaalsContact C-N 3.35Å; L70-C73 WeakPolarHBondContact O-CB 3.46Å; L70-C73 PolarHBondContact O-N 3.36Å; L70-I74 WeakPolarHBondContact O-CD1 3.47Å; L70-I74 WeakPolarHBondContact O-CG1 3.38Å; L70-I74 PolarHBondContact O-N 3.47Å |
| 71 | K | 96.7 | Very high | 95.7 | Very high | 16 Ų | 16 | 72 Ų | 72 | 7% | 0.07 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -54.8 | -54.5 | 173.2 | -175 | -175.7 | -173.2 | -177.3 | 0 | 111.2 | T67 C73 I74 E75 V87 V90 D92 | T67-K71 PolarHBondContact O-N 3.45Å; K71-C73 VanDerWaalsContact C-N 3.28Å; K71-C73 PolarHBondContact O-N 2.98Å; K71-I74 WeakPolarHBondContact O-CB 3.08Å; K71-I74 PolarHBondContact O-N 3.4Å; K71-E75 WeakPolarHBondContact CE-OE1 3.35Å; K71-E75 WeakPolarHBondContact O-CG 3.33Å; K71-E75 PolarHBondContact O-N 2.99Å; K71-V87 HydrophobicContact CB-CB 4.27Å; K71-V87 HydrophobicContact CB-CG2 4.39Å; K71-V87 HydrophobicContact CG-CB 4.16Å; K71-V87 HydrophobicContact CG-CG2 3.96Å; K71-V90 HydrophobicContact CB-CB 4.47Å; K71-V90 HydrophobicContact CB-CG1 4.31Å; K71-V90 HydrophobicContact CD-CB 4.17Å; K71-V90 HydrophobicContact CD-CG1 4.45Å; K71-V90 WeakPolarHBondContact CD-O 3.35Å; K71-V90 PolarHBondContact NZ-O 3.03Å; K71-D92 VanDerWaalsContact CE-OD1 3.26Å; K71-D92 WeakPolarHBondContact CE-OD1 3.45Å; K71-D92 IonicContact NZ-OD1 2.65Å; K71-D92 PolarHBondContact NZ-OD1 3.06Å; K71-D92 IonicContact NZ-OD2 2.68Å |
| 72 | Q | 95.6 | Very high | 95.9 | Very high | 57 Ų | 57 | 71.3 Ų | 71.3 | 27% | 0.266 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -57.6 | -39.9 | 178.1 | -177 | 69.4 | 81.5 | 0 | 0 | 112.5 | V56 S68 E75 L76 | V56-Q72 HydrophobicContact CG1-CB 4.07Å; V56-Q72 HydrophobicContact CG1-CG 3.89Å; S68-Q72 WeakPolarHBondContact O-CB 3.4Å; S68-Q72 PolarHBondContact O-N 3.42Å; Q72-E75 PolarHBondContact O-N 3.21Å; Q72-L76 HydrophobicContact CG-CD1 4.03Å; Q72-L76 WeakPolarHBondContact O-CD1 3.26Å; Q72-L76 VanDerWaalsContact O-CG 3.23Å; Q72-L76 WeakPolarHBondContact O-CG 3.49Å; Q72-L76 PolarHBondContact O-N 3.24Å |
| 73 | C | 96.6 | Very high | 96.1 | Very high | 1 Ų | 1 | 71 Ų | 71 | 1% | 0.007 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -64.5 | -37.6 | 176.1 | -176.4 | 0 | 0 | 0 | 0 | 112.8 | K52 A53 V56 H69 L70 K71 E77 | K52-C73 WeakPolarHBondContact CB-SG 3.15Å; A53-C73 HydrophobicContact CB-CB 3.97Å; A53-C73 PolarHBondContact N-SG 3.49Å; A53-C73 VanDerWaalsContact N-SG 3.36Å; V56-C73 HydrophobicContact CG2-CB 4.12Å; H69-C73 VanDerWaalsContact O-CB 3.3Å; H69-C73 WeakPolarHBondContact O-CB 3.23Å; H69-C73 PolarHBondContact O-N 3Å; L70-C73 WeakPolarHBondContact O-CB 3.46Å; L70-C73 PolarHBondContact O-N 3.36Å; K71-C73 VanDerWaalsContact C-N 3.28Å; K71-C73 PolarHBondContact O-N 2.98Å; C73-E77 WeakPolarHBondContact O-CB 3.37Å; C73-E77 WeakPolarHBondContact O-CG 3.44Å |
| 74 | I | 97.1 | Very high | 96.1 | Very high | 7 Ų | 7 | 64.5 Ų | 64.5 | 4% | 0.036 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -71.9 | -35.4 | 178.3 | -74.2 | 161.3 | 0 | 0 | 0 | 111.1 | L49 L70 K71 F80 L83 K84 V87 | L49-I74 HydrophobicContact CD1-CG1 4.34Å; L70-I74 WeakPolarHBondContact O-CD1 3.47Å; L70-I74 WeakPolarHBondContact O-CG1 3.38Å; L70-I74 PolarHBondContact O-N 3.47Å; K71-I74 WeakPolarHBondContact O-CB 3.08Å; K71-I74 PolarHBondContact O-N 3.4Å; I74-F80 HydrophobicContact CB-CB 4.44Å; I74-F80 HydrophobicContact CG1-CB 4.21Å; I74-F80 HydrophobicContact CG2-CB 4.39Å; I74-L83 HydrophobicContact CD1-CB 3.87Å; I74-L83 HydrophobicContact CD1-CD1 3.97Å; I74-L83 HydrophobicContact CG1-CB 4.17Å; I74-L83 HydrophobicContact CG1-CD1 4.04Å; I74-L83 HydrophobicContact CG2-CB 3.86Å; I74-K84 HydrophobicContact CG2-CG 3.87Å; I74-V87 HydrophobicContact CB-CG2 4.36Å; I74-V87 HydrophobicContact CD1-CG1 3.63Å; I74-V87 HydrophobicContact CD1-CG2 4.24Å; I74-V87 HydrophobicContact CG2-CG2 3.97Å |
| 75 | E | 95.1 | Very high | 96.2 | Very high | 83 Ų | 83 | 66.7 Ų | 66.7 | 39% | 0.388 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -71.8 | -34.4 | 179 | -72.2 | 173.5 | 168.9 | 0 | 0 | 113.6 | K71 Q72 | K71-E75 WeakPolarHBondContact CE-OE1 3.35Å; K71-E75 WeakPolarHBondContact O-CG 3.33Å; K71-E75 PolarHBondContact O-N 2.99Å; Q72-E75 PolarHBondContact O-N 3.21Å |
| 76 | L | 94.3 | Very high | 96.3 | Very high | 118 Ų | 118 | 69.8 Ų | 69.8 | 62% | 0.618 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -76 | -19.4 | 179.7 | -70.9 | 169.9 | 0 | 0 | 0 | 114 | V56 Q72 | V56-L76 HydrophobicContact CG2-CD1 4.39Å; Q72-L76 HydrophobicContact CG-CD1 4.03Å; Q72-L76 WeakPolarHBondContact O-CD1 3.26Å; Q72-L76 VanDerWaalsContact O-CG 3.23Å; Q72-L76 WeakPolarHBondContact O-CG 3.49Å; Q72-L76 PolarHBondContact O-N 3.24Å |
| 77 | E | 95.8 | Very high | 96.3 | Very high | 57 Ų | 57 | 67.7 Ų | 67.7 | 27% | 0.266 | 34% | 0.339 | S | S | . | . | trans | -121.5 | 101.1 | -163.9 | -73.9 | -81.5 | -163.5 | 0 | 0 | 111 | K52 C73 Q79 F80 | K52-E77 HydrophobicContact CD-CG 4.02Å; K52-E77 WeakPolarHBondContact CD-OE1 3.43Å; K52-E77 WeakPolarHBondContact CE-OE1 3.46Å; K52-E77 IonicContact NZ-OE1 3.14Å; K52-E77 PolarHBondContact NZ-OE1 3.2Å; K52-E77 VanDerWaalsContact NZ-OE1 3.14Å; K52-E77 IonicContact NZ-OE2 2.71Å; K52-E77 PolarHBondContact NZ-OE2 3.15Å; C73-E77 WeakPolarHBondContact O-CB 3.37Å; C73-E77 WeakPolarHBondContact O-CG 3.44Å; E77-Q79 PolarHBondContact O-N 2.9Å; E77-F80 HydrophobicContact CB-CB 4.46Å; E77-F80 HydrophobicContact CB-CD2 3.53Å; E77-F80 HydrophobicContact CB-CE2 4.04Å; E77-F80 HydrophobicContact CB-CG 4.18Å; E77-F80 HydrophobicContact CG-CD2 4.22Å; E77-F80 HydrophobicContact CG-CE2 4.3Å; E77-F80 WeakPolarHBondContact O-CA 3.45Å; E77-F80 WeakPolarHBondContact O-CB 3.43Å; E77-F80 PolarHBondContact O-N 3.41Å | ||
