| 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 | 49.8 | Very low | 68.7 | Low | 230 Ų | 230 | 123.5 Ų | 123.5 | 100% | 1.133 | 63% | 0.633 | S | S | * | * | 0 | 126.6 | 0 | -70.7 | -157.8 | 171.7 | 0 | 0 | 106.7 | |||||
| 2 | L | 61.7 | Low | 70.5 | Confident | 102 Ų | 102 | 123.3 Ų | 123.3 | 53% | 0.534 | 63% | 0.634 | S | S | . | * | trans | -64.9 | 135.2 | 179.2 | -66.9 | 167.3 | 0 | 0 | 0 | 109.5 | E6 | L2-E6 WeakPolarHBondContact CA-OE2 3.38Å; L2-E6 HydrophobicContact CB-CB 3.99Å; L2-E6 HydrophobicContact CD2-CB 4.16Å; L2-E6 HydrophobicContact CD2-CG 4.48Å; L2-E6 WeakPolarHBondContact CD2-OE2 3.47Å | ||
| 3 | T | 77.8 | Confident | 72.3 | Confident | 80 Ų | 80 | 114.2 Ų | 114.2 | 49% | 0.491 | 59% | 0.587 | S | S | . | * | trans | -64.4 | 159.7 | 178.4 | 65.3 | 0 | 0 | 0 | 0 | 110.2 | E5 E6 R7 | T3-E5 PolarHBondContact O-N 2.73Å; T3-E5 VanDerWaalsContact O-N 3.16Å; T3-E6 PolarHBondContact N-OE2 3.04Å; T3-E6 PolarHBondContact O-N 3.13Å; T3-E6 WeakPolarHBondContact OG1-CG 3.44Å; T3-E6 PolarHBondContact OG1-N 3.42Å; T3-E6 PolarHBondContact OG1-OE2 3.13Å; T3-R7 PolarHBondContact O-N 3.26Å | ||
| 4 | A | 76.4 | Confident | 73.9 | Confident | 90 Ų | 90 | 120 Ų | 120 | 74% | 0.744 | 61% | 0.606 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.5 | -28.6 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | R7 | A4-R7 PolarHBondContact O-N 3.38Š|
| 5 | E | 69.5 | Low | 75.3 | Confident | 173 Ų | 173 | 113.9 Ų | 113.9 | 81% | 0.808 | 58% | 0.582 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.1 | -38.6 | 174.1 | -72.5 | -171 | 120.7 | 0 | 0 | 112.8 | T3 R7 K8 | T3-E5 PolarHBondContact O-N 2.73Å; T3-E5 VanDerWaalsContact O-N 3.16Å; E5-R7 PolarHBondContact O-N 3.42Å; E5-R7 VanDerWaalsContact O-N 3.15Å; E5-K8 PolarHBondContact O-N 3.43Å; E5-K8 VanDerWaalsContact O-N 3.07Å |
| 6 | E | 65.7 | Low | 76.4 | Confident | 74 Ų | 74 | 111.7 Ų | 111.7 | 35% | 0.346 | 57% | 0.571 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -65.8 | -15.6 | 176.4 | -72.6 | 176.7 | 128.3 | 0 | 0 | 113.2 | L2 T3 K8 | L2-E6 WeakPolarHBondContact CA-OE2 3.38Å; L2-E6 HydrophobicContact CB-CB 3.99Å; L2-E6 HydrophobicContact CD2-CB 4.16Å; L2-E6 HydrophobicContact CD2-CG 4.48Å; L2-E6 WeakPolarHBondContact CD2-OE2 3.47Å; T3-E6 PolarHBondContact N-OE2 3.04Å; T3-E6 PolarHBondContact O-N 3.13Å; T3-E6 WeakPolarHBondContact OG1-CG 3.44Å; T3-E6 PolarHBondContact OG1-N 3.42Å; T3-E6 PolarHBondContact OG1-OE2 3.13Å; E6-K8 VanDerWaalsContact C-N 3.34Å |
| 7 | R | 66.9 | Low | 77.4 | Confident | 187 Ų | 187 | 115.1 Ų | 115.1 | 71% | 0.706 | 58% | 0.584 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.2 | -9.7 | 174.8 | -65.2 | -174.7 | -176 | -171.3 | -0.5 | 113.8 | T3 A4 E5 I9 | T3-R7 PolarHBondContact O-N 3.26Å; A4-R7 PolarHBondContact O-N 3.38Å; E5-R7 PolarHBondContact O-N 3.42Å; E5-R7 VanDerWaalsContact O-N 3.15Å; R7-I9 PolarHBondContact O-N 3.43Å |
| 8 | K | 73 | Confident | 78.3 | Confident | 183 Ų | 183 | 112.7 Ų | 112.7 | 80% | 0.796 | 57% | 0.574 | S | S | * | * | trans | -85.1 | 66.5 | 177.7 | -142.6 | 174.5 | -171.2 | -178.7 | 0 | 109.4 | E5 E6 P10 | E5-K8 PolarHBondContact O-N 3.43Å; E5-K8 VanDerWaalsContact O-N 3.07Å; E6-K8 VanDerWaalsContact C-N 3.34Å; K8-P10 WeakPolarHBondContact O-CD 3.32Å | ||
| 9 | I | 67.4 | Low | 78.9 | Confident | 81 Ų | 81 | 107.3 Ų | 107.3 | 42% | 0.415 | 55% | 0.547 | S | S | . | . | trans | -63.8 | 119.2 | 176.4 | -67.3 | 166.7 | 0 | 0 | 0 | 107.7 | R7 V11 C30 | R7-I9 PolarHBondContact O-N 3.43Å; I9-V11 PolarHBondContact O-N 3.1Å; I9-C30 HydrophobicContact CG2-CB 3.56Å | ||
| 10 | P | 71.2 | Confident | 79.4 | Confident | 56 Ų | 56 | 104.6 Ų | 104.6 | 36% | 0.364 | 54% | 0.536 | S | S | . | . | trans | -59.1 | 125 | 174.2 | 23.9 | -31 | 0 | 0 | 0 | 108.3 | K8 N12 | K8-P10 WeakPolarHBondContact O-CD 3.32Å; P10-N12 PolarHBondContact O-N 3.41Å | ||
| 11 | V | 76.5 | Confident | 79.6 | Confident | 103 Ų | 103 | 103 Ų | 103 | 62% | 0.624 | 54% | 0.54 | S | S | * | . | S | Bend | trans | -73.7 | 3.6 | -171.6 | -163.8 | 0 | 0 | 0 | 0 | 112.3 | I9 Q28 | I9-V11 PolarHBondContact O-N 3.1Å; V11-Q28 CarbonylContact C-O 3.19Å |
| 12 | N | 90.5 | Very high | 81.3 | Confident | 121 Ų | 121 | 100 Ų | 100 | 65% | 0.647 | 52% | 0.52 | S | S | * | . | trans | -146.3 | 63.5 | -174.6 | -70.5 | -39 | 0 | 0 | 0 | 111.5 | P10 Q28 | P10-N12 PolarHBondContact O-N 3.41Å; N12-Q28 CarbonylContact C-O 3.6Å; N12-Q28 VanDerWaalsContact CA-O 3.23Å; N12-Q28 WeakPolarHBondContact CA-O 3.32Å; N12-Q28 PolarHBondContact N-O 3.43Å | ||
| 13 | C | 93.1 | Very high | 82.7 | Confident | 4 Ų | 4 | 95.3 Ų | 95.3 | 3% | 0.027 | 50% | 0.496 | C | S | . | . | trans | -70.5 | 148.9 | 168.3 | 64.8 | 0 | 0 | 0 | 0 | 110.3 | D18 C25 Q28 R29 C30 | C13-D18 HydrophobicContact CB-CB 3.92Å; C13-C25 HydrophobicContact CB-CB 3.78Å; C13-C25 WeakPolarHBondContact CB-SG 3.36Å; C13-C25 PolarHBondContact O-SG 3.17Å; C13-C25 WeakPolarHBondContact SG-CA 3.37Å; C13-C25 WeakPolarHBondContact SG-CB 3.37Å; C13-C25 CovalentContact SG-SG 2.03Å; C13-C25 PolarHBondContact SG-SG 3.34Å; C13-Q28 PolarHBondContact N-O 3.36Å; C13-R29 PolarHBondContact SG-O 3.28Å; C13-C30 VanDerWaalsContact CB-SG 3.57Å | ||
| 14 | K | 94.8 | Very high | 83.3 | Confident | 196 Ų | 196 | 94.9 Ų | 94.9 | 85% | 0.852 | 49% | 0.49 | S | S | * | . | S | Bend | trans | -111.9 | -26 | 172 | -66 | -174.6 | 178.7 | -177.3 | 0 | 112.1 | D18 | K14-D18 WeakPolarHBondContact CA-OD2 3.49Å; K14-D18 PolarHBondContact N-OD2 3.35Å |
| 15 | A | 94.5 | Very high | 84.2 | Confident | 29 Ų | 29 | 91.8 Ų | 91.8 | 24% | 0.24 | 46% | 0.463 | C | S | . | . | S | Bend | trans | -142.7 | 162.1 | 177.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | Q17 D18 C25 | A15-Q17 HydrophobicContact CB-CG 4.04Å; A15-Q17 PolarHBondContact O-N 3.46Å; A15-Q17 VanDerWaalsContact O-N 3.15Å; A15-D18 PolarHBondContact N-OD2 3.04Å; A15-D18 WeakPolarHBondContact O-CB 3.12Å; A15-D18 PolarHBondContact O-N 3.24Å; A15-C25 VanDerWaalsContact C-CB 3.49Å; A15-C25 WeakPolarHBondContact O-CB 3.33Å |
| 16 | D | 93.9 | Very high | 85.4 | Confident | 78 Ų | 78 | 86.1 Ų | 86.1 | 42% | 0.417 | 44% | 0.442 | S | S | . | . | G | 310 helix | trans | -57.6 | -29.5 | 179.7 | -66.6 | -16.3 | 0 | 0 | 0 | 113.3 | D18 C19 L24 C25 | D16-D18 VanDerWaalsContact C-N 3.25Å; D16-D18 PolarHBondContact O-N 3.42Å; D16-C19 WeakPolarHBondContact O-CB 3.5Å; D16-C19 PolarHBondContact O-N 3.24Å; D16-L24 WeakPolarHBondContact OD1-CA 3.41Å; D16-L24 WeakPolarHBondContact OD2-CD2 3.44Å; D16-C25 PolarHBondContact OD1-N 3.03Å |
| 17 | Q | 93 | Very high | 86.7 | Confident | 169 Ų | 169 | 91.4 Ų | 91.4 | 79% | 0.79 | 47% | 0.467 | S | S | * | . | G | 310 helix | trans | -70 | -18.9 | 176.8 | 64.8 | -128.1 | 4.3 | 0 | 0 | 114 | A15 C19 | A15-Q17 HydrophobicContact CB-CG 4.04Å; A15-Q17 PolarHBondContact O-N 3.46Å; A15-Q17 VanDerWaalsContact O-N 3.15Å; Q17-C19 PolarHBondContact O-N 3.41Å |
| 18 | D | 93.1 | Very high | 87.9 | Confident | 73 Ų | 73 | 88.5 Ų | 88.5 | 39% | 0.39 | 46% | 0.461 | S | S | . | . | G | 310 helix | trans | -75.8 | -13.3 | 174.7 | -56.1 | -36.3 | 0 | 0 | 0 | 111.2 | C13 K14 A15 D16 | C13-D18 HydrophobicContact CB-CB 3.92Å; K14-D18 WeakPolarHBondContact CA-OD2 3.49Å; K14-D18 PolarHBondContact N-OD2 3.35Å; A15-D18 PolarHBondContact N-OD2 3.04Å; A15-D18 WeakPolarHBondContact O-CB 3.12Å; A15-D18 PolarHBondContact O-N 3.24Å; D16-D18 VanDerWaalsContact C-N 3.25Å; D16-D18 PolarHBondContact O-N 3.42Å |
| 19 | C | 91.3 | Very high | 88.8 | Confident | 9 Ų | 9 | 87.9 Ų | 87.9 | 6% | 0.061 | 45% | 0.454 | C | S | . | . | S | Bend | trans | -88.5 | 125.2 | -175.6 | -68 | 0 | 0 | 0 | 0 | 112.4 | D16 Q17 C30 | D16-C19 WeakPolarHBondContact O-CB 3.5Å; D16-C19 PolarHBondContact O-N 3.24Å; Q17-C19 PolarHBondContact O-N 3.41Å; C19-C30 WeakPolarHBondContact CA-SG 3.44Å; C19-C30 HydrophobicContact CB-CB 3.52Å; C19-C30 WeakPolarHBondContact CB-SG 3.48Å; C19-C30 WeakPolarHBondContact SG-CA 3.49Å; C19-C30 WeakPolarHBondContact SG-CB 3.49Å; C19-C30 CovalentContact SG-SG 2.03Å; C19-C30 PolarHBondContact SG-SG 3.09Å |
| 20 | P | 87.4 | Confident | 90 | Very high | 53 Ų | 53 | 84.6 Ų | 84.6 | 34% | 0.344 | 44% | 0.438 | S | S | . | . | G | 310 helix | trans | -62.5 | 156.2 | 172.9 | 27.6 | -33.2 | 0 | 0 | 0 | 110.2 | K22 G23 | P20-K22 VanDerWaalsContact C-N 3.27Å; P20-K22 PolarHBondContact O-N 3.46Å; P20-G23 PolarHBondContact O-N 2.87Å |
| 21 | A | 84.7 | Confident | 90.9 | Very high | 73 Ų | 73 | 86.4 Ų | 86.4 | 60% | 0.603 | 44% | 0.444 | S | S | * | . | G | 310 helix | trans | 58.4 | 31 | 177.8 | 0 | 0 | 0 | 0 | 0 | 115.4 | G23 | A21-G23 PolarHBondContact O-N 3.36Š|
| 22 | K | 85.5 | Confident | 91.5 | Very high | 167 Ų | 167 | 85.2 Ų | 85.2 | 73% | 0.726 | 45% | 0.445 | S | S | * | . | G | 310 helix | trans | 58.6 | 31.2 | -179.4 | -54 | 177.2 | 178.8 | 177.8 | 0 | 112.6 | P20 K33 | P20-K22 VanDerWaalsContact C-N 3.27Å; P20-K22 PolarHBondContact O-N 3.46Å; K22-K33 WeakPolarHBondContact O-CD 3.29Å; K22-K33 WeakPolarHBondContact O-CE 3.45Å; K22-K33 WeakPolarHBondContact O-CG 3.1Å; K22-K33 PolarHBondContact O-NZ 3.16Å; K22-K33 VanDerWaalsContact O-NZ 3.08Å |
| 23 | G | 89.5 | Confident | 91.4 | Very high | 3 Ų | 3 | 85 Ų | 85 | 3% | 0.031 | 44% | 0.438 | C | S | . | . | trans | -59.3 | 170.1 | 173.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | P20 A21 I31 | P20-G23 PolarHBondContact O-N 2.87Å; A21-G23 PolarHBondContact O-N 3.36Å; G23-I31 CarbonylContact C-O 3.49Å; G23-I31 WeakPolarHBondContact CA-O 3.34Å | ||
| 24 | L | 92.3 | Very high | 91.1 | Very high | 70 Ų | 70 | 87.9 Ų | 87.9 | 37% | 0.366 | 47% | 0.468 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.6 | 135.4 | 169.3 | -64.1 | 173 | 0 | 0 | 0 | 108.4 | D16 C30 I31 K33 | D16-L24 WeakPolarHBondContact OD1-CA 3.41Å; D16-L24 WeakPolarHBondContact OD2-CD2 3.44Å; L24-C30 WeakPolarHBondContact O-CA 3.4Å; L24-I31 PolarHBondContact N-O 3.47Å; L24-I31 PolarHBondContact O-N 2.81Å; L24-K33 HydrophobicContact CD1-CG 4.32Å; L24-K33 HydrophobicContact CD2-CG 4.45Å; L24-K33 HydrophobicContact CG-CG 3.92Å |
| 25 | C | 94.7 | Very high | 90.6 | Very high | 25 Ų | 25 | 85.5 Ų | 85.5 | 17% | 0.169 | 47% | 0.47 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.6 | 115.2 | 175.1 | -175 | 0 | 0 | 0 | 0 | 109.6 | C13 A15 D16 | C13-C25 HydrophobicContact CB-CB 3.78Å; C13-C25 WeakPolarHBondContact CB-SG 3.36Å; C13-C25 PolarHBondContact O-SG 3.17Å; C13-C25 WeakPolarHBondContact SG-CA 3.37Å; C13-C25 WeakPolarHBondContact SG-CB 3.37Å; C13-C25 CovalentContact SG-SG 2.03Å; C13-C25 PolarHBondContact SG-SG 3.34Å; A15-C25 VanDerWaalsContact C-CB 3.49Å; A15-C25 WeakPolarHBondContact O-CB 3.33Å; D16-C25 PolarHBondContact OD1-N 3.03Å |
| 26 | C | 93.8 | Very high | 90.3 | Very high | 55 Ų | 55 | 88.4 Ų | 88.4 | 37% | 0.372 | 49% | 0.494 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.9 | 126.1 | 178.4 | -63 | 0 | 0 | 0 | 0 | 108.8 | Q28 R29 I31 | C26-Q28 VanDerWaalsContact C-N 3.26Å; C26-Q28 PolarHBondContact O-N 3.44Å; C26-R29 PolarHBondContact N-O 3.3Å; C26-R29 PolarHBondContact O-N 3.37Å; C26-I31 HydrophobicContact CB-CD1 3.47Å; C26-I31 VanDerWaalsContact CB-CD1 3.47Å; C26-I31 HydrophobicContact CB-CG1 4.07Å |
| 27 | E | 93 | Very high | 89.9 | Confident | 185 Ų | 185 | 88.8 Ų | 88.8 | 86% | 0.864 | 51% | 0.508 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 51.7 | 44.2 | 179.3 | -57.8 | -178.9 | 174.2 | 0 | 0 | 113 | R29 | E27-R29 PolarHBondContact O-N 3.31Š|
| 28 | Q | 92.3 | Very high | 89.7 | Confident | 125 Ų | 125 | 83.3 Ų | 83.3 | 58% | 0.584 | 49% | 0.487 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 67.7 | 6.3 | -179.1 | -54.3 | 175.5 | -19.7 | 0 | 0 | 115.2 | V11 N12 C13 C26 | V11-Q28 CarbonylContact C-O 3.19Å; N12-Q28 CarbonylContact C-O 3.6Å; N12-Q28 VanDerWaalsContact CA-O 3.23Å; N12-Q28 WeakPolarHBondContact CA-O 3.32Å; N12-Q28 PolarHBondContact N-O 3.43Å; C13-Q28 PolarHBondContact N-O 3.36Å; C26-Q28 VanDerWaalsContact C-N 3.26Å; C26-Q28 PolarHBondContact O-N 3.44Å |
| 29 | R | 91.8 | Very high | 89.7 | Confident | 170 Ų | 170 | 88.9 Ų | 88.9 | 64% | 0.642 | 51% | 0.508 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -117.7 | 141.5 | 178.7 | -59.6 | 179.2 | -174 | -153.8 | 1 | 110.5 | C13 C26 E27 I31 | C13-R29 PolarHBondContact SG-O 3.28Å; C26-R29 PolarHBondContact N-O 3.3Å; C26-R29 PolarHBondContact O-N 3.37Å; E27-R29 PolarHBondContact O-N 3.31Å; R29-I31 PolarHBondContact O-N 3.03Å |
| 30 | C | 92.1 | Very high | 89.7 | Confident | 13 Ų | 13 | 91.5 Ų | 91.5 | 9% | 0.088 | 53% | 0.53 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.5 | 120.4 | 171.5 | -59.7 | 0 | 0 | 0 | 0 | 110.4 | I9 C13 C19 L24 | I9-C30 HydrophobicContact CG2-CB 3.56Å; C13-C30 VanDerWaalsContact CB-SG 3.57Å; C19-C30 WeakPolarHBondContact CA-SG 3.44Å; C19-C30 HydrophobicContact CB-CB 3.52Å; C19-C30 WeakPolarHBondContact CB-SG 3.48Å; C19-C30 WeakPolarHBondContact SG-CA 3.49Å; C19-C30 WeakPolarHBondContact SG-CB 3.49Å; C19-C30 CovalentContact SG-SG 2.03Å; C19-C30 PolarHBondContact SG-SG 3.09Å; L24-C30 WeakPolarHBondContact O-CA 3.4Å |
| 31 | I | 90.7 | Very high | 90 | Very high | 93 Ų | 93 | 91.4 Ų | 91.4 | 48% | 0.477 | 53% | 0.525 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.2 | 131.8 | 171.8 | -51.2 | -175.9 | 0 | 0 | 0 | 106.9 | G23 L24 C26 R29 K33 | G23-I31 CarbonylContact C-O 3.49Å; G23-I31 WeakPolarHBondContact CA-O 3.34Å; L24-I31 PolarHBondContact N-O 3.47Å; L24-I31 PolarHBondContact O-N 2.81Å; C26-I31 HydrophobicContact CB-CD1 3.47Å; C26-I31 VanDerWaalsContact CB-CD1 3.47Å; C26-I31 HydrophobicContact CB-CG1 4.07Å; R29-I31 PolarHBondContact O-N 3.03Å; I31-K33 PolarHBondContact O-N 2.75Å |
| 32 | A | 89.1 | Confident | 90.4 | Very high | 78 Ų | 78 | 96.5 Ų | 96.5 | 65% | 0.645 | 54% | 0.536 | S | S | * | . | P | Polyproline II helix | trans | -57.3 | 135.5 | 172 | 0 | 0 | 0 | 0 | 0 | 108.9 | G34 | A32-G34 PolarHBondContact O-N 3.01Š|
| 33 | K | 88.8 | Confident | 90.8 | Very high | 116 Ų | 116 | 89.3 Ų | 89.3 | 50% | 0.504 | 51% | 0.509 | S | S | . | . | P | Polyproline II helix | trans | -54.7 | 117 | 169.6 | -85 | 179.4 | -177 | 153.6 | 0 | 107.3 | K22 L24 I31 | K22-K33 WeakPolarHBondContact O-CD 3.29Å; K22-K33 WeakPolarHBondContact O-CE 3.45Å; K22-K33 WeakPolarHBondContact O-CG 3.1Å; K22-K33 PolarHBondContact O-NZ 3.16Å; K22-K33 VanDerWaalsContact O-NZ 3.08Å; L24-K33 HydrophobicContact CD1-CG 4.32Å; L24-K33 HydrophobicContact CD2-CG 4.45Å; L24-K33 HydrophobicContact CG-CG 3.92Å; I31-K33 PolarHBondContact O-N 2.75Å |
| 34 | G | 85.7 | Confident | 91 | Very high | 65 Ų | 65 | 94.7 Ų | 94.7 | 67% | 0.67 | 53% | 0.532 | S | S | * | . | P | Polyproline II helix | trans | -51.1 | 147.1 | 177.1 | 0 | 0 | 0 | 0 | 0 | 109.4 | A32 A36 | A32-G34 PolarHBondContact O-N 3.01Å; G34-A36 PolarHBondContact O-N 3.12Å; G34-A36 VanDerWaalsContact O-N 3.15Å |
| 35 | V | 85.9 | Confident | 91.1 | Very high | 146 Ų | 146 | 93.9 Ų | 93.9 | 89% | 0.885 | 53% | 0.531 | S | S | * | . | P | Polyproline II helix | trans | -51 | 128.1 | 171.4 | -178.8 | 0 | 0 | 0 | 0 | 107.1 | A37 | V35-A37 PolarHBondContact O-N 3.01Å; V35-A37 VanDerWaalsContact O-N 3.1Å |
| 36 | A | 87.1 | Confident | 91 | Very high | 91 Ų | 91 | 93.8 Ų | 93.8 | 75% | 0.752 | 53% | 0.53 | S | S | * | . | P | Polyproline II helix | trans | -48.9 | 124.9 | -179.1 | 0 | 0 | 0 | 0 | 0 | 108.9 | G34 | G34-A36 PolarHBondContact O-N 3.12Å; G34-A36 VanDerWaalsContact O-N 3.15Å |
| 37 | A | 86.3 | Confident | 90.8 | Very high | 85 Ų | 85 | 97.1 Ų | 97.1 | 70% | 0.702 | 55% | 0.554 | S | S | * | * | P | Polyproline II helix | trans | -52.2 | 137.9 | -178.3 | 0 | 0 | 0 | 0 | 0 | 109.1 | V35 K39 | V35-A37 PolarHBondContact O-N 3.01Å; V35-A37 VanDerWaalsContact O-N 3.1Å; A37-K39 PolarHBondContact O-N 3.27Å |
| 38 | P | 88.5 | Confident | 90.5 | Very high | 54 Ų | 54 | 90.2 Ų | 90.2 | 35% | 0.351 | 53% | 0.525 | S | S | . | . | P | Polyproline II helix | trans | -55.3 | 131.7 | 179.7 | 23.2 | -32.3 | 0 | 0 | 0 | 109.3 | A40 N60 K62 | P38-A40 PolarHBondContact O-N 3.02Å; P38-N60 HydrophobicContact CG-CB 4.4Å; P38-K62 HydrophobicContact CB-CD 4Å; P38-K62 HydrophobicContact CB-CG 4.45Å |
| 39 | K | 92.2 | Very high | 90.2 | Very high | 190 Ų | 190 | 88.3 Ų | 88.3 | 83% | 0.826 | 52% | 0.522 | S | S | * | . | P | Polyproline II helix | trans | -55.5 | 117.9 | 175.7 | -171 | 177.3 | -179.1 | -178 | 0 | 108.6 | A37 | A37-K39 PolarHBondContact O-N 3.27Š|
| 40 | A | 92.6 | Very high | 89.7 | Confident | 65 Ų | 65 | 91.9 Ų | 91.9 | 54% | 0.537 | 54% | 0.535 | S | S | . | . | P | Polyproline II helix | trans | -65.6 | 145.8 | 178 | 0 | 0 | 0 | 0 | 0 | 110.3 | P38 D61 | P38-A40 PolarHBondContact O-N 3.02Å; A40-D61 WeakPolarHBondContact CA-OD2 3.07Å |
| 41 | K | 93.8 | Very high | 89.4 | Confident | 51 Ų | 51 | 95.6 Ų | 95.6 | 22% | 0.222 | 55% | 0.554 | C | S | . | * | P | Polyproline II helix | trans | -70.8 | 156.7 | 172.3 | -73.3 | 174.2 | -176.3 | 179.5 | 0 | 110.1 | D61 C64 A66 E68 K69 | K41-D61 HydrophobicContact CB-CB 4.31Å; K41-D61 HydrophobicContact CD-CB 4.12Å; K41-D61 WeakPolarHBondContact CE-O 3.32Å; K41-D61 HydrophobicContact CG-CB 4.03Å; K41-D61 PolarHBondContact N-OD2 3Å; K41-D61 PolarHBondContact NZ-O 3.48Å; K41-C64 PolarHBondContact NZ-O 3.14Å; K41-A66 WeakPolarHBondContact CE-O 3.42Å; K41-A66 PolarHBondContact NZ-O 3.05Å; K41-E68 WeakPolarHBondContact CD-O 3.46Å; K41-E68 WeakPolarHBondContact CE-O 3.03Å; K41-E68 PolarHBondContact NZ-O 2.79Å; K41-K69 HydrophobicContact CB-CD 4.45Å; K41-K69 HydrophobicContact CB-CG 3.98Å; K41-K69 WeakPolarHBondContact O-CE 3.37Å; K41-K69 PolarHBondContact O-NZ 3.26Å |
| 42 | E | 92.9 | Very high | 89.3 | Confident | 180 Ų | 180 | 98.2 Ų | 98.2 | 84% | 0.841 | 57% | 0.569 | S | S | * | * | S | Bend | trans | -64.6 | 151.9 | -178.6 | -66.7 | 175.2 | -177.9 | 0 | 0 | 112.6 | P82 | E42-P82 WeakPolarHBondContact O-CG 3.34Š|
| 43 | G | 93.6 | Very high | 89.2 | Confident | 15 Ų | 15 | 97.1 Ų | 97.1 | 16% | 0.155 | 55% | 0.554 | C | S | . | * | S | Bend | trans | 89.9 | 179.2 | -178.4 | 0 | 0 | 0 | 0 | 0 | 114.9 | K69 | G43-K69 PolarHBondContact O-NZ 3.36Š|
| 44 | F | 93.5 | Very high | 89.2 | Confident | 117 Ų | 117 | 96.5 Ų | 96.5 | 51% | 0.513 | 56% | 0.56 | S | S | . | * | B | Isolated β-bridge | trans | -117.9 | 143.7 | -176.1 | -65.4 | -76.3 | 0 | 0 | 0 | 111.9 | P82 K83 R85 | F44-P82 WeakPolarHBondContact O-CA 3.44Å; F44-K83 PolarHBondContact N-O 3.24Å; F44-K83 PolarHBondContact O-N 2.95Å; F44-R85 HydrophobicContact CD2-CG 3.92Å; F44-R85 HydrophobicContact CE2-CG 3.57Å; F44-R85 VanDerWaalsContact CE2-NE 3.34Å |
| 45 | C | 94.9 | Very high | 89.5 | Confident | 53 Ų | 53 | 96.9 Ų | 96.9 | 36% | 0.358 | 55% | 0.549 | S | S | . | . | P | Polyproline II helix | trans | -63.1 | 143.4 | 168.6 | -69.3 | 0 | 0 | 0 | 0 | 109.7 | S47 C71 | C45-S47 PolarHBondContact O-N 3.2Å; C45-C71 WeakPolarHBondContact CA-SG 3.47Å; C45-C71 HydrophobicContact CB-CB 3.65Å; C45-C71 WeakPolarHBondContact CB-SG 3.03Å; C45-C71 VanDerWaalsContact SG-CA 3.51Å; C45-C71 WeakPolarHBondContact SG-CB 3.49Å; C45-C71 CovalentContact SG-SG 2.03Å; C45-C71 PolarHBondContact SG-SG 3.33Å |
| 46 | P | 91.3 | Very high | 90 | Very high | 22 Ų | 22 | 98.9 Ų | 98.9 | 14% | 0.143 | 54% | 0.541 | C | S | . | . | P | Polyproline II helix | trans | -56.2 | 138 | 171.6 | 25.9 | -33.6 | 0 | 0 | 0 | 109.3 | T48 F73 V80 | P46-T48 PolarHBondContact O-N 3.23Å; P46-F73 HydrophobicContact CG-CD2 4.35Å; P46-V80 HydrophobicContact CG-CG1 4.07Å |
| 47 | S | 90.4 | Very high | 90.5 | Very high | 126 Ų | 126 | 100.8 Ų | 100.8 | 88% | 0.881 | 53% | 0.534 | S | S | * | . | P | Polyproline II helix | trans | -60.3 | 124.5 | 174 | -171.5 | 0 | 0 | 0 | 0 | 108.9 | C45 | C45-S47 PolarHBondContact O-N 3.2Š|
| 48 | T | 87.3 | Confident | 91 | Very high | 39 Ų | 39 | 97 Ų | 97 | 24% | 0.239 | 50% | 0.502 | C | S | . | . | trans | -127.6 | 143.5 | 175.2 | 65.9 | 0 | 0 | 0 | 0 | 109.8 | P46 R50 H72 F73 | P46-T48 PolarHBondContact O-N 3.23Å; T48-R50 PolarHBondContact O-N 3.05Å; T48-H72 VanDerWaalsContact CG2-O 3.23Å; T48-H72 WeakPolarHBondContact CG2-O 3.23Å; T48-H72 PolarHBondContact OG1-O 2.75Å; T48-F73 HydrophobicContact CG2-CD2 3.97Å | ||
| 49 | T | 85.3 | Confident | 91.3 | Very high | 85 Ų | 85 | 101.8 Ų | 101.8 | 52% | 0.521 | 52% | 0.52 | S | S | . | . | trans | -54.4 | 133.3 | 170 | -47.8 | 0 | 0 | 0 | 0 | 109.2 | L51 | T49-L51 VanDerWaalsContact C-N 3.34Å; T49-L51 PolarHBondContact O-N 3.49Å | ||
| 50 | R | 81.6 | Confident | 91.4 | Very high | 245 Ų | 245 | 96 Ų | 96 | 93% | 0.925 | 50% | 0.498 | S | S | * | . | trans | -67.4 | 93.5 | 178.3 | -68.1 | -177.3 | 178.3 | 179.9 | -0.2 | 108.8 | T48 | T48-R50 PolarHBondContact O-N 3.05Š| ||
| 51 | L | 85.3 | Confident | 91.6 | Very high | 92 Ų | 92 | 94 Ų | 94 | 48% | 0.482 | 48% | 0.478 | S | S | . | . | P | Polyproline II helix | trans | -102.6 | 159.7 | 172.7 | -63.4 | 173.1 | 0 | 0 | 0 | 109.8 | T49 V53 H72 R74 | T49-L51 VanDerWaalsContact C-N 3.34Å; T49-L51 PolarHBondContact O-N 3.49Å; L51-V53 PolarHBondContact O-N 3.33Å; L51-H72 PolarHBondContact O-CE1 3.31Å; L51-H72 PolarHBondContact O-NE2 2.96Å; L51-R74 HydrophobicContact CD1-CB 4.49Å |
| 52 | N | 89.2 | Confident | 91.7 | Very high | 148 Ų | 148 | 98.6 Ų | 98.6 | 79% | 0.791 | 50% | 0.498 | S | S | * | . | P | Polyproline II helix | trans | -66.1 | 126.4 | 173.9 | -69.9 | -29.9 | 0 | 0 | 0 | 109.4 | T54 | N52-T54 PolarHBondContact O-N 3.02Š|
| 53 | V | 86.7 | Confident | 91.8 | Very high | 54 Ų | 54 | 94.5 Ų | 94.5 | 33% | 0.327 | 48% | 0.482 | S | S | . | . | P | Polyproline II helix | trans | -68.6 | 117.9 | 175.2 | -177.6 | 0 | 0 | 0 | 0 | 108.6 | L51 R56 H72 S75 I77 | L51-V53 PolarHBondContact O-N 3.33Å; V53-R56 HydrophobicContact CG1-CG 3.75Å; V53-H72 VanDerWaalsContact CG2-CD2 3.44Å; V53-H72 WeakPolarHBondContact CG2-CD2 3.18Å; V53-H72 WeakPolarHBondContact CG2-NE2 3.4Å; V53-S75 CarbonylContact C-O 3.6Å; V53-S75 WeakPolarHBondContact CA-O 3.33Å; V53-I77 HydrophobicContact CG1-CD1 3.85Å; V53-I77 HydrophobicContact CG1-CG1 3.77Å; V53-I77 HydrophobicContact CG2-CD1 3.85Å; V53-I77 HydrophobicContact CG2-CG1 3.98Å |