| 78 | Q | 96.1 | Very high | 96.2 | Very high | 161 Ų | 161 | 66.5 Ų | 66.5 | 75% | 0.752 | 34% | 0.339 | S | S | * | . | G | 310 helix | trans | -53.1 | -30 | -177.3 | 177.6 | 168.1 | 79.6 | 0 | 0 | 114.1 | F80 D81 | Q78-F80 PolarHBondContact O-N 3Å; Q78-F80 VanDerWaalsContact O-N 3.16Å; Q78-D81 WeakPolarHBondContact O-CB 3.36Å; Q78-D81 VanDerWaalsContact O-CG 3.27Å; Q78-D81 PolarHBondContact O-N 3.24Å |
| 79 | Q | 96.2 | Very high | 96.2 | Very high | 141 Ų | 141 | 70.1 Ų | 70.1 | 66% | 0.659 | 37% | 0.37 | S | S | * | . | G | 310 helix | trans | -65 | -15.3 | 176 | -60.1 | -171.7 | -67.8 | 0 | 0 | 113.6 | E77 F82 | E77-Q79 PolarHBondContact O-N 2.9Å; Q79-F82 WeakPolarHBondContact O-CE1 3.47Å |
| 80 | F | 97.4 | Very high | 96.1 | Very high | 6 Ų | 6 | 71.4 Ų | 71.4 | 3% | 0.026 | 38% | 0.378 | C | S | . | . | G | 310 helix | trans | -106.8 | 7.9 | -179.9 | -57.7 | -27.8 | 0 | 0 | 0 | 112.8 | F45 L49 K52 I74 E77 Q78 F82 L83 | F45-F80 HydrophobicContact CD2-CE1 4.23Å; F45-F80 AromaticContact CE2-CD1 3.95Å; F45-F80 HydrophobicContact CE2-CD1 3.95Å; F45-F80 AromaticContact CE2-CE1 3.85Å; F45-F80 HydrophobicContact CE2-CE1 3.85Å; L49-F80 HydrophobicContact CB-CE1 4.47Å; L49-F80 HydrophobicContact CB-CE2 4.44Å; L49-F80 HydrophobicContact CB-CZ 4.03Å; L49-F80 HydrophobicContact CD1-CD2 3.86Å; L49-F80 HydrophobicContact CD1-CE2 3.67Å; L49-F80 HydrophobicContact CD1-CG 4.41Å; L49-F80 HydrophobicContact CD1-CZ 4.06Å; K52-F80 HydrophobicContact CB-CE2 4.43Å; K52-F80 HydrophobicContact CD-CE2 3.58Å; K52-F80 HydrophobicContact CD-CZ 3.76Å; I74-F80 HydrophobicContact CB-CB 4.44Å; I74-F80 HydrophobicContact CG1-CB 4.21Å; I74-F80 HydrophobicContact CG2-CB 4.39Å; E77-F80 HydrophobicContact CB-CB 4.46Å; E77-F80 HydrophobicContact CB-CD2 3.53Å; E77-F80 HydrophobicContact CB-CE2 4.04Å; E77-F80 HydrophobicContact CB-CG 4.18Å; E77-F80 HydrophobicContact CG-CD2 4.22Å; E77-F80 HydrophobicContact CG-CE2 4.3Å; E77-F80 WeakPolarHBondContact O-CA 3.45Å; E77-F80 WeakPolarHBondContact O-CB 3.43Å; E77-F80 PolarHBondContact O-N 3.41Å; Q78-F80 PolarHBondContact O-N 3Å; Q78-F80 VanDerWaalsContact O-N 3.16Å; F80-F82 PolarHBondContact O-N 3.41Å; F80-L83 HydrophobicContact CB-CD1 4.23Å; F80-L83 WeakPolarHBondContact O-CB 3.39Å; F80-L83 PolarHBondContact O-N 3.42Å |
| 81 | D | 96.9 | Very high | 95.8 | Very high | 65 Ų | 65 | 73.9 Ų | 73.9 | 35% | 0.348 | 40% | 0.397 | S | S | . | . | G | 310 helix | trans | -52.4 | -33.7 | -178.6 | -81.2 | -5.5 | 0 | 0 | 0 | 113.3 | Q78 L83 K84 | Q78-D81 WeakPolarHBondContact O-CB 3.36Å; Q78-D81 VanDerWaalsContact O-CG 3.27Å; Q78-D81 PolarHBondContact O-N 3.24Å; D81-L83 PolarHBondContact O-N 3.16Å; D81-K84 HydrophobicContact CB-CD 4.42Å; D81-K84 WeakPolarHBondContact O-CB 3.27Å; D81-K84 WeakPolarHBondContact O-CG 3.16Å; D81-K84 PolarHBondContact O-N 3.25Å; D81-K84 WeakPolarHBondContact OD1-CE 3.48Å; D81-K84 IonicContact OD1-NZ 3.67Å; D81-K84 PolarHBondContact OD1-NZ 3.5Å |
| 82 | F | 97.5 | Very high | 95.4 | Very high | 139 Ų | 139 | 77.9 Ų | 77.9 | 61% | 0.61 | 42% | 0.419 | S | S | * | . | G | 310 helix | trans | -62.9 | -9.1 | 176.4 | 75.8 | -85.5 | 0 | 0 | 0 | 114.9 | F45 Q79 F80 | F45-F82 HydrophobicContact CD2-CZ 4.48Å; F45-F82 HydrophobicContact CE2-CE1 4.17Å; F45-F82 AromaticContact CE2-CZ 3.67Å; F45-F82 HydrophobicContact CE2-CZ 3.67Å; F45-F82 AromaticContact CZ-CZ 3.82Å; F45-F82 HydrophobicContact CZ-CZ 3.82Å; Q79-F82 WeakPolarHBondContact O-CE1 3.47Å; F80-F82 PolarHBondContact O-N 3.41Å |
| 83 | L | 97.4 | Very high | 94.7 | Very high | 24 Ų | 24 | 78.2 Ų | 78.2 | 13% | 0.126 | 42% | 0.421 | C | S | . | . | G | 310 helix | trans | -101.2 | -6.8 | 176.8 | -58.8 | 171.5 | 0 | 0 | 0 | 113.1 | F45 I74 F80 D81 D85 L86 V87 | F45-L83 HydrophobicContact CE2-CD1 4.47Å; F45-L83 HydrophobicContact CZ-CD1 4Å; I74-L83 HydrophobicContact CD1-CB 3.87Å; I74-L83 HydrophobicContact CD1-CD1 3.97Å; I74-L83 HydrophobicContact CG1-CB 4.17Å; I74-L83 HydrophobicContact CG1-CD1 4.04Å; I74-L83 HydrophobicContact CG2-CB 3.86Å; F80-L83 HydrophobicContact CB-CD1 4.23Å; F80-L83 WeakPolarHBondContact O-CB 3.39Å; F80-L83 PolarHBondContact O-N 3.42Å; D81-L83 PolarHBondContact O-N 3.16Å; L83-D85 VanDerWaalsContact C-N 3.35Å; L83-D85 PolarHBondContact O-N 2.96Å; L83-L86 HydrophobicContact CD2-CD2 4.45Å; L83-L86 WeakPolarHBondContact O-CB 3.29Å; L83-L86 PolarHBondContact O-N 2.96Å; L83-L86 VanDerWaalsContact O-N 3.09Å; L83-V87 PolarHBondContact O-N 3.03Å |
| 84 | K | 96 | Very high | 93.3 | Very high | 74 Ų | 74 | 87.6 Ų | 87.6 | 32% | 0.322 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -58.2 | -44.8 | -173.4 | -79.2 | 175.9 | 166.2 | 167.2 | 0 | 112.4 | I74 D81 L86 V87 A88 | I74-K84 HydrophobicContact CG2-CG 3.87Å; D81-K84 HydrophobicContact CB-CD 4.42Å; D81-K84 WeakPolarHBondContact O-CB 3.27Å; D81-K84 WeakPolarHBondContact O-CG 3.16Å; D81-K84 PolarHBondContact O-N 3.25Å; D81-K84 WeakPolarHBondContact OD1-CE 3.48Å; D81-K84 IonicContact OD1-NZ 3.67Å; D81-K84 PolarHBondContact OD1-NZ 3.5Å; K84-L86 VanDerWaalsContact C-N 3.28Å; K84-L86 PolarHBondContact O-N 2.87Å; K84-V87 WeakPolarHBondContact O-CG2 3.43Å; K84-V87 PolarHBondContact O-N 3.19Å; K84-V87 VanDerWaalsContact O-N 3.15Å; K84-A88 PolarHBondContact O-N 3.4Å |