| 54 | T | 89.8 | Confident | 92 | Very high | 103 Ų | 103 | 94.1 Ų | 94.1 | 63% | 0.632 | 48% | 0.477 | S | S | * | . | trans | -93.9 | -32.7 | 173.3 | 54.5 | 0 | 0 | 0 | 0 | 111.8 | N52 S75 | N52-T54 PolarHBondContact O-N 3.02Å; T54-S75 PolarHBondContact N-O 3.05Å; T54-S75 PolarHBondContact OG1-O 2.99Å | ||
| 55 | V | 92.5 | Very high | 92.1 | Very high | 73 Ų | 73 | 92.5 Ų | 92.5 | 44% | 0.442 | 48% | 0.478 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -140.4 | 138.5 | -173 | 175.7 | 0 | 0 | 0 | 0 | 110.5 | L76 I77 | V55-L76 HydrophobicContact CB-CD2 3.63Å; V55-L76 HydrophobicContact CG1-CD2 3.87Å; V55-L76 HydrophobicContact CG2-CD2 4.45Å; V55-L76 WeakPolarHBondContact O-CA 3.31Å; V55-I77 PolarHBondContact O-N 3.2Å |
| 56 | R | 95.8 | Very high | 92 | Very high | 188 Ų | 188 | 94.5 Ų | 94.5 | 71% | 0.709 | 50% | 0.499 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -120.7 | 116 | 178.7 | -57 | -170.8 | -179.4 | -170.9 | 0 | 110.6 | V53 I77 | V53-R56 HydrophobicContact CG1-CG 3.75Å; R56-I77 HydrophobicContact CB-CB 4.43Å; R56-I77 HydrophobicContact CG-CB 4.35Å; R56-I77 HydrophobicContact CG-CD1 4.01Å; R56-I77 HydrophobicContact CG-CG1 4.45Å |
| 57 | E | 96.5 | Very high | 92.1 | Very high | 132 Ų | 132 | 102 Ų | 102 | 62% | 0.617 | 53% | 0.529 | S | S | * | . | S | Bend | trans | -96.4 | -26.8 | 176.3 | -59.3 | -178.3 | 161.2 | 0 | 0 | 112.2 | I77 T78 | E57-I77 WeakPolarHBondContact CB-O 3.4Å; E57-I77 PolarHBondContact N-O 2.96Å; E57-T78 WeakPolarHBondContact OE2-CB 2.97Å; E57-T78 PolarHBondContact OE2-OG1 3.13Å |
| 58 | C | 96.8 | Very high | 92.3 | Very high | 5 Ų | 5 | 98.6 Ų | 98.6 | 3% | 0.034 | 50% | 0.499 | C | S | . | . | trans | -133.4 | 153.2 | 176.6 | 62.4 | 0 | 0 | 0 | 0 | 111 | N63 C70 I77 T78 | C58-N63 HydrophobicContact CB-CB 4.26Å; C58-C70 HydrophobicContact CB-CB 3.89Å; C58-C70 WeakPolarHBondContact CB-SG 3.27Å; C58-C70 PolarHBondContact O-SG 2.93Å; C58-C70 WeakPolarHBondContact SG-CA 3.48Å; C58-C70 WeakPolarHBondContact SG-CB 3.41Å; C58-C70 CovalentContact SG-SG 2.04Å; C58-C70 PolarHBondContact SG-SG 3.25Å; C58-I77 VanDerWaalsContact O-CG2 3.27Å; C58-I77 WeakPolarHBondContact O-CG2 3.02Å; C58-T78 VanDerWaalsContact SG-C 3.55Å | ||
| 59 | E | 95 | Very high | 92.7 | Very high | 154 Ų | 154 | 98 Ų | 98 | 72% | 0.72 | 49% | 0.493 | S | S | * | . | S | Bend | trans | -105.6 | -33.4 | 176.2 | -66.9 | -177 | 164.2 | 0 | 0 | 112.6 | ||
| 60 | N | 95.3 | Very high | 93.3 | Very high | 70 Ų | 70 | 95 Ų | 95 | 37% | 0.374 | 48% | 0.475 | S | S | . | . | S | Bend | trans | -146.9 | 160.3 | -176.3 | -67.3 | -64 | 0 | 0 | 0 | 110.1 | P38 K62 N63 C70 | P38-N60 HydrophobicContact CG-CB 4.4Å; N60-K62 PolarHBondContact O-N 3.36Å; N60-N63 WeakPolarHBondContact O-CB 3.38Å; N60-N63 PolarHBondContact O-N 3.36Å; N60-C70 VanDerWaalsContact C-CB 3.45Å |
| 61 | D | 96.2 | Very high | 94 | Very high | 21 Ų | 21 | 83.4 Ų | 83.4 | 11% | 0.112 | 43% | 0.432 | C | S | . | . | G | 310 helix | trans | -53.3 | -28.7 | 176 | -72.6 | -10.1 | 0 | 0 | 0 | 113.6 | A40 K41 N63 C64 K69 C70 | A40-D61 WeakPolarHBondContact CA-OD2 3.07Å; K41-D61 HydrophobicContact CB-CB 4.31Å; K41-D61 HydrophobicContact CD-CB 4.12Å; K41-D61 WeakPolarHBondContact CE-O 3.32Å; K41-D61 HydrophobicContact CG-CB 4.03Å; K41-D61 PolarHBondContact N-OD2 3Å; K41-D61 PolarHBondContact NZ-O 3.48Å; D61-N63 PolarHBondContact O-N 3.47Å; D61-C64 PolarHBondContact O-N 3.01Å; D61-K69 WeakPolarHBondContact OD1-CA 3.37Å; D61-K69 WeakPolarHBondContact OD1-CB 3.48Å; D61-K69 VanDerWaalsContact OD2-CE 3.27Å; D61-K69 WeakPolarHBondContact OD2-CE 3.04Å; D61-K69 IonicContact OD2-NZ 3.92Å; D61-C70 PolarHBondContact OD1-N 3.48Å |
| 62 | K | 95.6 | Very high | 94.4 | Very high | 149 Ų | 149 | 81.2 Ų | 81.2 | 65% | 0.648 | 42% | 0.419 | S | S | * | . | G | 310 helix | trans | -65.7 | -25.6 | 178.2 | -67.3 | -176 | 176.8 | -179.1 | 0 | 113.3 | P38 N60 C64 | P38-K62 HydrophobicContact CB-CD 4Å; P38-K62 HydrophobicContact CB-CG 4.45Å; N60-K62 PolarHBondContact O-N 3.36Å; K62-C64 VanDerWaalsContact C-N 3.28Å |
| 63 | N | 96.1 | Very high | 94.5 | Very high | 94 Ų | 94 | 78.2 Ų | 78.2 | 50% | 0.503 | 40% | 0.399 | S | S | . | . | G | 310 helix | trans | -78.7 | -18.1 | 179.6 | -62.2 | 47.2 | 0 | 0 | 0 | 111.5 | C58 N60 D61 | C58-N63 HydrophobicContact CB-CB 4.26Å; N60-N63 WeakPolarHBondContact O-CB 3.38Å; N60-N63 PolarHBondContact O-N 3.36Å; D61-N63 PolarHBondContact O-N 3.47Å |
| 64 | C | 96.9 | Very high | 94.6 | Very high | 7 Ų | 7 | 83.5 Ų | 83.5 | 5% | 0.047 | 41% | 0.413 | C | S | . | . | S | Bend | trans | -84.9 | 139.9 | 179.6 | -64.2 | 0 | 0 | 0 | 0 | 111.4 | K41 D61 K62 E68 C79 | K41-C64 PolarHBondContact NZ-O 3.14Å; D61-C64 PolarHBondContact O-N 3.01Å; K62-C64 VanDerWaalsContact C-N 3.28Å; C64-E68 HydrophobicContact CB-CB 3.91Å; C64-E68 VanDerWaalsContact CB-O 3.32Å; C64-E68 WeakPolarHBondContact CB-O 3.48Å; C64-C79 WeakPolarHBondContact CA-SG 3.41Å; C64-C79 HydrophobicContact CB-CB 3.65Å; C64-C79 WeakPolarHBondContact CB-SG 3.33Å; C64-C79 WeakPolarHBondContact SG-CA 2.99Å; C64-C79 WeakPolarHBondContact SG-CB 3.42Å; C64-C79 CovalentContact SG-SG 2.04Å; C64-C79 PolarHBondContact SG-SG 3.19Å |
| 65 | P | 96.2 | Very high | 94.7 | Very high | 83 Ų | 83 | 80.7 Ų | 80.7 | 54% | 0.539 | 40% | 0.398 | S | S | . | . | S | Bend | trans | -66.9 | 155.5 | 177.2 | 28.8 | -33.5 | 0 | 0 | 0 | 111.5 | K67 E68 | P65-K67 PolarHBondContact O-N 3.32Å; P65-E68 WeakPolarHBondContact CG-OE2 3.4Å; P65-E68 WeakPolarHBondContact O-CB 3.43Å; P65-E68 PolarHBondContact O-N 3.17Å |
| 66 | A | 92.3 | Very high | 94.7 | Very high | 95 Ų | 95 | 80 Ų | 80 | 79% | 0.785 | 39% | 0.391 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 48.5 | -125.2 | 172.8 | 0 | 0 | 0 | 0 | 0 | 114.1 | K41 | K41-A66 WeakPolarHBondContact CE-O 3.42Å; K41-A66 PolarHBondContact NZ-O 3.05Å |
| 67 | K | 92.5 | Very high | 94.8 | Very high | 179 Ų | 179 | 72.6 Ų | 72.6 | 78% | 0.778 | 37% | 0.365 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -96.9 | 9.1 | -175.8 | -62.1 | -176.6 | -179.6 | -177.5 | 0 | 113.7 | P65 P82 | P65-K67 PolarHBondContact O-N 3.32Å; K67-P82 WeakPolarHBondContact O-CD 3.45Å; K67-P82 WeakPolarHBondContact O-CG 3.47Å |
| 68 | E | 95.6 | Very high | 94.8 | Very high | 54 Ų | 54 | 67.7 Ų | 67.7 | 25% | 0.252 | 35% | 0.345 | S | S | . | . | trans | -77 | 147.8 | -178.9 | -65 | 176.3 | 172.5 | 0 | 0 | 112 | K41 C64 P65 C79 V80 I81 | K41-E68 WeakPolarHBondContact CD-O 3.46Å; K41-E68 WeakPolarHBondContact CE-O 3.03Å; K41-E68 PolarHBondContact NZ-O 2.79Å; C64-E68 HydrophobicContact CB-CB 3.91Å; C64-E68 VanDerWaalsContact CB-O 3.32Å; C64-E68 WeakPolarHBondContact CB-O 3.48Å; P65-E68 WeakPolarHBondContact CG-OE2 3.4Å; P65-E68 WeakPolarHBondContact O-CB 3.43Å; P65-E68 PolarHBondContact O-N 3.17Å; E68-C79 HydrophobicContact CB-CB 4.19Å; E68-C79 WeakPolarHBondContact OE2-CB 3.01Å; E68-V80 WeakPolarHBondContact CA-O 3.38Å; E68-I81 HydrophobicContact CG-CG1 4.04Å | ||
| 69 | K | 96.5 | Very high | 94.8 | Very high | 26 Ų | 26 | 69.1 Ų | 69.1 | 11% | 0.113 | 35% | 0.354 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.8 | 148.7 | 177.3 | -68.4 | -170.5 | 68.6 | 152.6 | 0 | 110.7 | K41 G43 D61 C71 C79 V80 P82 | K41-K69 HydrophobicContact CB-CD 4.45Å; K41-K69 HydrophobicContact CB-CG 3.98Å; K41-K69 WeakPolarHBondContact O-CE 3.37Å; K41-K69 PolarHBondContact O-NZ 3.26Å; G43-K69 PolarHBondContact O-NZ 3.36Å; D61-K69 WeakPolarHBondContact OD1-CA 3.37Å; D61-K69 WeakPolarHBondContact OD1-CB 3.48Å; D61-K69 VanDerWaalsContact OD2-CE 3.27Å; D61-K69 WeakPolarHBondContact OD2-CE 3.04Å; D61-K69 IonicContact OD2-NZ 3.92Å; K69-C71 VanDerWaalsContact CB-SG 3.58Å; K69-C71 PolarHBondContact O-N 2.93Å; K69-C79 WeakPolarHBondContact O-CA 3.46Å; K69-V80 PolarHBondContact N-O 3.45Å; K69-V80 PolarHBondContact O-N 3.21Å; K69-P82 HydrophobicContact CD-CB 3.69Å; K69-P82 HydrophobicContact CD-CG 4.21Å; K69-P82 HydrophobicContact CG-CB 3.95Å; K69-P82 HydrophobicContact CG-CG 4.08Å |
| 70 | C | 97.1 | Very high | 94.8 | Very high | 22 Ų | 22 | 63.3 Ų | 63.3 | 15% | 0.149 | 33% | 0.329 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -80.7 | 101.3 | 174.6 | -173.3 | 0 | 0 | 0 | 0 | 108.6 | C58 N60 D61 I77 | C58-C70 HydrophobicContact CB-CB 3.89Å; C58-C70 WeakPolarHBondContact CB-SG 3.27Å; C58-C70 PolarHBondContact O-SG 2.93Å; C58-C70 WeakPolarHBondContact SG-CA 3.48Å; C58-C70 WeakPolarHBondContact SG-CB 3.41Å; C58-C70 CovalentContact SG-SG 2.04Å; C58-C70 PolarHBondContact SG-SG 3.25Å; N60-C70 VanDerWaalsContact C-CB 3.45Å; D61-C70 PolarHBondContact OD1-N 3.48Å; C70-I77 WeakPolarHBondContact SG-CG2 3.46Å |
| 71 | C | 95.9 | Very high | 94.8 | Very high | 2 Ų | 2 | 66 Ų | 66 | 1% | 0.014 | 34% | 0.342 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -118 | 150.2 | -168.8 | -65.6 | 0 | 0 | 0 | 0 | 111.3 | C45 K69 F73 I77 T78 V80 | C45-C71 WeakPolarHBondContact CA-SG 3.47Å; C45-C71 HydrophobicContact CB-CB 3.65Å; C45-C71 WeakPolarHBondContact CB-SG 3.03Å; C45-C71 VanDerWaalsContact SG-CA 3.51Å; C45-C71 WeakPolarHBondContact SG-CB 3.49Å; C45-C71 CovalentContact SG-SG 2.03Å; C45-C71 PolarHBondContact SG-SG 3.33Å; K69-C71 VanDerWaalsContact CB-SG 3.58Å; K69-C71 PolarHBondContact O-N 2.93Å; C71-F73 PolarHBondContact O-N 3.33Å; C71-I77 WeakPolarHBondContact O-CA 3.27Å; C71-T78 PolarHBondContact N-O 2.82Å; C71-T78 PolarHBondContact O-N 3.29Å; C71-V80 HydrophobicContact CB-CB 4.19Å; C71-V80 HydrophobicContact CB-CG2 4.09Å |
| 72 | H | 94.7 | Very high | 94.7 | Very high | 47 Ų | 47 | 66 Ų | 66 | 22% | 0.218 | 34% | 0.343 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -73.3 | 123.1 | 166 | -162.7 | -112.7 | 0 | 0 | 0 | 108.8 | T48 L51 V53 R74 | T48-H72 VanDerWaalsContact CG2-O 3.23Å; T48-H72 WeakPolarHBondContact CG2-O 3.23Å; T48-H72 PolarHBondContact OG1-O 2.75Å; L51-H72 PolarHBondContact O-CE1 3.31Å; L51-H72 PolarHBondContact O-NE2 2.96Å; V53-H72 VanDerWaalsContact CG2-CD2 3.44Å; V53-H72 WeakPolarHBondContact CG2-CD2 3.18Å; V53-H72 WeakPolarHBondContact CG2-NE2 3.4Å; H72-R74 PolarHBondContact CE1-O 3.42Å; H72-R74 PolarHBondContact NE2-O 3.46Å |
| 73 | F | 91.3 | Very high | 94.4 | Very high | 84 Ų | 84 | 64.8 Ų | 64.8 | 37% | 0.368 | 34% | 0.338 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -133 | 104 | 177.3 | -164 | -103.4 | 0 | 0 | 0 | 110.3 | P46 T48 C71 S75 L76 T78 V80 | P46-F73 HydrophobicContact CG-CD2 4.35Å; T48-F73 HydrophobicContact CG2-CD2 3.97Å; C71-F73 PolarHBondContact O-N 3.33Å; F73-S75 PolarHBondContact O-N 2.99Å; F73-L76 CarbonylContact C-O 3.59Å; F73-L76 PolarHBondContact N-O 3.41Å; F73-L76 WeakPolarHBondContact O-CB 3.39Å; F73-L76 PolarHBondContact O-N 3.31Å; F73-T78 HydrophobicContact CB-CG2 3.99Å; F73-V80 HydrophobicContact CB-CG2 4.41Å |
| 74 | R | 87.9 | Confident | 93.8 | Very high | 166 Ų | 166 | 64 Ų | 64 | 63% | 0.626 | 35% | 0.345 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 57.2 | -115.4 | -172.2 | -57.9 | 179.1 | 173 | -179.7 | -2.9 | 110.9 | L51 H72 | L51-R74 HydrophobicContact CD1-CB 4.49Å; H72-R74 PolarHBondContact CE1-O 3.42Å; H72-R74 PolarHBondContact NE2-O 3.46Å |
| 75 | S | 91.3 | Very high | 92.2 | Very high | 43 Ų | 43 | 70.7 Ų | 70.7 | 30% | 0.301 | 37% | 0.369 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -95.8 | 4.5 | 177.7 | 49.9 | 0 | 0 | 0 | 0 | 113.3 | V53 T54 F73 | V53-S75 CarbonylContact C-O 3.6Å; V53-S75 WeakPolarHBondContact CA-O 3.33Å; T54-S75 PolarHBondContact N-O 3.05Å; T54-S75 PolarHBondContact OG1-O 2.99Å; F73-S75 PolarHBondContact O-N 2.99Å |
| 76 | L | 94.2 | Very high | 90.2 | Very high | 60 Ų | 60 | 74.7 Ų | 74.7 | 31% | 0.314 | 38% | 0.382 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.8 | 147.4 | -173.4 | -68.4 | 144.3 | 0 | 0 | 0 | 110.6 | V55 F73 | V55-L76 HydrophobicContact CB-CD2 3.63Å; V55-L76 HydrophobicContact CG1-CD2 3.87Å; V55-L76 HydrophobicContact CG2-CD2 4.45Å; V55-L76 WeakPolarHBondContact O-CA 3.31Å; F73-L76 CarbonylContact C-O 3.59Å; F73-L76 PolarHBondContact N-O 3.41Å; F73-L76 WeakPolarHBondContact O-CB 3.39Å; F73-L76 PolarHBondContact O-N 3.31Å |
| 77 | I | 96 | Very high | 88.3 | Confident | 31 Ų | 31 | 73.5 Ų | 73.5 | 16% | 0.159 | 37% | 0.372 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.9 | 109.6 | 161.6 | -65.2 | 179.3 | 0 | 0 | 0 | 107.2 | V53 V55 R56 E57 C58 C70 C71 | V53-I77 HydrophobicContact CG1-CD1 3.85Å; V53-I77 HydrophobicContact CG1-CG1 3.77Å; V53-I77 HydrophobicContact CG2-CD1 3.85Å; V53-I77 HydrophobicContact CG2-CG1 3.98Å; V55-I77 PolarHBondContact O-N 3.2Å; R56-I77 HydrophobicContact CB-CB 4.43Å; R56-I77 HydrophobicContact CG-CB 4.35Å; R56-I77 HydrophobicContact CG-CD1 4.01Å; R56-I77 HydrophobicContact CG-CG1 4.45Å; E57-I77 WeakPolarHBondContact CB-O 3.4Å; E57-I77 PolarHBondContact N-O 2.96Å; C58-I77 VanDerWaalsContact O-CG2 3.27Å; C58-I77 WeakPolarHBondContact O-CG2 3.02Å; C70-I77 WeakPolarHBondContact SG-CG2 3.46Å; C71-I77 WeakPolarHBondContact O-CA 3.27Å |
| 78 | T | 96.9 | Very high | 86.5 | Confident | 30 Ų | 30 | 71 Ų | 71 | 18% | 0.184 | 37% | 0.368 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -138.5 | 165.7 | -172.9 | -171.8 | 0 | 0 | 0 | 0 | 111.5 | E57 C58 C71 F73 V80 | E57-T78 WeakPolarHBondContact OE2-CB 2.97Å; E57-T78 PolarHBondContact OE2-OG1 3.13Å; C58-T78 VanDerWaalsContact SG-C 3.55Å; C71-T78 PolarHBondContact N-O 2.82Å; C71-T78 PolarHBondContact O-N 3.29Å; F73-T78 HydrophobicContact CB-CG2 3.99Å; T78-V80 HydrophobicContact CG2-CG2 3.82Å |
| 79 | C | 97.4 | Very high | 84.6 | Confident | 34 Ų | 34 | 74.4 Ų | 74.4 | 23% | 0.23 | 39% | 0.388 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.5 | 119.3 | 177.5 | -64.2 | 0 | 0 | 0 | 0 | 110.1 | C64 E68 K69 | C64-C79 WeakPolarHBondContact CA-SG 3.41Å; C64-C79 HydrophobicContact CB-CB 3.65Å; C64-C79 WeakPolarHBondContact CB-SG 3.33Å; C64-C79 WeakPolarHBondContact SG-CA 2.99Å; C64-C79 WeakPolarHBondContact SG-CB 3.42Å; C64-C79 CovalentContact SG-SG 2.04Å; C64-C79 PolarHBondContact SG-SG 3.19Å; E68-C79 HydrophobicContact CB-CB 4.19Å; E68-C79 WeakPolarHBondContact OE2-CB 3.01Å; K69-C79 WeakPolarHBondContact O-CA 3.46Å |
| 80 | V | 95.6 | Very high | 82.8 | Confident | 32 Ų | 32 | 85.2 Ų | 85.2 | 19% | 0.194 | 43% | 0.428 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.4 | 140.8 | -177.7 | -172.9 | 0 | 0 | 0 | 0 | 109.4 | P46 E68 K69 C71 F73 T78 P82 | P46-V80 HydrophobicContact CG-CG1 4.07Å; E68-V80 WeakPolarHBondContact CA-O 3.38Å; K69-V80 PolarHBondContact N-O 3.45Å; K69-V80 PolarHBondContact O-N 3.21Å; C71-V80 HydrophobicContact CB-CB 4.19Å; C71-V80 HydrophobicContact CB-CG2 4.09Å; F73-V80 HydrophobicContact CB-CG2 4.41Å; T78-V80 HydrophobicContact CG2-CG2 3.82Å; V80-P82 WeakPolarHBondContact O-CD 3.13Å; V80-P82 VanDerWaalsContact O-N 3.17Å |
| 81 | I | 94 | Very high | 80.9 | Confident | 126 Ų | 126 | 86.5 Ų | 86.5 | 65% | 0.646 | 44% | 0.444 | S | S | * | . | trans | -61.9 | 117.9 | 171.3 | -61.2 | 173.8 | 0 | 0 | 0 | 107.7 | E68 | E68-I81 HydrophobicContact CG-CG1 4.04Š| ||
| 82 | P | 93.9 | Very high | 79.1 | Confident | 21 Ų | 21 | 93.4 Ų | 93.4 | 14% | 0.136 | 48% | 0.481 | C | S | . | . | trans | -64.5 | 146.1 | -178.1 | 27.7 | -34.8 | 0 | 0 | 0 | 109.8 | E42 F44 K67 K69 V80 A84 | E42-P82 WeakPolarHBondContact O-CG 3.34Å; F44-P82 WeakPolarHBondContact O-CA 3.44Å; K67-P82 WeakPolarHBondContact O-CD 3.45Å; K67-P82 WeakPolarHBondContact O-CG 3.47Å; K69-P82 HydrophobicContact CD-CB 3.69Å; K69-P82 HydrophobicContact CD-CG 4.21Å; K69-P82 HydrophobicContact CG-CB 3.95Å; K69-P82 HydrophobicContact CG-CG 4.08Å; V80-P82 WeakPolarHBondContact O-CD 3.13Å; V80-P82 VanDerWaalsContact O-N 3.17Å; P82-A84 PolarHBondContact O-N 3.34Å | ||
| 83 | K | 91.2 | Very high | 77.5 | Confident | 124 Ų | 124 | 95.4 Ų | 95.4 | 54% | 0.539 | 51% | 0.506 | S | S | . | . | B | Isolated β-bridge | trans | -65.6 | 111.2 | 162.7 | -68.3 | -172.6 | 176.8 | -175.7 | 0 | 105.7 | F44 R85 | F44-K83 PolarHBondContact N-O 3.24Å; F44-K83 PolarHBondContact O-N 2.95Å; K83-R85 PolarHBondContact O-N 3.03Å |
| 84 | A | 82.8 | Confident | 76.2 | Confident | 78 Ų | 78 | 98.9 Ų | 98.9 | 65% | 0.645 | 53% | 0.528 | S | S | * | . | trans | -48.2 | 143.1 | 164.6 | 0 | 0 | 0 | 0 | 0 | 106.8 | P82 M86 | P82-A84 PolarHBondContact O-N 3.34Å; A84-M86 PolarHBondContact O-N 3.4Å | ||
| 85 | R | 63.2 | Low | 74.9 | Confident | 147 Ų | 147 | 95 Ų | 95 | 56% | 0.555 | 53% | 0.532 | S | S | * | . | trans | -56.4 | 96.6 | 178 | -64.2 | -161.4 | 170.4 | 175.2 | -2.1 | 107.8 | F44 K83 A87 D88 | F44-R85 HydrophobicContact CD2-CG 3.92Å; F44-R85 HydrophobicContact CE2-CG 3.57Å; F44-R85 VanDerWaalsContact CE2-NE 3.34Å; K83-R85 PolarHBondContact O-N 3.03Å; R85-A87 PolarHBondContact O-N 3.35Å; R85-A87 VanDerWaalsContact O-N 3.1Å; R85-D88 IonicContact NH1-OD2 2.85Å | ||
| 86 | M | 53.8 | Low | 73.4 | Confident | 167 Ų | 167 | 100.8 Ų | 100.8 | 82% | 0.823 | 56% | 0.559 | S | S | * | * | S | Bend | trans | -58.1 | 113.5 | 155.9 | -66.4 | 178.9 | 168.7 | 0 | 0 | 102.9 | A84 | A84-M86 PolarHBondContact O-N 3.4Š|
| 87 | A | 53.5 | Low | 72 | Confident | 70 Ų | 70 | 103 Ų | 103 | 58% | 0.579 | 58% | 0.577 | S | S | * | * | trans | 81.4 | 76.6 | -178 | 0 | 0 | 0 | 0 | 0 | 117.4 | R85 | R85-A87 PolarHBondContact O-N 3.35Å; R85-A87 VanDerWaalsContact O-N 3.1Å | ||
| 88 | D | 53.9 | Low | 70.3 | Confident | 128 Ų | 128 | 106.3 Ų | 106.3 | 68% | 0.684 | 61% | 0.609 | S | S | * | * | -111.7 | 28.4 | 109.9 | -76 | -48.2 | 0 | 0 | 0 | 110.2 | R85 R90 | R85-D88 IonicContact NH1-OD2 2.85Å; D88-R90 PolarHBondContact O-N 2.95Å | |||
| 89 | D | 54.7 | Low | 68.4 | Low | 124 Ų | 124 | 107.6 Ų | 107.6 | 66% | 0.663 | 63% | 0.627 | S | S | * | * | trans | -62.5 | 59.1 | 166.2 | -82.7 | -59.7 | 0 | 0 | 0 | 112.2 | ||||
| 90 | R | 59.3 | Low | 66.4 | Low | 254 Ų | 254 | 114 Ų | 114 | 96% | 0.958 | 66% | 0.658 | S | S | * | * | S | Bend | trans | -115.4 | 12.2 | 158 | -82.1 | -167.2 | -166.5 | 169 | 5.8 | 112.8 | D88 | D88-R90 PolarHBondContact O-N 2.95Š|
| 91 | G | 56.9 | Low | 64.4 | Low | 48 Ų | 48 | 119.1 Ų | 119.1 | 50% | 0.495 | 68% | 0.684 | S | S | . | * | S | Bend | trans | -164.5 | 127.2 | 171.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||
| 92 | D | 59.3 | Low | 62.7 | Low | 147 Ų | 147 | 121 Ų | 121 | 79% | 0.786 | 69% | 0.687 | S | S | * | * | trans | 79.7 | 63.3 | 170.1 | -47.1 | -45.9 | 0 | 0 | 0 | 117.1 | D94 | D92-D94 PolarHBondContact O-N 3.02Š| ||
| 93 | A | 61.5 | Low | 61 | Low | 89 Ų | 89 | 126.8 Ų | 126.8 | 74% | 0.736 | 72% | 0.718 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67 | 13.7 | 166.1 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||
| 94 | D | 62.7 | Low | 59.4 | Low | 157 Ų | 157 | 125 Ų | 125 | 84% | 0.84 | 72% | 0.717 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -110.7 | 11.5 | -169.6 | -71 | -47.3 | 0 | 0 | 0 | 115.1 | D92 | D92-D94 PolarHBondContact O-N 3.02Š|
| 95 | A | 60.3 | Low | 58.2 | Low | 86 Ų | 86 | 128.9 Ų | 128.9 | 71% | 0.711 | 72% | 0.722 | S | S | * | * | trans | -135.2 | 53.8 | -179.1 | 0 | 0 | 0 | 0 | 0 | 114.2 | P97 | A95-P97 VanDerWaalsContact O-CD 3.32Å; A95-P97 WeakPolarHBondContact O-CD 3.47Å | ||
| 96 | L | 61.2 | Low | 57.8 | Low | 164 Ų | 164 | 131.5 Ų | 131.5 | 86% | 0.859 | 73% | 0.732 | S | S | * | * | trans | -73.4 | 116.1 | 157.2 | -103.6 | 148 | 0 | 0 | 0 | 108.3 | A98 | L96-A98 PolarHBondContact O-N 3.01Š| ||
| 97 | P | 63.4 | Low | 58.1 | Low | 107 Ų | 107 | 128.1 Ų | 128.1 | 70% | 0.695 | 72% | 0.72 | S | S | * | * | trans | -65.2 | 111.7 | 171.8 | 26.2 | -31.6 | 0 | 0 | 0 | 108.3 | A95 G99 | A95-P97 VanDerWaalsContact O-CD 3.32Å; A95-P97 WeakPolarHBondContact O-CD 3.47Å; P97-G99 PolarHBondContact O-N 3.1Å | ||
| 98 | A | 60.6 | Low | 58.4 | Low | 100 Ų | 100 | 132 Ų | 132 | 83% | 0.826 | 73% | 0.726 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.1 | 22.8 | 176.2 | 0 | 0 | 0 | 0 | 0 | 114.5 | L96 | L96-A98 PolarHBondContact O-N 3.01Š|
| 99 | G | 58.3 | Low | 58.9 | Low | 56 Ų | 56 | 132.5 Ų | 132.5 | 58% | 0.577 | 73% | 0.725 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109.9 | -6.6 | -171.4 | 0 | 0 | 0 | 0 | 0 | 115.9 | P97 | P97-G99 PolarHBondContact O-N 3.1Š|
| 100 | L | 54.4 | Low | 59.5 | Low | 168 Ų | 168 | 130 Ų | 130 | 88% | 0.88 | 72% | 0.717 | S | S | * | * | S | Bend | trans | -112.4 | 23.3 | -171.2 | -137.6 | 88.8 | 0 | 0 | 0 | 115.1 | ||
| 101 | L | 53.8 | Low | 60 | Low | 140 Ų | 140 | 121 Ų | 121 | 73% | 0.733 | 69% | 0.693 | S | S | * | * | trans | -135.2 | 36.6 | 179.1 | -133.6 | 117.1 | 0 | 0 | 0 | 112.2 | ||||
| 102 | K | 57.4 | Low | 60.8 | Low | 165 Ų | 165 | 124.4 Ų | 124.4 | 72% | 0.717 | 70% | 0.699 | S | S | * | * | S | Bend | trans | -102.1 | 2.6 | 178.7 | -70.8 | -171.2 | 177.8 | -176.9 | 0 | 115.1 | ||
| 103 | D | 58.8 | Low | 61.6 | Low | 144 Ų | 144 | 122.6 Ų | 122.6 | 77% | 0.77 | 69% | 0.689 | S | S | * | * | S | Bend | trans | -112.1 | -0.3 | 179.6 | -66.3 | -44.2 | 0 | 0 | 0 | 114.4 | ||
| 104 | T | 57.1 | Low | 62.2 | Low | 87 Ų | 87 | 123.6 Ų | 123.6 | 53% | 0.534 | 68% | 0.681 | S | S | . | * | S | Bend | trans | -88 | -16.3 | 177.8 | 26.8 | 0 | 0 | 0 | 0 | 114.7 | R106 | T104-R106 VanDerWaalsContact C-N 3.3Å; T104-R106 PolarHBondContact O-N 2.74Å |
| 105 | E | 57.7 | Low | 62.9 | Low | 159 Ų | 159 | 120 Ų | 120 | 74% | 0.743 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -78 | -13 | 177.3 | -67.5 | -173.7 | 126.5 | 0 | 0 | 113.3 | ||
| 106 | R | 55.1 | Low | 63.8 | Low | 202 Ų | 202 | 122 Ų | 122 | 76% | 0.762 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -81.8 | -16 | 178.9 | -144.7 | 176.7 | -157 | 176.3 | 6 | 114.4 | T104 S110 | T104-R106 VanDerWaalsContact C-N 3.3Å; T104-R106 PolarHBondContact O-N 2.74Å; R106-S110 PolarHBondContact O-OG 2.91Å |