| 85 | D | 97 | Very high | 91.5 | Very high | 152 Ų | 152 | 89.6 Ų | 89.6 | 81% | 0.813 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -63.6 | -33.7 | 178.5 | -61.8 | -22.5 | 0 | 0 | 0 | 112.4 | L83 V87 | L83-D85 VanDerWaalsContact C-N 3.35Å; L83-D85 PolarHBondContact O-N 2.96Å; D85-V87 VanDerWaalsContact C-N 3.32Å; D85-V87 PolarHBondContact O-N 3.17Å |
| 86 | L | 96.6 | Very high | 89.4 | Confident | 138 Ų | 138 | 95.3 Ų | 95.3 | 72% | 0.723 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -69 | -28.9 | 177.4 | -175.7 | 63.9 | 0 | 0 | 0 | 112.7 | L83 K84 | L83-L86 HydrophobicContact CD2-CD2 4.45Å; L83-L86 WeakPolarHBondContact O-CB 3.29Å; L83-L86 PolarHBondContact O-N 2.96Å; L83-L86 VanDerWaalsContact O-N 3.09Å; K84-L86 VanDerWaalsContact C-N 3.28Å; K84-L86 PolarHBondContact O-N 2.87Å |
| 87 | V | 96.1 | Very high | 87.4 | Confident | 17 Ų | 17 | 91.7 Ų | 91.7 | 10% | 0.103 | 51% | 0.505 | C | S | . | . | H | α-helix | trans | -102.9 | -0.7 | 179.9 | -60.7 | 0 | 0 | 0 | 0 | 114.3 | K71 I74 L83 K84 D85 A89 V90 | K71-V87 HydrophobicContact CB-CB 4.27Å; K71-V87 HydrophobicContact CB-CG2 4.39Å; K71-V87 HydrophobicContact CG-CB 4.16Å; K71-V87 HydrophobicContact CG-CG2 3.96Å; I74-V87 HydrophobicContact CB-CG2 4.36Å; I74-V87 HydrophobicContact CD1-CG1 3.63Å; I74-V87 HydrophobicContact CD1-CG2 4.24Å; I74-V87 HydrophobicContact CG2-CG2 3.97Å; L83-V87 PolarHBondContact O-N 3.03Å; K84-V87 WeakPolarHBondContact O-CG2 3.43Å; K84-V87 PolarHBondContact O-N 3.19Å; K84-V87 VanDerWaalsContact O-N 3.15Å; D85-V87 VanDerWaalsContact C-N 3.32Å; D85-V87 PolarHBondContact O-N 3.17Å; V87-A89 PolarHBondContact O-N 2.78Å; V87-V90 HydrophobicContact CB-CG2 4.35Å; V87-V90 WeakPolarHBondContact O-CB 3.49Å; V87-V90 PolarHBondContact O-N 3.02Å |
| 88 | A | 94.7 | Very high | 85.4 | Confident | 68 Ų | 68 | 98.3 Ų | 98.3 | 56% | 0.562 | 54% | 0.536 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56 | -35.8 | -178.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | K84 V90 | K84-A88 PolarHBondContact O-N 3.4Å; A88-V90 VanDerWaalsContact C-N 3.33Å; A88-V90 PolarHBondContact O-N 2.95Å |
| 89 | A | 94.4 | Very high | 83.3 | Confident | 99 Ų | 99 | 97.5 Ų | 97.5 | 82% | 0.818 | 54% | 0.537 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.5 | -7.6 | 178.1 | 0 | 0 | 0 | 0 | 0 | 114.6 | V87 | V87-A89 PolarHBondContact O-N 2.78Š|
| 90 | V | 94.3 | Very high | 81.1 | Confident | 30 Ų | 30 | 97.6 Ų | 97.6 | 18% | 0.182 | 54% | 0.542 | C | S | . | . | S | Bend | trans | -76.9 | 130 | 179 | 177.9 | 0 | 0 | 0 | 0 | 109.2 | K71 V87 A88 | K71-V90 HydrophobicContact CB-CB 4.47Å; K71-V90 HydrophobicContact CB-CG1 4.31Å; K71-V90 HydrophobicContact CD-CB 4.17Å; K71-V90 HydrophobicContact CD-CG1 4.45Å; K71-V90 WeakPolarHBondContact CD-O 3.35Å; K71-V90 PolarHBondContact NZ-O 3.03Å; V87-V90 HydrophobicContact CB-CG2 4.35Å; V87-V90 WeakPolarHBondContact O-CB 3.49Å; V87-V90 PolarHBondContact O-N 3.02Å; A88-V90 VanDerWaalsContact C-N 3.33Å; A88-V90 PolarHBondContact O-N 2.95Å |
| 91 | P | 91 | Very high | 78.6 | Confident | 98 Ų | 98 | 106.5 Ų | 106.5 | 64% | 0.636 | 58% | 0.583 | S | S | * | * | P | Polyproline II helix | trans | -61.1 | 138.4 | 175.5 | -24.6 | 34.7 | 0 | 0 | 0 | 112.6 | S68 | S68-P91 PolarHBondContact OG-O 3.21Š|
| 92 | D | 86.9 | Confident | 76.1 | Confident | 100 Ų | 100 | 108 Ų | 108 | 54% | 0.535 | 61% | 0.605 | S | S | . | * | P | Polyproline II helix | trans | -62.4 | 151.6 | 173.3 | -60.2 | -48.6 | 0 | 0 | 0 | 111.4 | K71 Q94 | K71-D92 VanDerWaalsContact CE-OD1 3.26Å; K71-D92 WeakPolarHBondContact CE-OD1 3.45Å; K71-D92 IonicContact NZ-OD1 2.65Å; K71-D92 PolarHBondContact NZ-OD1 3.06Å; K71-D92 IonicContact NZ-OD2 2.68Å; D92-Q94 PolarHBondContact O-N 3.25Å |
| 93 | M | 81 | Confident | 73.4 | Confident | 64 Ų | 64 | 111 Ų | 111 | 32% | 0.315 | 62% | 0.621 | S | S | . | * | trans | -74.4 | 97.7 | -175.9 | -164 | -177.3 | 172.7 | 0 | 0 | 110.6 | R60 H69 G95 | R60-M93 HydrophobicContact CB-CE 3.86Å; R60-M93 HydrophobicContact CB-SD 4.48Å; R60-M93 HydrophobicContact CG-CE 3.91Å; R60-M93 HydrophobicContact CG-SD 3.89Å; H69-M93 PolarHBondContact CD2-SD 3.25Å; H69-M93 WeakPolarHBondContact NE2-CE 3.44Å; M93-G95 PolarHBondContact O-N 3.44Å; M93-G95 VanDerWaalsContact O-N 3.08Å | ||
| 94 | Q | 68.6 | Low | 70.5 | Confident | 199 Ų | 199 | 113.6 Ų | 113.6 | 93% | 0.93 | 65% | 0.653 | S | S | * | * | trans | -72.2 | 99.5 | 177 | -68.3 | -178.1 | -15.6 | 0 | 0 | 111.1 | D92 | D92-Q94 PolarHBondContact O-N 3.25Š| ||
| 95 | G | 58.8 | Low | 67.6 | Low | 49 Ų | 49 | 113 Ų | 113 | 51% | 0.505 | 67% | 0.669 | S | S | . | * | S | Bend | trans | 172.6 | 136.4 | 175 | 0 | 0 | 0 | 0 | 0 | 112 | R60 M93 | R60-G95 PolarHBondContact NH1-O 3.15Å; M93-G95 PolarHBondContact O-N 3.44Å; M93-G95 VanDerWaalsContact O-N 3.08Å |
| 96 | E | 49.8 | Very low | 65.2 | Low | 202 Ų | 202 | 114.7 Ų | 114.7 | 94% | 0.944 | 67% | 0.672 | S | S | * | * | S | Bend | trans | -48.3 | 140.6 | -164.3 | -66.5 | -179.4 | 127.9 | 0 | 0 | 115.5 | R60 | R60-E96 PolarHBondContact NH1-O 3.08Š|
| 97 | G | 54 | Low | 62.6 | Low | 42 Ų | 42 | 117 Ų | 117 | 43% | 0.433 | 68% | 0.676 | S | S | . | * | trans | 136.8 | 49.1 | -179 | 0 | 0 | 0 | 0 | 0 | 111.4 | R60 | R60-G97 PolarHBondContact NH2-O 3.43Š| ||
| 98 | E | 53.8 | Low | 59.9 | Low | 196 Ų | 196 | 121.9 Ų | 121.9 | 92% | 0.916 | 71% | 0.705 | S | S | * | * | trans | -68.3 | 111.7 | 146.2 | -81.9 | 171.9 | 77.1 | 0 | 0 | 106.4 | ||||
| 99 | D | 50.9 | Low | 57.5 | Low | 145 Ų | 145 | 123.2 Ų | 123.2 | 78% | 0.775 | 72% | 0.716 | S | S | * | * | trans | -153.6 | 119.6 | 166.8 | -108.5 | -41.6 | 0 | 0 | 0 | 110.1 | ||||
| 100 | N | 50 | Low | 55.4 | Low | 143 Ų | 143 | 130 Ų | 130 | 77% | 0.765 | 72% | 0.721 | S | S | * | * | S | Bend | trans | 79.8 | 76.7 | 172.2 | -53.3 | -83.5 | 0 | 0 | 0 | 118.5 | ||
| 101 | H | 46 | Very low | 53.2 | Low | 193 Ų | 193 | 140.8 Ų | 140.8 | 89% | 0.894 | 76% | 0.758 | S | S | * | * | S | Bend | -158.5 | 145.3 | 112 | -120.9 | -122.4 | 0 | 0 | 0 | 112.3 | |||
| 102 | A | 44 | Very low | 50.7 | Low | 97 Ų | 97 | 140 Ų | 140 | 80% | 0.802 | 77% | 0.769 | S | S | * | * | trans | 73.2 | 88.2 | 170.6 | 0 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 103 | E | 40.4 | Very low | 48.8 | Very low | 201 Ų | 201 | 146.7 Ų | 146.7 | 94% | 0.939 | 79% | 0.786 | S | S | * | * | trans | 10.1 | 133.8 | 135.7 | -162.1 | -169.7 | 157.8 | 0 | 0 | 121.8 | ||||
| 104 | G | 37.3 | Very low | 47.2 | Very low | 78 Ų | 78 | 152.3 Ų | 152.3 | 80% | 0.804 | 81% | 0.809 | S | S | * | * | trans | 116 | 96.5 | 137 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 105 | G | 34.2 | Very low | 46.3 | Very low | 63 Ų | 63 | 148.9 Ų | 148.9 | 65% | 0.649 | 80% | 0.804 | S | S | * | * | trans | 173.2 | 56.9 | 174.8 | 0 | 0 | 0 | 0 | 0 | 118.6 | K107 | G105-K107 PolarHBondContact O-N 3.36Š| ||
| 106 | E | 46.3 | Very low | 45.4 | Very low | 187 Ų | 187 | 149.9 Ų | 149.9 | 87% | 0.874 | 81% | 0.814 | S | S | * | * | trans | -49.6 | 120.5 | 176.5 | -172.8 | -174.2 | 129.7 | 0 | 0 | 114.3 | ||||
| 107 | K | 41.2 | Very low | 44.9 | Very low | 187 Ų | 187 | 146.2 Ų | 146.2 | 81% | 0.813 | 81% | 0.811 | S | S | * | * | trans | -156.9 | 98.5 | 155.6 | 17.1 | -125.3 | 170.3 | -174.2 | 0 | 115.7 | G105 | G105-K107 PolarHBondContact O-N 3.36Š| ||
| 108 | V | 39.8 | Very low | 44.1 | Very low | 119 Ų | 119 | 147.3 Ų | 147.3 | 72% | 0.721 | 82% | 0.822 | S | S | * | * | trans | 47.4 | 107 | 133.2 | -172 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 109 | A | 44.9 | Very low | 43.7 | Very low | 96 Ų | 96 | 149.8 Ų | 149.8 | 79% | 0.793 | 82% | 0.823 | S | S | * | * | trans | -61 | 140.1 | 162.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 110 | R | 51.2 | Low | 43.2 | Very low | 241 Ų | 241 | 150.7 Ų | 150.7 | 91% | 0.909 | 82% | 0.82 | S | S | * | * | trans | -122.8 | 117.2 | 160.8 | -74.8 | -165.5 | 172.2 | -168 | -0.8 | 111.8 | ||||
| 111 | R | 46.1 | Very low | 42.5 | Very low | 256 Ų | 256 | 151 Ų | 151 | 97% | 0.966 | 82% | 0.822 | S | S | * | * | trans | -72.8 | 137.1 | 174.3 | -66.5 | 170.7 | 167 | 176.3 | -5.2 | 110.5 | ||||
| 112 | G | 39 | Very low | 41.9 | Very low | 83 Ų | 83 | 145.4 Ų | 145.4 | 86% | 0.856 | 82% | 0.816 | S | S | * | * | trans | -145.3 | 139.9 | 174.7 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 113 | R | 46.8 | Very low | 41.4 | Very low | 239 Ų | 239 | 144.4 Ų | 144.4 | 90% | 0.902 | 82% | 0.815 | S | S | * | * | trans | -143 | 142.8 | -156.4 | -174.4 | -178 | -165 | -149.4 | 9.1 | 108.7 | ||||
| 114 | K | 48 | Very low | 41.5 | Very low | 182 Ų | 182 | 141.9 Ų | 141.9 | 79% | 0.791 | 81% | 0.813 | S | S | * | * | cis | -148.8 | 171.4 | 26.5 | -138 | -165 | 169.2 | -175.2 | 0 | 108.4 | ||||
| 115 | P | 49.7 | Very low | 41.6 | Very low | 127 Ų | 127 | 141.8 Ų | 141.8 | 83% | 0.825 | 81% | 0.812 | S | S | * | * | trans | -88.4 | 161.8 | 179.1 | 36.3 | -29.8 | 0 | 0 | 0 | 113.7 | ||||
| 116 | G | 39.8 | Very low | 42.2 | Very low | 71 Ų | 71 | 144.9 Ų | 144.9 | 73% | 0.732 | 82% | 0.823 | S | S | * | * | trans | -152.3 | 128.5 | 163.3 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 117 | S | 39.2 | Very low | 42 | Very low | 125 Ų | 125 | 145.9 Ų | 145.9 | 87% | 0.874 | 82% | 0.824 | S | S | * | * | 96.9 | 83.1 | 56.3 | 178.8 | 0 | 0 | 0 | 0 | 113.2 | |||||
| 118 | G | 36.8 | Very low | 42 | Very low | 65 Ų | 65 | 140.8 Ų | 140.8 | 67% | 0.67 | 83% | 0.825 | S | S | * | * | 104.5 | 136.8 | 127.4 | 0 | 0 | 0 | 0 | 0 | 120 | |||||
| 119 | R | 45.5 | Very low | 42.5 | Very low | 248 Ų | 248 | 144.3 Ų | 144.3 | 94% | 0.936 | 83% | 0.83 | S | S | * | * | trans | 75.5 | 152.8 | 152.8 | -59.2 | 173.8 | 171.5 | -173.1 | -3.3 | 117 | ||||
| 120 | K | 40.6 | Very low | 42.6 | Very low | 163 Ų | 163 | 145.7 Ų | 145.7 | 71% | 0.709 | 83% | 0.825 | S | S | * | * | cis | -176.7 | 133.9 | -21.9 | 168.1 | -179.3 | 175 | -174.8 | 0 | 107.9 | ||||
| 121 | N | 35.5 | Very low | 42.3 | Very low | 150 Ų | 150 | 142.3 Ų | 142.3 | 80% | 0.802 | 82% | 0.816 | S | S | * | * | trans | 57.1 | 150.5 | 166.2 | -62.6 | 11.1 | 0 | 0 | 0 | 116.6 | ||||
| 122 | G | 34.2 | Very low | 42 | Very low | 75 Ų | 75 | 138.8 Ų | 138.8 | 77% | 0.773 | 81% | 0.808 | S | S | * | * | cis | 148.7 | 142.9 | 11.1 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 123 | G | 32.8 | Very low | 42.5 | Very low | 76 Ų | 76 | 142.4 Ų | 142.4 | 78% | 0.784 | 81% | 0.807 | S | S | * | * | trans | 77.3 | 160.4 | 176.6 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 124 | V | 42.6 | Very low | 42.2 | Very low | 148 Ų | 148 | 136.9 Ų | 136.9 | 90% | 0.897 | 81% | 0.805 | S | S | * | * | cis | -142.4 | 145.9 | -1.6 | -177.5 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 125 | G | 39.9 | Very low | 42 | Very low | 76 Ų | 76 | 131.4 Ų | 131.4 | 78% | 0.784 | 80% | 0.8 | S | S | * | * | trans | -76 | 157.3 | -177.9 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 126 | C | 46.5 | Very low | 41.8 | Very low | 128 Ų | 128 | 131.5 Ų | 131.5 | 87% | 0.865 | 80% | 0.799 | S | S | * | * | trans | -121.5 | 120.6 | 160.1 | -170.2 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 127 | K | 42.4 | Very low | 42.1 | Very low | 208 Ų | 208 | 136.2 Ų | 136.2 | 90% | 0.904 | 80% | 0.802 | S | S | * | * | trans | -86.7 | 111.7 | 166.6 | -85.9 | 175.3 | 171.7 | 170.9 | 0 | 108.2 | ||||