| 107 | V | 60 | Low | 64.5 | Low | 95 Ų | 95 | 118.7 Ų | 118.7 | 58% | 0.576 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -86.3 | -27.2 | -179.5 | -173.1 | 0 | 0 | 0 | 0 | 111.4 | S111 | V107-S111 PolarHBondContact O-N 3.03Å; V107-S111 PolarHBondContact O-OG 2.79Å |
| 108 | E | 60.6 | Low | 65.1 | Low | 151 Ų | 151 | 119.1 Ų | 119.1 | 71% | 0.706 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -74.2 | -36.3 | 173.7 | -74.2 | -143.2 | 122 | 0 | 0 | 112.8 | S110 S111 L112 | E108-S110 VanDerWaalsContact C-N 3.32Å; E108-S110 PolarHBondContact O-N 2.56Å; E108-S111 PolarHBondContact O-N 2.73Å; E108-S111 VanDerWaalsContact O-N 3.17Å; E108-L112 PolarHBondContact O-N 2.94Å; E108-L112 VanDerWaalsContact O-N 3.16Å |
| 109 | E | 63.7 | Low | 65.9 | Low | 140 Ų | 140 | 122.2 Ų | 122.2 | 65% | 0.654 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -64.8 | -35.4 | 174.5 | -79 | -167.8 | 136 | 0 | 0 | 112.8 | S111 L113 | E109-S111 VanDerWaalsContact C-N 3.27Å; E109-S111 PolarHBondContact O-N 2.85Å; E109-L113 PolarHBondContact O-N 3Å |
| 110 | S | 67.9 | Low | 66.7 | Low | 71 Ų | 71 | 125.9 Ų | 125.9 | 50% | 0.497 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -69.4 | -27.7 | 176.4 | -61.6 | 0 | 0 | 0 | 0 | 112.3 | R106 E108 | R106-S110 PolarHBondContact O-OG 2.91Å; E108-S110 VanDerWaalsContact C-N 3.32Å; E108-S110 PolarHBondContact O-N 2.56Å |
| 111 | S | 69.6 | Low | 67.4 | Low | 65 Ų | 65 | 123.2 Ų | 123.2 | 46% | 0.455 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -79.1 | -34.3 | 179.8 | -55.9 | 0 | 0 | 0 | 0 | 112.2 | V107 E108 E109 I114 V115 | V107-S111 PolarHBondContact O-N 3.03Å; V107-S111 PolarHBondContact O-OG 2.79Å; E108-S111 PolarHBondContact O-N 2.73Å; E108-S111 VanDerWaalsContact O-N 3.17Å; E109-S111 VanDerWaalsContact C-N 3.27Å; E109-S111 PolarHBondContact O-N 2.85Å; S111-I114 PolarHBondContact O-N 2.04Å; S111-V115 PolarHBondContact O-N 3.23Å |
| 112 | L | 73.1 | Confident | 67.8 | Low | 119 Ų | 119 | 124.3 Ų | 124.3 | 62% | 0.623 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -69.7 | -32.3 | 176.8 | -81.9 | 165.7 | 0 | 0 | 0 | 113.3 | E108 V115 Q116 | E108-L112 PolarHBondContact O-N 2.94Å; E108-L112 VanDerWaalsContact O-N 3.16Å; L112-V115 PolarHBondContact O-N 3.36Å; L112-Q116 PolarHBondContact O-N 3.05Å; L112-Q116 VanDerWaalsContact O-N 3.1Å |
| 113 | L | 76.2 | Confident | 67.6 | Low | 109 Ų | 109 | 121.5 Ų | 121.5 | 57% | 0.571 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -65.1 | -36.2 | 175.6 | -103.5 | 157.4 | 0 | 0 | 0 | 112.7 | E109 Q116 E117 | E109-L113 PolarHBondContact O-N 3Å; L113-Q116 PolarHBondContact O-N 2.89Å; L113-E117 PolarHBondContact O-N 2.89Å; L113-E117 VanDerWaalsContact O-N 3.13Å |
| 114 | I | 75 | Confident | 67.7 | Low | 111 Ų | 111 | 122.3 Ų | 122.3 | 57% | 0.569 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -68.7 | -37.5 | 177.2 | -61.1 | 171.3 | 0 | 0 | 0 | 110.9 | S111 L118 | S111-I114 PolarHBondContact O-N 2.04Å; I114-L118 HydrophobicContact CG2-CD1 4.19Å; I114-L118 WeakPolarHBondContact O-CG 3.47Å; I114-L118 PolarHBondContact O-N 3.28Å; I114-L118 VanDerWaalsContact O-N 3.13Å |
| 115 | V | 77 | Confident | 67.8 | Low | 82 Ų | 82 | 128 Ų | 128 | 50% | 0.497 | 64% | 0.642 | S | S | . | * | H | α-helix | trans | -70.6 | -33.3 | 177.4 | -180 | 0 | 0 | 0 | 0 | 111.8 | S111 L112 K119 | S111-V115 PolarHBondContact O-N 3.23Å; L112-V115 PolarHBondContact O-N 3.36Å; V115-K119 PolarHBondContact O-N 2.82Å |
| 116 | Q | 78.3 | Confident | 67.5 | Low | 128 Ų | 128 | 124.4 Ų | 124.4 | 60% | 0.598 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -70.1 | -39.4 | 174.9 | -94.8 | -172.7 | -5.5 | 0 | 0 | 113.1 | L112 L113 K119 | L112-Q116 PolarHBondContact O-N 3.05Å; L112-Q116 VanDerWaalsContact O-N 3.1Å; L113-Q116 PolarHBondContact O-N 2.89Å; Q116-K119 PolarHBondContact O-N 3.2Å |
| 117 | E | 77.1 | Confident | 67.5 | Low | 94 Ų | 94 | 118.1 Ų | 118.1 | 44% | 0.439 | 65% | 0.645 | S | S | . | * | H | α-helix | trans | -70.1 | -37 | 177.1 | -75.8 | -58.8 | 131.4 | 0 | 0 | 112.3 | L113 K119 K120 | L113-E117 PolarHBondContact O-N 2.89Å; L113-E117 VanDerWaalsContact O-N 3.13Å; E117-K119 VanDerWaalsContact C-N 3.25Å; E117-K119 PolarHBondContact O-N 2.91Å; E117-K120 PolarHBondContact O-N 3.11Å; E117-K120 IonicContact OE1-NZ 2.73Å; E117-K120 PolarHBondContact OE1-NZ 3.05Å |
| 118 | L | 76.1 | Confident | 67.1 | Low | 116 Ų | 116 | 123.2 Ų | 123.2 | 61% | 0.607 | 66% | 0.66 | S | S | * | * | H | α-helix | trans | -63.5 | -28 | 175.4 | -74.4 | 171.2 | 0 | 0 | 0 | 113.6 | I114 K120 | I114-L118 HydrophobicContact CG2-CD1 4.19Å; I114-L118 WeakPolarHBondContact O-CG 3.47Å; I114-L118 PolarHBondContact O-N 3.28Å; I114-L118 VanDerWaalsContact O-N 3.13Å; L118-K120 VanDerWaalsContact C-N 3.34Å |
| 119 | K | 76 | Confident | 66.8 | Low | 164 Ų | 164 | 122.4 Ų | 122.4 | 71% | 0.713 | 67% | 0.665 | S | S | * | * | H | α-helix | trans | -71.5 | -24.2 | 173.3 | -89.5 | 179.4 | 176.4 | 176.2 | 0 | 113.6 | V115 Q116 E117 | V115-K119 PolarHBondContact O-N 2.82Å; Q116-K119 PolarHBondContact O-N 3.2Å; E117-K119 VanDerWaalsContact C-N 3.25Å; E117-K119 PolarHBondContact O-N 2.91Å |
| 120 | K | 75.8 | Confident | 66.6 | Low | 133 Ų | 133 | 121.9 Ų | 121.9 | 58% | 0.578 | 67% | 0.671 | S | S | * | * | H | α-helix | trans | -80.8 | -19.7 | 179.5 | -65.4 | 176.7 | -171.3 | 166.7 | 0 | 113.2 | E117 L118 Q122 P123 | E117-K120 PolarHBondContact O-N 3.11Å; E117-K120 IonicContact OE1-NZ 2.73Å; E117-K120 PolarHBondContact OE1-NZ 3.05Å; L118-K120 VanDerWaalsContact C-N 3.34Å; K120-Q122 VanDerWaalsContact C-N 3.34Å; K120-P123 WeakPolarHBondContact O-CD 3.24Å |
| 121 | V | 68.2 | Low | 65.8 | Low | 113 Ų | 113 | 121.9 Ų | 121.9 | 69% | 0.685 | 68% | 0.682 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.1 | -2.3 | -179 | -173.8 | 0 | 0 | 0 | 0 | 112.5 | ||
| 122 | Q | 62.8 | Low | 64.7 | Low | 163 Ų | 163 | 124.8 Ų | 124.8 | 76% | 0.762 | 70% | 0.702 | S | S | * | * | trans | -84.5 | 1.2 | -173.4 | -84.9 | -147 | -19.3 | 0 | 0 | 120.1 | K120 L124 | K120-Q122 VanDerWaalsContact C-N 3.34Å; Q122-L124 PolarHBondContact O-N 3.49Å | ||
| 123 | P | 54.1 | Low | 63.5 | Low | 106 Ų | 106 | 122.6 Ų | 122.6 | 69% | 0.688 | 71% | 0.709 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.9 | 62.8 | 177.6 | 39.2 | -30.9 | 0 | 0 | 0 | 112.2 | K120 | K120-P123 WeakPolarHBondContact O-CD 3.24Š|
| 124 | L | 59.8 | Low | 62.3 | Low | 161 Ų | 161 | 124.5 Ų | 124.5 | 84% | 0.843 | 72% | 0.72 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -137.1 | 1.3 | 165.8 | -78.4 | 178.9 | 0 | 0 | 0 | 115 | Q122 | Q122-L124 PolarHBondContact O-N 3.49Š|
| 125 | F | 59.6 | Low | 60.9 | Low | 207 Ų | 207 | 124.4 Ų | 124.4 | 91% | 0.908 | 73% | 0.729 | S | S | * | * | trans | -113.3 | 92.5 | 167.6 | -78.5 | -85.5 | 0 | 0 | 0 | 109.7 | ||||
| 126 | G | 51.7 | Low | 59.5 | Low | 83 Ų | 83 | 130.7 Ų | 130.7 | 86% | 0.856 | 75% | 0.75 | S | S | * | * | trans | -63.5 | 141 | 166.1 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 127 | G | 54.8 | Low | 57.9 | Low | 69 Ų | 69 | 130.3 Ų | 130.3 | 71% | 0.711 | 76% | 0.756 | S | S | * | * | trans | 102.6 | 31.8 | 144.4 | 0 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 128 | F | 52.6 | Low | 56.4 | Low | 203 Ų | 203 | 134.9 Ų | 134.9 | 89% | 0.89 | 78% | 0.775 | S | S | * | * | trans | -107 | 93.7 | 160.6 | -110.7 | -92.4 | 0 | 0 | 0 | 111.6 | V130 | F128-V130 PolarHBondContact O-N 2.81Š| ||
| 129 | T | 52.9 | Low | 55.2 | Low | 133 Ų | 133 | 138.7 Ų | 138.7 | 82% | 0.816 | 79% | 0.786 | S | S | * | * | trans | -71 | 108.1 | 164.3 | 50.7 | 0 | 0 | 0 | 0 | 108.7 | G131 | T129-G131 PolarHBondContact O-N 2.94Š| ||
| 130 | V | 59.9 | Low | 53.7 | Low | 130 Ų | 130 | 138.9 Ų | 138.9 | 79% | 0.788 | 79% | 0.79 | S | S | * | * | trans | -79.9 | 108.6 | 165.7 | -178.7 | 0 | 0 | 0 | 0 | 107.2 | F128 S132 | F128-V130 PolarHBondContact O-N 2.81Å; V130-S132 PolarHBondContact O-N 3.46Å | ||
| 131 | G | 50.9 | Low | 52.9 | Low | 71 Ų | 71 | 140.7 Ų | 140.7 | 73% | 0.732 | 81% | 0.806 | S | S | * | * | trans | -63.3 | 117.9 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | T129 G133 | T129-G131 PolarHBondContact O-N 2.94Å; G131-G133 PolarHBondContact O-N 3.24Å | ||
| 132 | S | 46.1 | Very low | 52.1 | Low | 125 Ų | 125 | 142 Ų | 142 | 87% | 0.874 | 81% | 0.809 | S | S | * | * | trans | -66.9 | 111.5 | 165.5 | -57.3 | 0 | 0 | 0 | 0 | 109.5 | V130 | V130-S132 PolarHBondContact O-N 3.46Š| ||
| 133 | G | 48.5 | Very low | 51.6 | Low | 74 Ų | 74 | 140.1 Ų | 140.1 | 76% | 0.763 | 81% | 0.813 | S | S | * | * | trans | -111.2 | 98.4 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | G131 | G131-G133 PolarHBondContact O-N 3.24Š| ||
| 134 | N | 50.1 | Low | 51.2 | Low | 148 Ų | 148 | 138.4 Ų | 138.4 | 79% | 0.791 | 82% | 0.815 | S | S | * | * | trans | 32.1 | 115.2 | 147.2 | -69.5 | -5 | 0 | 0 | 0 | 121.7 | ||||
| 135 | S | 46.5 | Very low | 50.7 | Low | 110 Ų | 110 | 140.7 Ų | 140.7 | 77% | 0.769 | 82% | 0.818 | S | S | * | * | 29.5 | 107.6 | 114.6 | -57.9 | 0 | 0 | 0 | 0 | 118.3 | |||||
| 136 | F | 48.3 | Very low | 50 | Low | 214 Ų | 214 | 140.6 Ų | 140.6 | 94% | 0.939 | 82% | 0.818 | S | S | * | * | trans | -126.3 | 104.7 | 152.8 | -131.5 | -96.1 | 0 | 0 | 0 | 109.4 | ||||
| 137 | T | 44.1 | Very low | 49.9 | Very low | 119 Ų | 119 | 143.1 Ų | 143.1 | 73% | 0.73 | 82% | 0.816 | S | S | * | * | trans | -87.5 | 148.5 | 170.6 | 50.4 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 138 | K | 46.1 | Very low | 49.1 | Very low | 191 Ų | 191 | 144.4 Ų | 144.4 | 83% | 0.83 | 81% | 0.814 | S | S | * | * | trans | 86.5 | 111.3 | 146.4 | -136 | 173.7 | -171 | 171.9 | 0 | 116.9 | ||||
| 139 | K | 50.9 | Low | 48.9 | Very low | 195 Ų | 195 | 145.9 Ų | 145.9 | 85% | 0.848 | 81% | 0.814 | S | S | * | * | -174.8 | 137.5 | 93.3 | -93.9 | 176.7 | -178.2 | 177.5 | 0 | 111.2 | |||||
| 140 | H | 43.3 | Very low | 48.6 | Very low | 169 Ų | 169 | 146.7 Ų | 146.7 | 78% | 0.782 | 81% | 0.813 | S | S | * | * | trans | -61.8 | 146.5 | 167 | -91.7 | -114.4 | 0 | 0 | 0 | 110.9 | ||||
| 141 | D | 60 | Low | 47.4 | Very low | 171 Ų | 171 | 146.6 Ų | 146.6 | 91% | 0.914 | 82% | 0.817 | S | S | * | * | trans | -144.2 | 133.7 | 134.9 | -91 | -49.7 | 0 | 0 | 0 | 110.3 | ||||
| 142 | D | 50.6 | Low | 47 | Very low | 140 Ų | 140 | 147.6 Ų | 147.6 | 75% | 0.749 | 82% | 0.818 | S | S | * | * | trans | -88.4 | 134.3 | -173.2 | -136.9 | -60.5 | 0 | 0 | 0 | 109.2 | ||||
| 143 | S | 52.4 | Low | 47 | Very low | 123 Ų | 123 | 147.7 Ų | 147.7 | 86% | 0.86 | 82% | 0.816 | S | S | * | * | trans | -171.7 | 108.9 | 152.3 | 22.1 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 144 | G | 45.9 | Very low | 47 | Very low | 70 Ų | 70 | 151.1 Ų | 151.1 | 72% | 0.722 | 82% | 0.821 | S | S | * | * | trans | -80.3 | 170.8 | -172.4 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 145 | K | 48.6 | Very low | 46.7 | Very low | 210 Ų | 210 | 148.3 Ų | 148.3 | 91% | 0.913 | 82% | 0.819 | S | S | * | * | trans | -159.8 | 113.8 | 140.1 | -124.6 | 170.3 | -176.9 | 175.5 | 0 | 110.2 | ||||