| 128 | G | 41.4 | Very low | 42.4 | Very low | 80 Ų | 80 | 135.9 Ų | 135.9 | 83% | 0.825 | 80% | 0.799 | S | S | * | * | trans | -104.9 | 94.9 | 162.3 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 129 | K | 50.1 | Low | 43.1 | Very low | 193 Ų | 193 | 141.4 Ų | 141.4 | 84% | 0.839 | 81% | 0.807 | S | S | * | * | trans | -97.8 | 127.4 | 160 | -84.2 | -171.6 | 173.9 | -172.1 | 0 | 107 | ||||
| 130 | D | 46.6 | Very low | 43.1 | Very low | 126 Ų | 126 | 138.3 Ų | 138.3 | 67% | 0.674 | 80% | 0.804 | S | S | * | * | trans | 167.3 | 149.5 | 146 | -88.7 | -7.7 | 0 | 0 | 0 | 108.1 | ||||
| 131 | K | 45.4 | Very low | 43.2 | Very low | 170 Ų | 170 | 139.3 Ų | 139.3 | 74% | 0.739 | 81% | 0.811 | S | S | * | * | cis | 177.7 | 148.4 | -19.5 | -115.5 | -178.6 | -154.7 | 112 | 0 | 103.8 | ||||
| 132 | K | 40.2 | Very low | 43.4 | Very low | 182 Ų | 182 | 139.4 Ų | 139.4 | 79% | 0.791 | 81% | 0.811 | S | S | * | * | trans | 81.4 | 105.5 | 147.3 | -146.2 | 179.6 | -174.8 | -163.9 | 0 | 120 | ||||
| 133 | L | 47.9 | Very low | 43.9 | Very low | 158 Ų | 158 | 142.2 Ų | 142.2 | 83% | 0.827 | 81% | 0.808 | S | S | * | * | 38.7 | 121.1 | 128.7 | -44 | 171.6 | 0 | 0 | 0 | 119.7 | |||||
| 134 | S | 41.9 | Very low | 44.5 | Very low | 124 Ų | 124 | 142.9 Ų | 142.9 | 87% | 0.867 | 80% | 0.801 | S | S | * | * | trans | -139.5 | 107 | 132.7 | 59.1 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 135 | G | 42.3 | Very low | 44.5 | Very low | 66 Ų | 66 | 144.9 Ų | 144.9 | 68% | 0.68 | 80% | 0.801 | S | S | * | * | trans | -93.4 | 143.4 | 162.5 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 136 | T | 46.1 | Very low | 44.6 | Very low | 130 Ų | 130 | 147.4 Ų | 147.4 | 80% | 0.798 | 80% | 0.796 | S | S | * | * | trans | -143.9 | 94.3 | 157 | 40 | 0 | 0 | 0 | 0 | 106.2 | ||||
| 137 | E | 45.7 | Very low | 44.6 | Very low | 170 Ų | 170 | 146 Ų | 146 | 79% | 0.794 | 79% | 0.788 | S | S | * | * | trans | -55 | 146.6 | 150.3 | 58.1 | -123.2 | 74.3 | 0 | 0 | 109.8 | ||||
| 138 | S | 46.7 | Very low | 44.8 | Very low | 117 Ų | 117 | 143.7 Ų | 143.7 | 82% | 0.818 | 78% | 0.78 | S | S | * | * | trans | -150.3 | 98 | 168.1 | -69.3 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 139 | E | 51.6 | Low | 45 | Very low | 181 Ų | 181 | 145.4 Ų | 145.4 | 85% | 0.846 | 78% | 0.775 | S | S | * | * | trans | -90 | 129.2 | 169.3 | -58.8 | 178 | 135.5 | 0 | 0 | 107.9 | ||||
| 140 | Q | 45.3 | Very low | 44.8 | Very low | 184 Ų | 184 | 143.5 Ų | 143.5 | 86% | 0.86 | 77% | 0.774 | S | S | * | * | trans | -175.8 | 105.5 | 158.9 | -107.5 | 169.8 | -18.9 | 0 | 0 | 104.3 | ||||
| 141 | E | 42.3 | Very low | 44.9 | Very low | 184 Ų | 184 | 146 Ų | 146 | 86% | 0.86 | 78% | 0.782 | S | S | * | * | 66.9 | 129.8 | 61.9 | -62.6 | -160.8 | 164.9 | 0 | 0 | 114.2 | |||||
| 142 | D | 38.8 | Very low | 44.8 | Very low | 151 Ų | 151 | 145.3 Ų | 145.3 | 81% | 0.807 | 79% | 0.786 | S | S | * | * | trans | 94.9 | 152.9 | 159.4 | -116.1 | -31.7 | 0 | 0 | 0 | 123 | ||||
| 143 | D | 44.5 | Very low | 45 | Very low | 134 Ų | 134 | 146.2 Ų | 146.2 | 72% | 0.717 | 79% | 0.793 | S | S | * | * | trans | 75.5 | 88.5 | 174 | -91.6 | -61.4 | 0 | 0 | 0 | 121.4 | ||||
| 144 | S | 45.8 | Very low | 44.8 | Very low | 90 Ų | 90 | 148.1 Ų | 148.1 | 63% | 0.629 | 80% | 0.798 | S | S | * | * | trans | -30.4 | 133.1 | 135.5 | 41.7 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 145 | E | 44.2 | Very low | 44.5 | Very low | 191 Ų | 191 | 149.9 Ų | 149.9 | 89% | 0.893 | 80% | 0.798 | S | S | * | * | trans | -129.5 | 109.4 | 139.6 | -72.5 | -168.2 | 169.8 | 0 | 0 | 108.9 | ||||
| 146 | D | 41.2 | Very low | 44.1 | Very low | 128 Ų | 128 | 149.4 Ų | 149.4 | 68% | 0.684 | 79% | 0.792 | S | S | * | * | trans | -80.6 | 134.2 | 173 | -171.5 | 23.4 | 0 | 0 | 0 | 108.8 | ||||
| 147 | S | 45.9 | Very low | 43.8 | Very low | 100 Ų | 100 | 149.1 Ų | 149.1 | 70% | 0.699 | 80% | 0.796 | S | S | * | * | trans | -125 | 79.1 | 179.4 | -74.5 | 0 | 0 | 0 | 0 | 109.1 | T149 | S147-T149 PolarHBondContact O-N 3.12Å; S147-T149 VanDerWaalsContact O-N 3.08Å | ||
| 148 | E | 47.8 | Very low | 43.7 | Very low | 158 Ų | 158 | 150 Ų | 150 | 74% | 0.738 | 80% | 0.8 | S | S | * | * | trans | -61.9 | 102.2 | 164.4 | -63.7 | -74.3 | -156 | 0 | 0 | 108.6 | ||||
| 149 | T | 43.9 | Very low | 43.1 | Very low | 117 Ų | 117 | 149.8 Ų | 149.8 | 72% | 0.718 | 80% | 0.798 | S | S | * | * | trans | -92.8 | 97.4 | 162.1 | 51 | 0 | 0 | 0 | 0 | 108.3 | S147 E151 | S147-T149 PolarHBondContact O-N 3.12Å; S147-T149 VanDerWaalsContact O-N 3.08Å; T149-E151 PolarHBondContact O-N 3.3Å | ||
| 150 | D | 47 | Very low | 42.7 | Very low | 152 Ų | 152 | 146.2 Ų | 146.2 | 81% | 0.813 | 79% | 0.793 | S | S | * | * | trans | -52.3 | 122 | 156.8 | -91.4 | -59 | 0 | 0 | 0 | 108.9 | ||||
| 151 | E | 47.7 | Very low | 42.2 | Very low | 179 Ų | 179 | 143.5 Ų | 143.5 | 84% | 0.836 | 79% | 0.789 | S | S | * | * | trans | -121.9 | 111 | 158.2 | -75.7 | -171.2 | 164.1 | 0 | 0 | 106 | T149 | T149-E151 PolarHBondContact O-N 3.3Š| ||
| 152 | D | 45.1 | Very low | 41.9 | Very low | 155 Ų | 155 | 141.1 Ų | 141.1 | 83% | 0.829 | 78% | 0.782 | S | S | * | * | trans | -55.2 | 145.2 | -175.5 | -61.3 | -92.3 | 0 | 0 | 0 | 113.3 | ||||
| 153 | E | 43.4 | Very low | 41.9 | Very low | 202 Ų | 202 | 141.8 Ų | 141.8 | 94% | 0.944 | 79% | 0.785 | S | S | * | * | trans | -78 | 133.4 | 167.7 | -61.9 | -153.8 | 154.4 | 0 | 0 | 110.6 | ||||
| 154 | E | 43.5 | Very low | 41.8 | Very low | 198 Ų | 198 | 142.2 Ų | 142.2 | 93% | 0.925 | 78% | 0.783 | S | S | * | * | trans | -112.6 | 143.7 | 161.1 | -147.3 | -171 | -171.4 | 0 | 0 | 111.4 | ||||
| 155 | D | 36.2 | Very low | 41.5 | Very low | 161 Ų | 161 | 144.3 Ų | 144.3 | 86% | 0.861 | 79% | 0.794 | S | S | * | * | trans | -85.4 | 161.6 | -164.8 | 175.7 | 42.6 | 0 | 0 | 0 | 114.4 | ||||
| 156 | G | 33.7 | Very low | 41.2 | Very low | 55 Ų | 55 | 143 Ų | 143 | 57% | 0.567 | 79% | 0.788 | S | S | * | * | trans | 85.6 | 140.1 | 160.1 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 157 | S | 40.4 | Very low | 41 | Very low | 124 Ų | 124 | 142.6 Ų | 142.6 | 87% | 0.867 | 80% | 0.795 | S | S | * | * | cis | -151.2 | 138.1 | -1.6 | -78.4 | 0 | 0 | 0 | 0 | 110.1 | S159 | S157-S159 PolarHBondContact O-N 3.23Š| ||
| 158 | Q | 42.5 | Very low | 40.4 | Very low | 190 Ų | 190 | 148.6 Ų | 148.6 | 89% | 0.888 | 80% | 0.803 | S | S | * | * | trans | -86.9 | 107.3 | 172.7 | -64.5 | -174.7 | -8.3 | 0 | 0 | 110.7 | S160 | Q158-S160 PolarHBondContact O-N 3.46Š| ||
| 159 | S | 33.9 | Very low | 40.1 | Very low | 112 Ų | 112 | 149.3 Ų | 149.3 | 78% | 0.783 | 80% | 0.803 | S | S | * | * | trans | -87.1 | 101.8 | 169.7 | -170.3 | 0 | 0 | 0 | 0 | 110.9 | S157 | S157-S159 PolarHBondContact O-N 3.23Š| ||
| 160 | S | 43.6 | Very low | 39.8 | Very low | 106 Ų | 106 | 152 Ų | 152 | 74% | 0.741 | 81% | 0.808 | S | S | * | * | trans | -99 | 115.4 | 169.2 | -69.4 | 0 | 0 | 0 | 0 | 110.1 | Q158 | Q158-S160 PolarHBondContact O-N 3.46Š| ||
| 161 | T | 35.7 | Very low | 39.4 | Very low | 126 Ų | 126 | 150.3 Ų | 150.3 | 77% | 0.773 | 81% | 0.808 | S | S | * | * | trans | -121.8 | 85.4 | 165.9 | 57 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 162 | N | 35.2 | Very low | 39.9 | Very low | 134 Ų | 134 | 147.1 Ų | 147.1 | 72% | 0.717 | 80% | 0.803 | S | S | * | * | trans | -78.6 | 119.2 | 166.6 | 172 | 16.3 | 0 | 0 | 0 | 109.2 | ||||
| 163 | L | 39.6 | Very low | 39.4 | Very low | 165 Ų | 165 | 146.4 Ų | 146.4 | 86% | 0.864 | 80% | 0.799 | S | S | * | * | trans | -135.4 | 112 | 163.1 | -71.9 | 178.3 | 0 | 0 | 0 | 110 | ||||
| 164 | Q | 41.7 | Very low | 39.2 | Very low | 144 Ų | 144 | 142.1 Ų | 142.1 | 67% | 0.673 | 79% | 0.787 | S | S | * | * | trans | -72.7 | 164 | 164.1 | -75.8 | 176.7 | -32.1 | 0 | 0 | 110.8 | ||||
| 165 | P | 38.3 | Very low | 39.2 | Very low | 133 Ų | 133 | 141.2 Ų | 141.2 | 86% | 0.864 | 79% | 0.785 | S | S | * | * | -131.3 | 156 | 110 | 35.4 | -27.9 | 0 | 0 | 0 | 114.1 | |||||
| 166 | Q | 38.3 | Very low | 39.9 | Very low | 164 Ų | 164 | 138.9 Ų | 138.9 | 77% | 0.766 | 78% | 0.778 | S | S | * | * | trans | -101.5 | 140.8 | 179.7 | -63.7 | -178.9 | -21.8 | 0 | 0 | 112.9 | ||||
| 167 | S | 37.1 | Very low | 41.1 | Very low | 119 Ų | 119 | 141.3 Ų | 141.3 | 83% | 0.832 | 78% | 0.784 | S | S | * | * | trans | -167.4 | 100.7 | 147 | 48.5 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 168 | R | 34.8 | Very low | 41.1 | Very low | 227 Ų | 227 | 144.6 Ų | 144.6 | 86% | 0.857 | 79% | 0.786 | S | S | * | * | 84.8 | 96.6 | 79.6 | -175.7 | -178.1 | -93.7 | -126.5 | 0.2 | 114.1 | |||||
| 169 | F | 41.4 | Very low | 41 | Very low | 172 Ų | 172 | 146.2 Ų | 146.2 | 75% | 0.754 | 79% | 0.785 | S | S | * | * | trans | 55 | 130.9 | 150.1 | -72.5 | -116.3 | 0 | 0 | 0 | 118.8 | ||||
| 170 | H | 36.2 | Very low | 41.2 | Very low | 174 Ų | 174 | 148.4 Ų | 148.4 | 81% | 0.806 | 79% | 0.787 | S | S | * | * | -166.4 | 163 | 56.2 | -71.9 | 86.4 | 0 | 0 | 0 | 111.6 | |||||
| 171 | S | 38.2 | Very low | 41.1 | Very low | 117 Ų | 117 | 151.6 Ų | 151.6 | 82% | 0.818 | 79% | 0.79 | S | S | * | * | trans | -108 | 179.2 | 165.3 | -51.6 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 172 | P | 58.9 | Low | 41.6 | Very low | 112 Ų | 112 | 154 Ų | 154 | 73% | 0.727 | 79% | 0.794 | S | S | * | * | cis | -140.2 | -171.9 | 5.6 | 38.9 | -17 | 0 | 0 | 0 | 116.7 | ||||
| 173 | D | 34.8 | Very low | 41.7 | Very low | 139 Ų | 139 | 150.4 Ų | 150.4 | 74% | 0.743 | 79% | 0.79 | S | S | * | * | 119.4 | 142.5 | 129.7 | -119.4 | -47.9 | 0 | 0 | 0 | 122.6 | |||||
| 174 | T | 38.3 | Very low | 41.7 | Very low | 113 Ų | 113 | 149.3 Ų | 149.3 | 69% | 0.693 | 79% | 0.79 | S | S | * | * | trans | 68.7 | 103.6 | 156 | 27.9 | 0 | 0 | 0 | 0 | 124.5 | ||||
| 175 | M | 44.9 | Very low | 41.6 | Very low | 179 Ų | 179 | 146.7 Ų | 146.7 | 88% | 0.882 | 79% | 0.793 | S | S | * | * | 83.5 | 157.2 | 123.1 | -84.5 | -146.1 | 168.1 | 0 | 0 | 123 | |||||
| 176 | P | 50.8 | Low | 41.7 | Very low | 111 Ų | 111 | 149.8 Ų | 149.8 | 72% | 0.721 | 80% | 0.796 | S | S | * | * | trans | -129.7 | -146.6 | -130.6 | 51.3 | -34.4 | 0 | 0 | 0 | 114.1 | ||||
| 177 | P | 58.7 | Low | 41.5 | Very low | 107 Ų | 107 | 146 Ų | 146 | 70% | 0.695 | 80% | 0.8 | S | S | * | * | trans | -99.4 | 165.1 | -137.7 | 40.6 | -26.4 | 0 | 0 | 0 | 115.4 | ||||
| 178 | Q | 39.6 | Very low | 41.4 | Very low | 193 Ų | 193 | 144.2 Ų | 144.2 | 90% | 0.902 | 80% | 0.801 | S | S | * | * | trans | -133.9 | 136.7 | 162.8 | -68.4 | -69.4 | -82.4 | 0 | 0 | 110.5 | ||||