| 146 | K | 44.9 | Very low | 46.3 | Very low | 205 Ų | 205 | 147.3 Ų | 147.3 | 89% | 0.891 | 82% | 0.818 | S | S | * | * | trans | -82.7 | 131.5 | 166.6 | -72.2 | 177.3 | 176.9 | 177.3 | 0 | 108.8 | ||||
| 147 | V | 49.7 | Very low | 46.2 | Very low | 136 Ų | 136 | 144.9 Ų | 144.9 | 82% | 0.824 | 81% | 0.813 | S | S | * | * | trans | -137.3 | 115.1 | 149.4 | 180 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 148 | S | 38.2 | Very low | 45.9 | Very low | 96 Ų | 96 | 142 Ų | 142 | 67% | 0.671 | 81% | 0.807 | S | S | * | * | trans | -102.1 | 133.9 | 171.5 | 170.4 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 149 | R | 48 | Very low | 46 | Very low | 233 Ų | 233 | 141.9 Ų | 141.9 | 88% | 0.879 | 81% | 0.809 | S | S | * | * | trans | -146.9 | 97.8 | 156 | -75.1 | -164.6 | -176.6 | 161.4 | 1.5 | 110.9 | ||||
| 150 | N | 47 | Very low | 45.6 | Very low | 150 Ų | 150 | 139.5 Ų | 139.5 | 80% | 0.802 | 80% | 0.804 | S | S | * | * | 40.1 | 128.5 | 125.8 | -63 | -6.7 | 0 | 0 | 0 | 121.6 | |||||
| 151 | C | 34.6 | Very low | 45.5 | Very low | 129 Ų | 129 | 140.8 Ų | 140.8 | 87% | 0.872 | 81% | 0.807 | S | S | * | * | trans | -62.2 | 151.5 | 164 | -61.4 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 152 | A | 43.5 | Very low | 44.3 | Very low | 92 Ų | 92 | 137.9 Ų | 137.9 | 76% | 0.76 | 80% | 0.8 | S | S | * | * | -174.8 | 132 | 126.7 | 0 | 0 | 0 | 0 | 0 | 110.4 | |||||
| 153 | P | 45.5 | Very low | 44.1 | Very low | 126 Ų | 126 | 136.7 Ų | 136.7 | 82% | 0.818 | 80% | 0.798 | S | S | * | * | trans | -98.1 | 141.6 | 163.6 | 35 | -25.4 | 0 | 0 | 0 | 110.3 | ||||
| 154 | V | 48 | Very low | 43.2 | Very low | 146 Ų | 146 | 136.6 Ų | 136.6 | 89% | 0.885 | 79% | 0.793 | S | S | * | * | trans | -133.6 | 140.9 | 169.1 | -175.8 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 155 | A | 44.3 | Very low | 43.2 | Very low | 90 Ų | 90 | 141.9 Ų | 141.9 | 74% | 0.744 | 80% | 0.798 | S | S | * | * | trans | -58.4 | 150.4 | -166.1 | 0 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 156 | A | 38.9 | Very low | 42.7 | Very low | 89 Ų | 89 | 137.6 Ų | 137.6 | 74% | 0.736 | 79% | 0.794 | S | S | * | * | trans | 14.8 | 144.6 | 131.1 | 0 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 157 | I | 45.8 | Very low | 42.6 | Very low | 163 Ų | 163 | 131.5 Ų | 131.5 | 84% | 0.836 | 79% | 0.79 | S | S | * | * | trans | 151.8 | 105.7 | 146.7 | -75 | 151.4 | 0 | 0 | 0 | 103.5 | ||||
| 158 | G | 38 | Very low | 42.1 | Very low | 59 Ų | 59 | 128.7 Ų | 128.7 | 61% | 0.608 | 79% | 0.788 | S | S | * | * | cis | 87 | 93.9 | 48.8 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 159 | H | 47 | Very low | 42.3 | Very low | 188 Ų | 188 | 128.5 Ų | 128.5 | 87% | 0.87 | 79% | 0.793 | S | S | * | * | trans | -166.1 | 130.5 | 150.7 | -97.5 | -63.3 | 0 | 0 | 0 | 113.1 | ||||
| 160 | I | 43 | Very low | 42 | Very low | 144 Ų | 144 | 125.2 Ų | 125.2 | 74% | 0.738 | 79% | 0.787 | S | S | * | * | trans | -74.7 | 139.6 | 176.4 | -65.4 | 153.6 | 0 | 0 | 0 | 109.7 | ||||
| 161 | F | 41.3 | Very low | 41.9 | Very low | 196 Ų | 196 | 130 Ų | 130 | 86% | 0.86 | 79% | 0.794 | S | S | * | * | trans | -157.4 | 113.5 | 146.2 | -111.3 | -79.2 | 0 | 0 | 0 | 111.2 | V163 | F161-V163 HydrophobicContact CD1-CG2 4.13Š| ||
| 162 | S | 36 | Very low | 42.5 | Very low | 110 Ų | 110 | 130.8 Ų | 130.8 | 77% | 0.769 | 79% | 0.789 | S | S | * | * | trans | -89.7 | 133.6 | 160.4 | -60.1 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 163 | V | 45.2 | Very low | 42.6 | Very low | 116 Ų | 116 | 130 Ų | 130 | 70% | 0.703 | 78% | 0.783 | S | S | * | * | trans | -141.7 | 109.2 | 159 | -179.5 | 0 | 0 | 0 | 0 | 108.8 | F161 | F161-V163 HydrophobicContact CD1-CG2 4.13Š| ||
| 164 | T | 33.4 | Very low | 42.8 | Very low | 121 Ų | 121 | 134 Ų | 134 | 74% | 0.742 | 79% | 0.787 | S | S | * | * | trans | -69.1 | 138.8 | 156.4 | 44.4 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 165 | H | 45.9 | Very low | 43.1 | Very low | 180 Ų | 180 | 133 Ų | 133 | 83% | 0.833 | 79% | 0.787 | S | S | * | * | trans | -160.6 | 123.3 | 143.8 | -93.4 | -66.3 | 0 | 0 | 0 | 111.7 | ||||
| 166 | S | 39.4 | Very low | 43.3 | Very low | 120 Ų | 120 | 137.8 Ų | 137.8 | 84% | 0.839 | 79% | 0.794 | S | S | * | * | trans | -75.3 | 150.1 | 164.1 | 44.7 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 167 | G | 41.7 | Very low | 43.7 | Very low | 78 Ų | 78 | 137.9 Ų | 137.9 | 80% | 0.804 | 80% | 0.795 | S | S | * | * | trans | 142.6 | 112.3 | 168.2 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 168 | G | 39.2 | Very low | 44.3 | Very low | 76 Ų | 76 | 138 Ų | 138 | 78% | 0.784 | 80% | 0.797 | S | S | * | * | 121.7 | 106.3 | 81.1 | 0 | 0 | 0 | 0 | 0 | 106.5 | |||||
| 169 | A | 42.5 | Very low | 44.8 | Very low | 93 Ų | 93 | 143.1 Ų | 143.1 | 77% | 0.769 | 81% | 0.805 | S | S | * | * | 77.5 | 122.9 | 100.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | |||||
| 170 | E | 42 | Very low | 44.7 | Very low | 163 Ų | 163 | 143.7 Ų | 143.7 | 76% | 0.762 | 81% | 0.805 | S | S | * | * | trans | 56.5 | 113.5 | 151.8 | -74.9 | 178.9 | 93.5 | 0 | 0 | 120.3 | ||||
| 171 | R | 45.6 | Very low | 45 | Very low | 252 Ų | 252 | 141.3 Ų | 141.3 | 95% | 0.951 | 81% | 0.807 | S | S | * | * | -137.7 | 118.4 | 128.4 | -76.3 | -161.9 | 178.2 | -178.4 | -0.5 | 112.4 | |||||
| 172 | L | 46.9 | Very low | 45.5 | Very low | 145 Ų | 145 | 139.3 Ų | 139.3 | 76% | 0.759 | 81% | 0.805 | S | S | * | * | trans | -58.8 | 146.9 | 167.2 | -104.5 | 91.6 | 0 | 0 | 0 | 113.6 | ||||
| 173 | A | 46.1 | Very low | 46.1 | Very low | 76 Ų | 76 | 142 Ų | 142 | 63% | 0.628 | 81% | 0.807 | S | S | * | * | trans | 62.3 | 119.8 | 131.3 | 0 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 174 | K | 49.7 | Very low | 46.2 | Very low | 208 Ų | 208 | 144.7 Ų | 144.7 | 90% | 0.904 | 81% | 0.81 | S | S | * | * | 162 | 119.1 | 106 | -87.5 | 169.2 | -178.9 | 179.2 | 0 | 109.8 | |||||
| 175 | S | 54.1 | Low | 46.9 | Very low | 127 Ų | 127 | 146.1 Ų | 146.1 | 89% | 0.888 | 81% | 0.808 | S | S | * | * | trans | -176.7 | 104.9 | 140.4 | 179.6 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 176 | Q | 48.4 | Very low | 47.1 | Very low | 189 Ų | 189 | 144.9 Ų | 144.9 | 88% | 0.883 | 81% | 0.808 | S | S | * | * | trans | -101.2 | 159.5 | 168.5 | -80.9 | -172.6 | -1.1 | 0 | 0 | 109.4 | ||||
| 177 | A | 47 | Very low | 47.4 | Very low | 92 Ų | 92 | 144.5 Ų | 144.5 | 76% | 0.76 | 81% | 0.805 | S | S | * | * | trans | 83 | 105 | 151.6 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 178 | N | 58.2 | Low | 47.8 | Very low | 166 Ų | 166 | 146.9 Ų | 146.9 | 89% | 0.888 | 81% | 0.809 | S | S | * | * | -147.4 | 131 | 112.5 | -119.1 | -9 | 0 | 0 | 0 | 113.3 | |||||
| 179 | E | 48.1 | Very low | 48.1 | Very low | 166 Ų | 166 | 146.3 Ų | 146.3 | 78% | 0.776 | 80% | 0.803 | S | S | * | * | trans | -39.9 | 135.3 | 173.5 | -140.8 | 147.8 | 111.7 | 0 | 0 | 116.2 | ||||
| 180 | K | 44.9 | Very low | 48.3 | Very low | 200 Ų | 200 | 151.9 Ų | 151.9 | 87% | 0.87 | 81% | 0.81 | S | S | * | * | 38.9 | 140.2 | 101.6 | -56.2 | 177.9 | 177 | 176.6 | 0 | 114.3 | |||||
| 181 | A | 48.6 | Very low | 48.3 | Very low | 93 Ų | 93 | 151.5 Ų | 151.5 | 77% | 0.769 | 81% | 0.806 | S | S | * | * | cis | -151.7 | 163.3 | 13.1 | 0 | 0 | 0 | 0 | 0 | 106 | ||||
| 182 | N | 53.2 | Low | 48.3 | Very low | 155 Ų | 155 | 146 Ų | 146 | 83% | 0.829 | 81% | 0.805 | S | S | * | * | -179.9 | 146.8 | 85.4 | -153 | -9.6 | 0 | 0 | 0 | 110 | |||||
| 183 | M | 48.3 | Very low | 48.1 | Very low | 165 Ų | 165 | 144.8 Ų | 144.8 | 81% | 0.813 | 80% | 0.799 | S | S | * | * | trans | -61.9 | 158.2 | 170.4 | -61.8 | 174 | 145.7 | 0 | 0 | 109.9 | ||||
| 184 | K | 47.9 | Very low | 48.4 | Very low | 173 Ų | 173 | 150.5 Ų | 150.5 | 75% | 0.752 | 81% | 0.813 | S | S | * | * | 177.2 | 151.4 | 64 | -143 | 171.7 | -178.6 | -177.5 | 0 | 109 | |||||
| 185 | E | 46.4 | Very low | 47.8 | Very low | 151 Ų | 151 | 147.5 Ų | 147.5 | 71% | 0.706 | 81% | 0.812 | S | S | * | * | trans | 7.2 | 135.6 | 147.6 | -57.6 | 173.6 | 129.6 | 0 | 0 | 117.4 | ||||
| 186 | D | 52 | Low | 47.4 | Very low | 155 Ų | 155 | 145.3 Ų | 145.3 | 83% | 0.829 | 80% | 0.801 | S | S | * | * | -167.9 | 147.3 | 77.2 | -94.5 | -52.1 | 0 | 0 | 0 | 113.5 | |||||
| 187 | S | 45.1 | Very low | 47.3 | Very low | 111 Ų | 111 | 144.8 Ų | 144.8 | 78% | 0.776 | 80% | 0.799 | S | S | * | * | trans | -83.3 | 134.3 | 171.7 | 61 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 188 | S | 49.5 | Very low | 47.5 | Very low | 128 Ų | 128 | 149.5 Ų | 149.5 | 90% | 0.895 | 81% | 0.807 | S | S | * | * | trans | 179.1 | 145.3 | 147.5 | 60.7 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 189 | G | 45.8 | Very low | 46.5 | Very low | 64 Ų | 64 | 148.3 Ų | 148.3 | 66% | 0.66 | 81% | 0.807 | S | S | * | * | cis | 175.6 | 159 | 1.4 | 0 | 0 | 0 | 0 | 0 | 107 | ||||
| 190 | K | 47.3 | Very low | 46.6 | Very low | 210 Ų | 210 | 145.1 Ų | 145.1 | 91% | 0.913 | 81% | 0.808 | S | S | * | * | trans | 48.4 | 145.9 | 140.7 | -67.2 | 177 | -179.9 | 177.1 | 0 | 119.1 | ||||
| 191 | K | 40.5 | Very low | 46.5 | Very low | 155 Ų | 155 | 145.6 Ų | 145.6 | 67% | 0.674 | 81% | 0.81 | S | S | * | * | cis | 172.3 | 126.8 | -6.6 | -169.8 | 175.7 | -170.7 | -111.5 | 0 | 101.5 | D193 | K191-D193 IonicContact NZ-OD1 3.61Å; K191-D193 IonicContact NZ-OD2 3.93Å; K191-D193 PolarHBondContact NZ-OD2 3.36Å | ||
| 192 | C | 45.7 | Very low | 46.5 | Very low | 138 Ų | 138 | 153.1 Ų | 153.1 | 93% | 0.932 | 82% | 0.819 | S | S | * | * | trans | -123.8 | 95 | 169.7 | -79.4 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 193 | D | 43.2 | Very low | 46.3 | Very low | 118 Ų | 118 | 155.4 Ų | 155.4 | 63% | 0.631 | 82% | 0.822 | S | S | * | * | trans | -74.3 | 129.2 | 160.5 | -72.2 | -58.6 | 0 | 0 | 0 | 108.4 | K191 | K191-D193 IonicContact NZ-OD1 3.61Å; K191-D193 IonicContact NZ-OD2 3.93Å; K191-D193 PolarHBondContact NZ-OD2 3.36Å | ||
| 194 | Q | 52.9 | Low | 45.8 | Very low | 197 Ų | 197 | 153.2 Ų | 153.2 | 92% | 0.921 | 82% | 0.822 | S | S | * | * | trans | -141.1 | 103.6 | 151.3 | -74.2 | -165.8 | 10.1 | 0 | 0 | 109.6 | ||||
| 195 | T | 37.8 | Very low | 45.9 | Very low | 145 Ų | 145 | 150 Ų | 150 | 89% | 0.89 | 82% | 0.822 | S | S | * | * | trans | -140.1 | 110.1 | 162.7 | -60.1 | 0 | 0 | 0 | 0 | 106 | ||||
| 196 | A | 45.6 | Very low | 45.5 | Very low | 80 Ų | 80 | 150 Ų | 150 | 66% | 0.661 | 83% | 0.832 | S | S | * | * | trans | -175.1 | 120.5 | 154.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 197 | Q | 45.6 | Very low | 45.4 | Very low | 178 Ų | 178 | 149.8 Ų | 149.8 | 83% | 0.832 | 83% | 0.829 | S | S | * | * | trans | 64.3 | 118.6 | 132.7 | -57 | 179.4 | 38.5 | 0 | 0 | 118.5 | ||||
| 198 | M | 51.5 | Low | 45.1 | Very low | 191 Ų | 191 | 148.4 Ų | 148.4 | 94% | 0.941 | 83% | 0.833 | S | S | * | * | -155.1 | 107.3 | 115.7 | -75.8 | -140.9 | 108 | 0 | 0 | 110.2 | |||||