| 179 | Y | 40.1 | Very low | 41.8 | Very low | 224 Ų | 224 | 141.9 Ų | 141.9 | 88% | 0.878 | 81% | 0.805 | S | S | * | * | trans | -95.6 | -177.9 | 176.1 | -128.6 | -100.5 | 0 | 0 | 0 | 110.1 | ||||
| 180 | L | 39.3 | Very low | 42 | Very low | 158 Ų | 158 | 140.4 Ų | 140.4 | 83% | 0.827 | 81% | 0.81 | S | S | * | * | trans | 89.3 | 144.4 | 175.1 | -58 | 170 | 0 | 0 | 0 | 114.9 | ||||
| 181 | H | 41.5 | Very low | 42.7 | Very low | 172 Ų | 172 | 140 Ų | 140 | 80% | 0.796 | 81% | 0.81 | S | S | * | * | cis | -159 | 171.4 | -14.2 | -177 | 80.6 | 0 | 0 | 0 | 108.7 | ||||
| 182 | M | 45.5 | Very low | 43.4 | Very low | 176 Ų | 176 | 140.2 Ų | 140.2 | 87% | 0.867 | 81% | 0.809 | S | S | * | * | trans | -74.6 | 154.7 | -178.3 | -58 | -161.9 | 82.9 | 0 | 0 | 114.5 | ||||
| 183 | G | 37.8 | Very low | 42.9 | Very low | 60 Ų | 60 | 142.8 Ų | 142.8 | 62% | 0.619 | 82% | 0.816 | S | S | * | * | trans | -176.7 | 99.3 | 164.4 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 184 | T | 38.9 | Very low | 43.3 | Very low | 141 Ų | 141 | 139.9 Ų | 139.9 | 87% | 0.865 | 82% | 0.818 | S | S | * | * | 75.8 | 115.8 | 86.3 | 60.6 | 0 | 0 | 0 | 0 | 116.2 | |||||
| 185 | A | 40.2 | Very low | 43.7 | Very low | 89 Ų | 89 | 140.2 Ų | 140.2 | 74% | 0.736 | 83% | 0.825 | S | S | * | * | trans | 80.5 | 119.5 | 140.1 | 0 | 0 | 0 | 0 | 0 | 122.2 | ||||
| 186 | Q | 39.8 | Very low | 43.8 | Very low | 198 Ų | 198 | 141 Ų | 141 | 93% | 0.925 | 82% | 0.824 | S | S | * | * | trans | 68.2 | 125 | 133.4 | -66.1 | -176.2 | 2.6 | 0 | 0 | 122.5 | ||||
| 187 | G | 35 | Very low | 43.9 | Very low | 84 Ų | 84 | 139.7 Ų | 139.7 | 87% | 0.866 | 82% | 0.822 | S | S | * | * | 114.2 | 141.2 | 126.7 | 0 | 0 | 0 | 0 | 0 | 117.2 | |||||
| 188 | G | 34.9 | Very low | 43.6 | Very low | 82 Ų | 82 | 139.9 Ų | 139.9 | 85% | 0.845 | 82% | 0.824 | S | S | * | * | trans | 118.2 | 90.4 | 155.5 | 0 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 189 | L | 41.9 | Very low | 44.2 | Very low | 178 Ų | 178 | 139.4 Ų | 139.4 | 93% | 0.932 | 82% | 0.821 | S | S | * | * | trans | -44.6 | 141.6 | 161.3 | -55.5 | 159.3 | 0 | 0 | 0 | 114 | ||||
| 190 | V | 46.9 | Very low | 44.8 | Very low | 142 Ų | 142 | 134 Ų | 134 | 86% | 0.861 | 81% | 0.813 | S | S | * | * | 174.7 | 142.4 | 121.6 | 64.8 | 0 | 0 | 0 | 0 | 111.9 | |||||
| 191 | M | 51.5 | Low | 45.3 | Very low | 164 Ų | 164 | 131.5 Ų | 131.5 | 81% | 0.808 | 81% | 0.809 | S | S | * | * | trans | -80.8 | 167.2 | 174.9 | -59.8 | -71.1 | -175.9 | 0 | 0 | 111.4 | ||||
| 192 | P | 51.9 | Low | 45.9 | Very low | 123 Ų | 123 | 131.4 Ų | 131.4 | 80% | 0.799 | 81% | 0.813 | S | S | * | * | -140.5 | 167.1 | 99.4 | 34.1 | -18.9 | 0 | 0 | 0 | 114.9 | |||||
| 193 | L | 49.2 | Very low | 46.4 | Very low | 166 Ų | 166 | 131.3 Ų | 131.3 | 87% | 0.869 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -66.9 | 131 | -171.3 | -67 | 75.1 | 0 | 0 | 0 | 112.7 | ||
| 194 | G | 42.6 | Very low | 47.3 | Very low | 77 Ų | 77 | 132.1 Ų | 132.1 | 79% | 0.794 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -88.7 | 117.8 | 161.1 | 0 | 0 | 0 | 0 | 0 | 110.7 | F196 | G194-F196 PolarHBondContact O-N 3.46Š|
| 195 | S | 46.7 | Very low | 47.9 | Very low | 120 Ų | 120 | 132 Ų | 132 | 84% | 0.839 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -62.6 | 124.7 | 177.7 | -70.5 | 0 | 0 | 0 | 0 | 112.4 | A197 | S195-A197 PolarHBondContact O-N 3.26Š|
| 196 | F | 47.6 | Very low | 48.9 | Very low | 196 Ų | 196 | 132.1 Ų | 132.1 | 86% | 0.86 | 82% | 0.822 | S | S | * | * | trans | -77.3 | 101.2 | 165.8 | -171.7 | -95.4 | 0 | 0 | 0 | 109.2 | G194 | G194-F196 PolarHBondContact O-N 3.46Š| ||
| 197 | A | 52.2 | Low | 50.1 | Low | 83 Ų | 83 | 128.1 Ų | 128.1 | 69% | 0.686 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -86.8 | 124.1 | 172.9 | 0 | 0 | 0 | 0 | 0 | 109.9 | S195 H199 | S195-A197 PolarHBondContact O-N 3.26Å; A197-H199 PolarHBondContact O-N 3.37Å |
| 198 | P | 53.1 | Low | 51.9 | Low | 111 Ų | 111 | 129.6 Ų | 129.6 | 72% | 0.721 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -74 | 125.9 | 176.9 | 29.5 | -32.8 | 0 | 0 | 0 | 110.5 | ||
| 199 | H | 51.5 | Low | 53.8 | Low | 184 Ų | 184 | 131.2 Ų | 131.2 | 85% | 0.852 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -70.2 | 136 | 172.8 | -127.6 | -116.9 | 0 | 0 | 0 | 110 | A197 S201 | A197-H199 PolarHBondContact O-N 3.37Å; H199-S201 PolarHBondContact O-N 3.46Å |
| 200 | P | 52.5 | Low | 55.2 | Low | 109 Ų | 109 | 128 Ų | 128 | 71% | 0.708 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -70.1 | 131 | 178.8 | 27.8 | -33.2 | 0 | 0 | 0 | 111 | L202 | P200-L202 PolarHBondContact O-N 3.3Š|
| 201 | S | 49.5 | Very low | 56.3 | Low | 107 Ų | 107 | 127.2 Ų | 127.2 | 75% | 0.748 | 79% | 0.79 | S | S | * | * | trans | -70.1 | 110.1 | 176.1 | -169.9 | 0 | 0 | 0 | 0 | 110.2 | H199 M203 | H199-S201 PolarHBondContact O-N 3.46Å; S201-M203 PolarHBondContact O-N 3.36Å | ||
| 202 | L | 55.2 | Low | 56.7 | Low | 169 Ų | 169 | 125 Ų | 125 | 89% | 0.885 | 79% | 0.791 | S | S | * | * | trans | -81.4 | 106.7 | 170.2 | -84 | 173.9 | 0 | 0 | 0 | 109.9 | P200 | P200-L202 PolarHBondContact O-N 3.3Š| ||
| 203 | M | 56.3 | Low | 57.1 | Low | 174 Ų | 174 | 127.5 Ų | 127.5 | 86% | 0.857 | 80% | 0.795 | S | S | * | * | trans | -45 | 137.8 | 176 | -48.1 | -161 | 173.5 | 0 | 0 | 111.9 | S201 | S201-M203 PolarHBondContact O-N 3.36Š| ||
| 204 | G | 56.1 | Low | 57.7 | Low | 78 Ų | 78 | 125.3 Ų | 125.3 | 80% | 0.804 | 79% | 0.79 | S | S | * | * | trans | -69.5 | 151.7 | -163.2 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 205 | T | 52.3 | Low | 58.4 | Low | 138 Ų | 138 | 129.8 Ų | 129.8 | 85% | 0.847 | 79% | 0.79 | S | S | * | * | trans | -113.2 | 126 | 154.5 | 51.4 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 206 | A | 60 | Low | 58.7 | Low | 91 Ų | 91 | 133.4 Ų | 133.4 | 75% | 0.752 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -69.7 | 144.5 | 173.3 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||
| 207 | P | 66.1 | Low | 58.9 | Low | 115 Ų | 115 | 130.5 Ų | 130.5 | 75% | 0.747 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -63 | 144.5 | 170.8 | 27.9 | -33.8 | 0 | 0 | 0 | 110 | ||
| 208 | P | 72.5 | Confident | 58.9 | Low | 115 Ų | 115 | 135.4 Ų | 135.4 | 75% | 0.747 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -64.7 | 150.1 | 177.1 | 28.3 | -34.7 | 0 | 0 | 0 | 111 | ||
| 209 | P | 73.5 | Confident | 58.9 | Low | 116 Ų | 116 | 137.2 Ų | 137.2 | 75% | 0.753 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -64.6 | 152 | 175.3 | 28.8 | -35 | 0 | 0 | 0 | 111.3 | ||
| 210 | P | 72.4 | Confident | 59.1 | Low | 111 Ų | 111 | 135 Ų | 135 | 72% | 0.721 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 152.1 | 174 | 28.8 | -35.1 | 0 | 0 | 0 | 111 | S212 | P210-S212 PolarHBondContact O-N 3.47Š|
| 211 | P | 69.3 | Low | 59.3 | Low | 124 Ų | 124 | 137.7 Ų | 137.7 | 81% | 0.805 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 135.3 | 176.3 | 27.2 | -34.2 | 0 | 0 | 0 | 110.7 | M213 | P211-M213 PolarHBondContact O-N 3.1Š|
| 212 | S | 60.7 | Low | 59.7 | Low | 118 Ų | 118 | 139.3 Ų | 139.3 | 83% | 0.825 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -58.5 | 127.8 | 172.1 | -50.6 | 0 | 0 | 0 | 0 | 110 | P210 | P210-S212 PolarHBondContact O-N 3.47Š|
| 213 | M | 60.8 | Low | 59.8 | Low | 176 Ų | 176 | 139.9 Ų | 139.9 | 87% | 0.867 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -59.7 | 138.8 | 167.1 | -75.4 | 178.6 | 165 | 0 | 0 | 109.1 | P211 | P211-M213 PolarHBondContact O-N 3.1Š|
| 214 | P | 62 | Low | 59.8 | Low | 119 Ų | 119 | 138.9 Ų | 138.9 | 77% | 0.773 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -61.5 | 145.6 | 164.7 | 28.6 | -33 | 0 | 0 | 0 | 108.8 | K216 | P214-K216 PolarHBondContact O-N 3.21Š|
| 215 | H | 56 | Low | 59.9 | Low | 172 Ų | 172 | 144.6 Ų | 144.6 | 80% | 0.796 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -52 | 134.5 | 167.5 | -83.2 | -108.3 | 0 | 0 | 0 | 108.8 | D217 | H215-D217 PolarHBondContact O-N 3.17Š|
| 216 | K | 52.9 | Low | 60.5 | Low | 196 Ų | 196 | 145 Ų | 145 | 85% | 0.852 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -71.7 | 119.1 | 148.8 | -79.9 | -175.4 | 171 | -172.1 | 0 | 105 | P214 E218 | P214-K216 PolarHBondContact O-N 3.21Å; K216-E218 PolarHBondContact O-N 2.87Å |
| 217 | D | 51.2 | Low | 60.6 | Low | 134 Ų | 134 | 148.9 Ų | 148.9 | 72% | 0.717 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -59.3 | 131.5 | 164.3 | -61.7 | -66.2 | 0 | 0 | 0 | 107.8 | H215 D219 | H215-D217 PolarHBondContact O-N 3.17Å; D217-D219 VanDerWaalsContact C-N 3.29Å; D217-D219 PolarHBondContact O-N 3.39Å; D217-D219 VanDerWaalsContact O-N 3.15Å |
| 218 | E | 52.7 | Low | 60.3 | Low | 187 Ų | 187 | 150.6 Ų | 150.6 | 87% | 0.874 | 82% | 0.816 | S | S | * | * | trans | -78.1 | 86.8 | 168.8 | -68.4 | 172.6 | 135.8 | 0 | 0 | 106.1 | K216 D220 | K216-E218 PolarHBondContact O-N 2.87Å; E218-D220 PolarHBondContact O-N 3.5Å | ||
| 219 | D | 53.9 | Low | 59.7 | Low | 149 Ų | 149 | 152.4 Ų | 152.4 | 80% | 0.797 | 82% | 0.82 | S | S | * | * | trans | -75.6 | 102.9 | 163.9 | -78.9 | -43.3 | 0 | 0 | 0 | 107.6 | D217 D221 | D217-D219 VanDerWaalsContact C-N 3.29Å; D217-D219 PolarHBondContact O-N 3.39Å; D217-D219 VanDerWaalsContact O-N 3.15Å; D219-D221 PolarHBondContact O-N 3.39Å | ||
| 220 | D | 55.9 | Low | 58.9 | Low | 137 Ų | 137 | 154.4 Ų | 154.4 | 73% | 0.733 | 82% | 0.824 | S | S | * | * | trans | -53.6 | 124.1 | 161.1 | -72.3 | -58.1 | 0 | 0 | 0 | 109.7 | E218 | E218-D220 PolarHBondContact O-N 3.5Š| ||
| 221 | D | 56.2 | Low | 58.1 | Low | 166 Ų | 166 | 157 Ų | 157 | 89% | 0.888 | 83% | 0.83 | S | S | * | * | trans | -135.1 | 74 | 154.6 | -95.8 | -37.9 | 0 | 0 | 0 | 107 | D219 | D219-D221 PolarHBondContact O-N 3.39Š| ||
| 222 | D | 56.8 | Low | 57.4 | Low | 141 Ų | 141 | 159.1 Ų | 159.1 | 75% | 0.754 | 83% | 0.831 | S | S | * | * | trans | -70.1 | 160.8 | 157.7 | -92.6 | -38.5 | 0 | 0 | 0 | 110.1 | ||||
| 223 | E | 57.2 | Low | 57.2 | Low | 180 Ų | 180 | 161.8 Ų | 161.8 | 84% | 0.841 | 83% | 0.832 | S | S | * | * | trans | 78.4 | 94.2 | 167.2 | -46 | -155.4 | 151.9 | 0 | 0 | 119 | ||||
| 224 | D | 58 | Low | 57 | Low | 153 Ų | 153 | 160.8 Ų | 160.8 | 82% | 0.818 | 83% | 0.829 | S | S | * | * | 173 | 108.8 | 108.4 | -93.4 | -23.2 | 0 | 0 | 0 | 109 | |||||
| 225 | Y | 57.4 | Low | 56.6 | Low | 198 Ų | 198 | 164 Ų | 164 | 78% | 0.776 | 83% | 0.833 | S | S | * | * | 65.3 | 94.6 | 71.8 | -156.4 | -73 | 0 | 0 | 0 | 114.2 | |||||
| 226 | D | 65.1 | Low | 56.6 | Low | 147 Ų | 147 | 163.3 Ų | 163.3 | 79% | 0.786 | 84% | 0.837 | S | S | * | * | -159.7 | 171 | 116.2 | -145.8 | -10.1 | 0 | 0 | 0 | 111.9 | |||||
| 227 | S | 62 | Low | 57 | Low | 172 Ų | 172 | 160.4 Ų | 160.4 | 100% | 1.203 | 84% | 0.835 | S | S | * | * | trans | -93.4 | 0 | -167.4 | -51.2 | 0 | 0 | 0 | 0 | 116.1 |
Retrieved 227 of 227 residues in 349.7 ms
(Link to these results)