| 199 | T | 37.5 | Very low | 44.9 | Very low | 142 Ų | 142 | 151.4 Ų | 151.4 | 87% | 0.871 | 83% | 0.832 | S | S | * | * | trans | -80.4 | 121.8 | 160.3 | 44.1 | 0 | 0 | 0 | 0 | 109 | ||||
| 200 | A | 49.7 | Very low | 45.1 | Very low | 98 Ų | 98 | 155.2 Ų | 155.2 | 81% | 0.81 | 83% | 0.833 | S | S | * | * | trans | -145.3 | 108.6 | 164.3 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 201 | K | 43.4 | Very low | 45.4 | Very low | 210 Ų | 210 | 150.2 Ų | 150.2 | 91% | 0.913 | 82% | 0.822 | S | S | * | * | trans | -53.5 | 129 | 166.4 | -69 | 168.4 | 173.1 | 174.6 | 0 | 110.2 | ||||
| 202 | R | 47.4 | Very low | 45.9 | Very low | 252 Ų | 252 | 148.3 Ų | 148.3 | 95% | 0.951 | 83% | 0.828 | S | S | * | * | trans | -151 | 147.7 | 151.7 | -110.8 | 172.1 | -169.4 | -165.7 | 2.2 | 112.3 | ||||
| 203 | K | 48.7 | Very low | 47.1 | Very low | 203 Ų | 203 | 146.7 Ų | 146.7 | 88% | 0.883 | 81% | 0.806 | S | S | * | * | trans | -78.5 | 155.9 | -152.4 | -73.2 | 164.6 | 171.1 | 179.7 | 0 | 114.1 | ||||
| 204 | S | 38.5 | Very low | 48.9 | Very low | 118 Ų | 118 | 145.1 Ų | 145.1 | 83% | 0.825 | 80% | 0.8 | S | S | * | * | trans | -49.7 | 142.1 | 171.8 | 58.1 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 205 | S | 48.9 | Very low | 49.7 | Very low | 107 Ų | 107 | 141 Ų | 141 | 75% | 0.748 | 78% | 0.784 | S | S | * | * | trans | -146.1 | 113.4 | 144.5 | 51 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 206 | T | 37.9 | Very low | 51.4 | Low | 149 Ų | 149 | 136.7 Ų | 136.7 | 91% | 0.914 | 76% | 0.763 | S | S | * | * | trans | -56.9 | 120.1 | 170.8 | 18 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 207 | I | 51 | Low | 53 | Low | 151 Ų | 151 | 138 Ų | 138 | 77% | 0.774 | 76% | 0.756 | S | S | * | * | trans | -130 | 123.8 | 159.2 | -59.8 | 177.8 | 0 | 0 | 0 | 105.4 | E209 | I207-E209 PolarHBondContact O-N 3.44Š| ||
| 208 | G | 39.7 | Very low | 54.7 | Low | 82 Ų | 82 | 133.5 Ų | 133.5 | 85% | 0.845 | 74% | 0.736 | S | S | * | * | trans | -67.5 | 112.9 | -175.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 209 | E | 44.1 | Very low | 56 | Low | 191 Ų | 191 | 124.7 Ų | 124.7 | 89% | 0.893 | 69% | 0.694 | S | S | * | * | P | Polyproline II helix | trans | -84.7 | 118 | 166.5 | -85.2 | -177.8 | 117.3 | 0 | 0 | 109.5 | I207 | I207-E209 PolarHBondContact O-N 3.44Š|
| 210 | E | 50.6 | Low | 58.2 | Low | 144 Ų | 144 | 122.6 Ų | 122.6 | 67% | 0.673 | 68% | 0.681 | S | S | * | * | P | Polyproline II helix | trans | -58.2 | 138.8 | 161.4 | -107.9 | -146.7 | 141.1 | 0 | 0 | 108.7 | S212 K213 | E210-S212 PolarHBondContact O-N 3Å; E210-K213 IonicContact OE1-NZ 2.79Å; E210-K213 PolarHBondContact OE1-NZ 3.48Å; E210-K213 IonicContact OE2-NZ 3.99Å; E210-K213 PolarHBondContact OE2-NZ 2.89Å |
| 211 | P | 53.9 | Low | 60.1 | Low | 105 Ų | 105 | 126.9 Ų | 126.9 | 68% | 0.682 | 68% | 0.681 | S | S | * | * | P | Polyproline II helix | trans | -61.1 | 125.5 | 175.7 | 26.3 | -32.5 | 0 | 0 | 0 | 109 | K213 | P211-K213 PolarHBondContact O-N 3.03Š|
| 212 | S | 50.7 | Low | 62.3 | Low | 115 Ų | 115 | 124.4 Ų | 124.4 | 80% | 0.804 | 67% | 0.671 | S | S | * | * | trans | -45.1 | 103.9 | 171.1 | 37.9 | 0 | 0 | 0 | 0 | 109.7 | E210 T214 | E210-S212 PolarHBondContact O-N 3Å; S212-T214 PolarHBondContact O-N 2.66Å | ||
| 213 | K | 70.8 | Confident | 64.2 | Low | 105 Ų | 105 | 115.5 Ų | 115.5 | 46% | 0.457 | 66% | 0.658 | S | S | . | * | trans | -63 | 112 | 177.1 | -69.9 | 174.4 | 177.1 | 115.2 | 0 | 106.9 | E210 P211 | E210-K213 IonicContact OE1-NZ 2.79Å; E210-K213 PolarHBondContact OE1-NZ 3.48Å; E210-K213 IonicContact OE2-NZ 3.99Å; E210-K213 PolarHBondContact OE2-NZ 2.89Å; P211-K213 PolarHBondContact O-N 3.03Å | ||
| 214 | T | 79.5 | Confident | 65.9 | Low | 84 Ų | 84 | 109.6 Ų | 109.6 | 52% | 0.515 | 64% | 0.635 | S | S | . | * | trans | -53.5 | 142.6 | 177.4 | 12.2 | 0 | 0 | 0 | 0 | 109.2 | S212 A216 Q217 I218 | S212-T214 PolarHBondContact O-N 2.66Å; T214-A216 CarbonylContact O-C 3.58Å; T214-A216 PolarHBondContact O-N 3.15Å; T214-Q217 WeakPolarHBondContact O-CA 3.43Å; T214-Q217 WeakPolarHBondContact O-CB 3.37Å; T214-Q217 PolarHBondContact O-N 2.8Å; T214-I218 PolarHBondContact O-N 2.96Å | ||
| 215 | L | 70.2 | Confident | 67.9 | Low | 110 Ų | 110 | 107.5 Ų | 107.5 | 58% | 0.576 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -53.5 | -29.5 | 179.9 | -148.8 | 111.4 | 0 | 0 | 0 | 112 | I218 A219 L234 | L215-I218 PolarHBondContact O-N 3.35Å; L215-A219 PolarHBondContact O-N 3.03Å; L215-L234 HydrophobicContact CD2-CD1 4.02Å |
| 216 | A | 74.2 | Confident | 69 | Low | 55 Ų | 55 | 107.3 Ų | 107.3 | 46% | 0.455 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -56.4 | -47.3 | 169 | 0 | 0 | 0 | 0 | 0 | 113 | T214 I218 A219 T220 | T214-A216 CarbonylContact O-C 3.58Å; T214-A216 PolarHBondContact O-N 3.15Å; A216-I218 VanDerWaalsContact C-N 3.28Å; A216-I218 PolarHBondContact O-N 2.88Å; A216-A219 PolarHBondContact O-N 3.19Å; A216-T220 PolarHBondContact O-N 3.25Å; A216-T220 PolarHBondContact O-OG1 3.26Å |
| 217 | Q | 80 | Confident | 70.7 | Confident | 108 Ų | 108 | 108 Ų | 108 | 51% | 0.505 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -64.1 | -33.3 | 177.3 | -63.5 | 179.6 | -0.2 | 0 | 0 | 112.3 | T214 K221 | T214-Q217 WeakPolarHBondContact O-CA 3.43Å; T214-Q217 WeakPolarHBondContact O-CB 3.37Å; T214-Q217 PolarHBondContact O-N 2.8Å; Q217-K221 VanDerWaalsContact O-CB 3.29Å; Q217-K221 WeakPolarHBondContact O-CB 3.19Å; Q217-K221 PolarHBondContact O-N 3.04Å |
| 218 | I | 79.7 | Confident | 71.2 | Confident | 83 Ų | 83 | 104.9 Ų | 104.9 | 43% | 0.426 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -69.3 | -43.8 | 175.1 | -58.9 | 175.6 | 0 | 0 | 0 | 110.1 | T214 L215 A216 K221 K222 | T214-I218 PolarHBondContact O-N 2.96Å; L215-I218 PolarHBondContact O-N 3.35Å; A216-I218 VanDerWaalsContact C-N 3.28Å; A216-I218 PolarHBondContact O-N 2.88Å; I218-K221 PolarHBondContact O-N 2.77Å; I218-K222 WeakPolarHBondContact O-CG 3.22Å; I218-K222 PolarHBondContact O-N 3.21Å |
| 219 | A | 79.2 | Confident | 72.1 | Confident | 7 Ų | 7 | 104.1 Ų | 104.1 | 6% | 0.058 | 57% | 0.568 | C | S | . | * | H | α-helix | trans | -61.7 | -44.3 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | L215 A216 K221 K222 G223 I224 L229 | L215-A219 PolarHBondContact O-N 3.03Å; A216-A219 PolarHBondContact O-N 3.19Å; A219-K221 PolarHBondContact O-N 2.99Å; A219-K222 PolarHBondContact O-N 3.24Å; A219-G223 PolarHBondContact O-N 3.45Å; A219-I224 HydrophobicContact CB-CB 4.41Å; A219-I224 PolarHBondContact O-N 2.04Å; A219-L229 HydrophobicContact CB-CD1 4.18Å |
| 220 | T | 83.4 | Confident | 72.7 | Confident | 97 Ų | 97 | 102.7 Ų | 102.7 | 60% | 0.595 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -63.7 | -41.9 | 176.2 | -37.5 | 0 | 0 | 0 | 0 | 111.6 | A216 K222 G223 | A216-T220 PolarHBondContact O-N 3.25Å; A216-T220 PolarHBondContact O-OG1 3.26Å; T220-K222 PolarHBondContact O-N 2.86Å; T220-G223 PolarHBondContact O-N 3.18Å |
| 221 | K | 90.3 | Very high | 72.9 | Confident | 188 Ų | 188 | 105.7 Ų | 105.7 | 82% | 0.817 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -66.6 | -26.4 | 178.4 | -170.1 | 173.7 | -178.7 | 178.8 | 0 | 112.9 | Q217 I218 A219 | Q217-K221 VanDerWaalsContact O-CB 3.29Å; Q217-K221 WeakPolarHBondContact O-CB 3.19Å; Q217-K221 PolarHBondContact O-N 3.04Å; I218-K221 PolarHBondContact O-N 2.77Å; A219-K221 PolarHBondContact O-N 2.99Å |
| 222 | K | 88.6 | Confident | 72.3 | Confident | 158 Ų | 158 | 105 Ų | 105 | 69% | 0.687 | 57% | 0.566 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.3 | 3.6 | 178.1 | -69.9 | -156.1 | 175.7 | -168.2 | 0 | 114.4 | I218 A219 T220 I224 | I218-K222 WeakPolarHBondContact O-CG 3.22Å; I218-K222 PolarHBondContact O-N 3.21Å; A219-K222 PolarHBondContact O-N 3.24Å; T220-K222 PolarHBondContact O-N 2.86Å; K222-I224 HydrophobicContact CB-CD1 4.09Å; K222-I224 HydrophobicContact CB-CG1 4.05Å; K222-I224 PolarHBondContact O-N 2.9Å |
| 223 | G | 87.7 | Confident | 71.9 | Confident | 66 Ų | 66 | 108.5 Ų | 108.5 | 68% | 0.68 | 57% | 0.57 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 66.3 | 25 | -180 | 0 | 0 | 0 | 0 | 0 | 113.7 | A219 T220 P225 | A219-G223 PolarHBondContact O-N 3.45Å; T220-G223 PolarHBondContact O-N 3.18Å; G223-P225 WeakPolarHBondContact O-CD 2.98Å |
| 224 | I | 84.6 | Confident | 70.4 | Confident | 78 Ų | 78 | 108.7 Ų | 108.7 | 40% | 0.4 | 58% | 0.575 | S | S | . | * | trans | -84.6 | 118.6 | 177.4 | -56.9 | 173.4 | 0 | 0 | 0 | 107.3 | A219 K222 I226 | A219-I224 HydrophobicContact CB-CB 4.41Å; A219-I224 PolarHBondContact O-N 2.04Å; K222-I224 HydrophobicContact CB-CD1 4.09Å; K222-I224 HydrophobicContact CB-CG1 4.05Å; K222-I224 PolarHBondContact O-N 2.9Å; I224-I226 PolarHBondContact O-N 2.8Å | ||
| 225 | P | 79.9 | Confident | 68.8 | Low | 75 Ų | 75 | 110.3 Ų | 110.3 | 49% | 0.487 | 59% | 0.585 | S | S | . | * | trans | -62.3 | 126.7 | 177.1 | 23.6 | -30.6 | 0 | 0 | 0 | 109.6 | G223 E227 S228 | G223-P225 WeakPolarHBondContact O-CD 2.98Å; P225-E227 PolarHBondContact O-N 2.03Å; P225-E227 VanDerWaalsContact O-N 3.13Å; P225-S228 WeakPolarHBondContact O-CB 2.93Å; P225-S228 PolarHBondContact O-N 3.22Å | ||
| 226 | I | 73.5 | Confident | 67.3 | Low | 102 Ų | 102 | 112.2 Ų | 112.2 | 52% | 0.523 | 60% | 0.596 | S | S | . | * | G | 310 helix | trans | -58.3 | -28.3 | -177.5 | -64.5 | 171.9 | 0 | 0 | 0 | 111.1 | I224 S228 L229 | I224-I226 PolarHBondContact O-N 2.8Å; I226-S228 PolarHBondContact O-N 3.02Å; I226-L229 WeakPolarHBondContact O-CB 3.43Å; I226-L229 PolarHBondContact O-N 3.45Å |
| 227 | E | 72.6 | Confident | 66.4 | Low | 165 Ų | 165 | 114.4 Ų | 114.4 | 77% | 0.771 | 60% | 0.603 | S | S | * | * | G | 310 helix | trans | -62.4 | -22.5 | 176.6 | -60.2 | 175.9 | 178 | 0 | 0 | 113.2 | P225 L229 | P225-E227 PolarHBondContact O-N 2.03Å; P225-E227 VanDerWaalsContact O-N 3.13Å; E227-L229 VanDerWaalsContact C-N 3.31Å |
| 228 | S | 62.6 | Low | 64.7 | Low | 85 Ų | 85 | 116.9 Ų | 116.9 | 59% | 0.594 | 62% | 0.62 | S | S | * | * | G | 310 helix | trans | -79.6 | -9.8 | 174.4 | -64.4 | 0 | 0 | 0 | 0 | 113.7 | P225 I226 H230 | P225-S228 WeakPolarHBondContact O-CB 2.93Å; P225-S228 PolarHBondContact O-N 3.22Å; I226-S228 PolarHBondContact O-N 3.02Å; S228-H230 VanDerWaalsContact C-N 3.34Å |
| 229 | L | 57.7 | Low | 63.5 | Low | 65 Ų | 65 | 118 Ų | 118 | 34% | 0.34 | 63% | 0.626 | S | S | . | * | G | 310 helix | trans | -84.6 | -3.5 | 179.2 | -68.2 | 167.9 | 0 | 0 | 0 | 113.4 | A219 I226 E227 K231 V232 | A219-L229 HydrophobicContact CB-CD1 4.18Å; I226-L229 WeakPolarHBondContact O-CB 3.43Å; I226-L229 PolarHBondContact O-N 3.45Å; E227-L229 VanDerWaalsContact C-N 3.31Å; L229-K231 PolarHBondContact O-N 3.45Å; L229-V232 PolarHBondContact O-N 3.45Å |
| 230 | H | 55.8 | Low | 62.2 | Low | 162 Ų | 162 | 121.7 Ų | 121.7 | 75% | 0.75 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.4 | 6.2 | -177.4 | -71.4 | 177.3 | 0 | 0 | 0 | 115.8 | S228 | S228-H230 VanDerWaalsContact C-N 3.34Š|
| 231 | K | 55.4 | Low | 60.9 | Low | 206 Ų | 206 | 123.8 Ų | 123.8 | 90% | 0.896 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -117.5 | 6.2 | 176.6 | -86.6 | -178.7 | 178.8 | 177.7 | 0 | 115 | L229 | L229-K231 PolarHBondContact O-N 3.45Š|
| 232 | V | 40.8 | Very low | 59.9 | Low | 91 Ų | 91 | 118.6 Ų | 118.6 | 55% | 0.552 | 66% | 0.664 | S | S | * | * | trans | -116 | 97 | 173.6 | -164.9 | 0 | 0 | 0 | 0 | 107.6 | L229 L234 | L229-V232 PolarHBondContact O-N 3.45Å; V232-L234 HydrophobicContact CG1-CD2 4.49Å; V232-L234 HydrophobicContact CG1-CG 3.95Å; V232-L234 PolarHBondContact O-N 3.43Å | ||
| 233 | E | 42.5 | Very low | 58 | Low | 188 Ų | 188 | 114.8 Ų | 114.8 | 88% | 0.879 | 66% | 0.657 | S | S | * | * | trans | -66 | 92.4 | 160.8 | -79.5 | -174.1 | 152.1 | 0 | 0 | 107.2 | V235 | E233-V235 PolarHBondContact O-N 3.02Š| ||
| 234 | L | 38.9 | Very low | 56.3 | Low | 110 Ų | 110 | 121.3 Ų | 121.3 | 58% | 0.576 | 67% | 0.67 | S | S | * | * | trans | -75.3 | 107.9 | 163.8 | -78.2 | 155 | 0 | 0 | 0 | 106.5 | L215 V232 D236 | L215-L234 HydrophobicContact CD2-CD1 4.02Å; V232-L234 HydrophobicContact CG1-CD2 4.49Å; V232-L234 HydrophobicContact CG1-CG 3.95Å; V232-L234 PolarHBondContact O-N 3.43Å; L234-D236 PolarHBondContact O-N 3.28Å | ||
| 235 | V | 46.1 | Very low | 54.4 | Low | 118 Ų | 118 | 125.6 Ų | 125.6 | 72% | 0.715 | 69% | 0.688 | S | S | * | * | trans | -74.4 | 104.9 | 165.1 | -176.9 | 0 | 0 | 0 | 0 | 106.2 | E233 V237 | E233-V235 PolarHBondContact O-N 3.02Å; V235-V237 HydrophobicContact CG1-CG2 3.96Å; V235-V237 PolarHBondContact O-N 3.39Å; V235-V237 VanDerWaalsContact O-N 3.12Å | ||
| 236 | D | 40 | Very low | 52.7 | Low | 150 Ų | 150 | 127.5 Ų | 127.5 | 80% | 0.802 | 70% | 0.698 | S | S | * | * | trans | -64.5 | 109.2 | 167.1 | -74.1 | -39 | 0 | 0 | 0 | 107.9 | L234 | L234-D236 PolarHBondContact O-N 3.28Š| ||
| 237 | V | 54 | Low | 51.1 | Low | 101 Ų | 101 | 128.3 Ų | 128.3 | 61% | 0.612 | 71% | 0.708 | S | S | * | * | trans | -102 | 104.1 | 170.7 | -178.5 | 0 | 0 | 0 | 0 | 106.9 | V235 L239 | V235-V237 HydrophobicContact CG1-CG2 3.96Å; V235-V237 PolarHBondContact O-N 3.39Å; V235-V237 VanDerWaalsContact O-N 3.12Å; V237-L239 HydrophobicContact CG1-CD1 4.39Å; V237-L239 HydrophobicContact CG1-CG 4.36Å; V237-L239 PolarHBondContact O-N 2.89Å | ||
| 238 | D | 45.6 | Very low | 49.8 | Very low | 160 Ų | 160 | 126 Ų | 126 | 86% | 0.856 | 70% | 0.699 | S | S | * | * | trans | -64.8 | 102.7 | 168.6 | -75 | -47 | 0 | 0 | 0 | 109.2 | ||||
| 239 | L | 55 | Low | 48.8 | Very low | 106 Ų | 106 | 125.4 Ų | 125.4 | 56% | 0.555 | 69% | 0.694 | S | S | * | * | P | Polyproline II helix | trans | -88.3 | 129.6 | 170 | -83.1 | 130.4 | 0 | 0 | 0 | 109.5 | V237 C243 | V237-L239 HydrophobicContact CG1-CD1 4.39Å; V237-L239 HydrophobicContact CG1-CG 4.36Å; V237-L239 PolarHBondContact O-N 2.89Å; L239-C243 HydrophobicContact CD2-CB 4.11Å |
| 240 | P | 50.8 | Low | 48.5 | Very low | 85 Ų | 85 | 131.4 Ų | 131.4 | 55% | 0.552 | 72% | 0.717 | S | S | * | * | P | Polyproline II helix | trans | -65.8 | 149.5 | 174.5 | 27.6 | -33 | 0 | 0 | 0 | 110.8 | G242 | P240-G242 PolarHBondContact O-N 3.47Š|
| 241 | P | 56.2 | Low | 48.3 | Very low | 140 Ų | 140 | 133.8 Ų | 133.8 | 91% | 0.909 | 72% | 0.721 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.4 | 123.4 | 176.6 | 24.3 | -32 | 0 | 0 | 0 | 110.2 | ||
| 242 | G | 69 | Low | 48.1 | Very low | 79 Ų | 79 | 131.6 Ų | 131.6 | 81% | 0.814 | 71% | 0.712 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 122.8 | 1.4 | 177.8 | 0 | 0 | 0 | 0 | 0 | 116.6 | P240 | P240-G242 PolarHBondContact O-N 3.47Š|
| 243 | C | 48.7 | Very low | 48.7 | Very low | 79 Ų | 79 | 131 Ų | 131 | 53% | 0.534 | 71% | 0.709 | S | S | . | * | trans | -96.4 | 96.5 | 174.5 | -65.4 | 0 | 0 | 0 | 0 | 111.4 | L239 E245 | L239-C243 HydrophobicContact CD2-CB 4.11Å; C243-E245 VanDerWaalsContact C-N 3.33Å | ||
| 244 | E | 52.9 | Low | 49 | Very low | 202 Ų | 202 | 124.6 Ų | 124.6 | 94% | 0.944 | 69% | 0.692 | S | S | * | * | trans | -83.5 | -0.5 | 174.5 | -81 | -175.2 | 155 | 0 | 0 | 114.1 | ||||
| 245 | E | 43.8 | Very low | 49.9 | Very low | 169 Ų | 169 | 125.2 Ų | 125.2 | 79% | 0.79 | 70% | 0.696 | S | S | * | * | trans | -134.5 | 108.5 | -178.9 | -126.7 | 177.8 | 179 | 0 | 0 | 112.5 | C243 T247 | C243-E245 VanDerWaalsContact C-N 3.33Å; E245-T247 PolarHBondContact O-N 2.85Å; E245-T247 VanDerWaalsContact O-N 3.15Å | ||
| 246 | V | 43.9 | Very low | 50.6 | Low | 114 Ų | 114 | 126.3 Ų | 126.3 | 69% | 0.691 | 70% | 0.697 | S | S | * | * | trans | -78.3 | 95.4 | 171.5 | -178.5 | 0 | 0 | 0 | 0 | 108.3 | I248 | V246-I248 PolarHBondContact O-N 3.26Š| ||
| 247 | T | 41.3 | Very low | 51.8 | Low | 119 Ų | 119 | 123.7 Ų | 123.7 | 73% | 0.73 | 68% | 0.683 | S | S | * | * | trans | -79.1 | 102.4 | 169.9 | -51.2 | 0 | 0 | 0 | 0 | 108.8 | E245 P249 | E245-T247 PolarHBondContact O-N 2.85Å; E245-T247 VanDerWaalsContact O-N 3.15Å; T247-P249 WeakPolarHBondContact O-CD 3.2Å | ||
| 248 | I | 45.2 | Very low | 52.2 | Low | 116 Ų | 116 | 125.1 Ų | 125.1 | 60% | 0.595 | 70% | 0.695 | S | S | * | * | trans | -61.4 | 123.2 | 173.2 | -57.6 | 173.7 | 0 | 0 | 0 | 108.1 | V246 K250 F252 | V246-I248 PolarHBondContact O-N 3.26Å; I248-K250 PolarHBondContact O-N 3.41Å; I248-F252 HydrophobicContact CG2-CB 4.4Å | ||
| 249 | P | 40.4 | Very low | 54.1 | Low | 74 Ų | 74 | 121.1 Ų | 121.1 | 48% | 0.481 | 69% | 0.692 | S | S | . | * | trans | -56.2 | 130.3 | 176.5 | -21.4 | 30.6 | 0 | 0 | 0 | 110 | T247 Y251 F252 | T247-P249 WeakPolarHBondContact O-CD 3.2Å; P249-Y251 HydrophobicContact CB-CD2 4.17Å; P249-Y251 PolarHBondContact O-N 3.22Å; P249-F252 PolarHBondContact O-N 3.12Å; P249-F252 VanDerWaalsContact O-N 3.11Å | ||
| 250 | K | 52.4 | Low | 55.5 | Low | 191 Ų | 191 | 118.8 Ų | 118.8 | 83% | 0.83 | 68% | 0.679 | S | S | * | * | G | 310 helix | trans | -54 | -12.6 | 180 | -71.7 | 179.6 | 178.8 | 173.4 | 0 | 114.4 | I248 | I248-K250 PolarHBondContact O-N 3.41Š|
| 251 | Y | 51.7 | Low | 57.5 | Low | 211 Ų | 211 | 117 Ų | 117 | 83% | 0.827 | 67% | 0.668 | S | S | * | * | G | 310 helix | trans | -82.3 | -7.6 | -178.5 | -50.3 | -74.8 | 0 | 0 | 0 | 114.2 | P249 | P249-Y251 HydrophobicContact CB-CD2 4.17Å; P249-Y251 PolarHBondContact O-N 3.22Å |
| 252 | F | 50.1 | Low | 59.1 | Low | 160 Ų | 160 | 118.2 Ų | 118.2 | 70% | 0.702 | 66% | 0.659 | S | S | * | * | G | 310 helix | trans | -92.7 | -11 | -178.3 | -100.4 | -85.3 | 0 | 0 | 0 | 115.4 | I248 P249 | I248-F252 HydrophobicContact CG2-CB 4.4Å; P249-F252 PolarHBondContact O-N 3.12Å; P249-F252 VanDerWaalsContact O-N 3.11Å |
| 253 | T | 53.1 | Low | 60.3 | Low | 80 Ų | 80 | 120.5 Ų | 120.5 | 49% | 0.491 | 65% | 0.648 | S | S | . | * | S | Bend | trans | -110.2 | -2.7 | -176.7 | 47.4 | 0 | 0 | 0 | 0 | 114.5 | ||
| 254 | G | 49.2 | Very low | 62.4 | Low | 52 Ų | 52 | 121.1 Ų | 121.1 | 54% | 0.536 | 64% | 0.643 | S | S | . | * | S | Bend | trans | -75.4 | -28.6 | -171.5 | 0 | 0 | 0 | 0 | 0 | 116 | ||
| 255 | D | 58.1 | Low | 64.2 | Low | 123 Ų | 123 | 114.6 Ų | 114.6 | 66% | 0.658 | 61% | 0.614 | S | S | * | * | S | Bend | trans | -109.2 | -4.3 | -164.6 | -67.7 | -19.3 | 0 | 0 | 0 | 114.7 | ||
| 256 | L | 62 | Low | 66.6 | Low | 141 Ų | 141 | 109.7 Ų | 109.7 | 74% | 0.738 | 60% | 0.596 | S | S | * | * | S | Bend | trans | -86.8 | -12.9 | -170.4 | -82 | 165.4 | 0 | 0 | 0 | 115.3 | ||
| 257 | N | 64.7 | Low | 69.1 | Low | 95 Ų | 95 | 110.7 Ų | 110.7 | 51% | 0.508 | 59% | 0.593 | S | S | . | * | trans | -168.1 | 95 | 169.7 | -87 | -48.3 | 0 | 0 | 0 | 110 | G259 M260 | N257-G259 PolarHBondContact O-N 3.17Å; N257-M260 HydrophobicContact CB-CB 4.42Å; N257-M260 HydrophobicContact CB-CG 3.93Å; N257-M260 PolarHBondContact O-N 3.04Å | ||
| 258 | P | 61.6 | Low | 71.7 | Confident | 131 Ų | 131 | 110.1 Ų | 110.1 | 85% | 0.851 | 58% | 0.582 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.9 | 110 | 175.4 | 27 | -31.1 | 0 | 0 | 0 | 109.2 | ||
| 259 | G | 85.7 | Confident | 74 | Confident | 77 Ų | 77 | 110.7 Ų | 110.7 | 79% | 0.794 | 58% | 0.582 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 127.9 | -8.8 | 177.8 | 0 | 0 | 0 | 0 | 0 | 115.4 | N257 | N257-G259 PolarHBondContact O-N 3.17Š|
| 260 | M | 85.5 | Confident | 76.7 | Confident | 57 Ų | 57 | 113.6 Ų | 113.6 | 28% | 0.281 | 59% | 0.587 | S | S | . | * | trans | -85.8 | 134.4 | 174.5 | -70.5 | -112.8 | -61.5 | 0 | 0 | 111.7 | N257 Q264 I265 Q268 | N257-M260 HydrophobicContact CB-CB 4.42Å; N257-M260 HydrophobicContact CB-CG 3.93Å; N257-M260 PolarHBondContact O-N 3.04Å; M260-Q264 HydrophobicContact CB-CB 4.29Å; M260-Q264 HydrophobicContact CE-CB 3.88Å; M260-Q264 HydrophobicContact SD-CB 3.81Å; M260-I265 HydrophobicContact CB-CG1 4.04Å; M260-I265 HydrophobicContact CE-CG1 4.17Å; M260-Q268 HydrophobicContact CE-CG 4.15Å | ||
| 261 | S | 92.7 | Very high | 78.8 | Confident | 46 Ų | 46 | 110.1 Ų | 110.1 | 32% | 0.322 | 57% | 0.574 | S | S | . | * | trans | -69.4 | 158.6 | 172.7 | 91.8 | 0 | 0 | 0 | 0 | 111.1 | E263 Q264 I265 | S261-E263 VanDerWaalsContact CB-OE2 3.24Å; S261-E263 WeakPolarHBondContact CB-OE2 3.49Å; S261-E263 PolarHBondContact O-N 3.36Å; S261-E263 PolarHBondContact OG-N 3.07Å; S261-E263 PolarHBondContact OG-OE2 3.32Å; S261-Q264 WeakPolarHBondContact O-CB 3.42Å; S261-Q264 PolarHBondContact O-N 2.82Å; S261-Q264 PolarHBondContact OG-N 3.1Å; S261-I265 PolarHBondContact O-N 3.42Å | ||
| 262 | K | 88.8 | Confident | 80.8 | Confident | 167 Ų | 167 | 105.1 Ų | 105.1 | 73% | 0.726 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -57 | -34.3 | 176.6 | -172.8 | -178 | 177.1 | -171.7 | 0 | 111.6 | T266 | K262-T266 WeakPolarHBondContact O-CB 3.37Å; K262-T266 PolarHBondContact O-N 3.37Å; K262-T266 PolarHBondContact O-OG1 3.26Å |
| 263 | E | 93.8 | Very high | 83 | Confident | 126 Ų | 126 | 100.5 Ų | 100.5 | 59% | 0.589 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -66.4 | -43.4 | 175.9 | -58.7 | 69.7 | -147.2 | 0 | 0 | 111.1 | S261 T266 Q267 | S261-E263 VanDerWaalsContact CB-OE2 3.24Å; S261-E263 WeakPolarHBondContact CB-OE2 3.49Å; S261-E263 PolarHBondContact O-N 3.36Å; S261-E263 PolarHBondContact OG-N 3.07Å; S261-E263 PolarHBondContact OG-OE2 3.32Å; E263-T266 PolarHBondContact O-N 2.77Å; E263-Q267 WeakPolarHBondContact O-CB 3.39Å; E263-Q267 PolarHBondContact O-N 3.06Å |
| 264 | Q | 94.5 | Very high | 85.2 | Confident | 92 Ų | 92 | 103.5 Ų | 103.5 | 43% | 0.43 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -64.1 | -41.9 | 177.3 | -70.3 | 176.3 | -36.6 | 0 | 0 | 112.1 | M260 S261 T266 Q267 Q268 | M260-Q264 HydrophobicContact CB-CB 4.29Å; M260-Q264 HydrophobicContact CE-CB 3.88Å; M260-Q264 HydrophobicContact SD-CB 3.81Å; S261-Q264 WeakPolarHBondContact O-CB 3.42Å; S261-Q264 PolarHBondContact O-N 2.82Å; S261-Q264 PolarHBondContact OG-N 3.1Å; Q264-T266 VanDerWaalsContact C-N 3.32Å; Q264-T266 PolarHBondContact O-N 3.42Å; Q264-Q267 PolarHBondContact O-N 2.89Å; Q264-Q268 PolarHBondContact O-N 3.04Å |
| 265 | I | 90.2 | Very high | 87.4 | Confident | 65 Ų | 65 | 105.2 Ų | 105.2 | 33% | 0.333 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -61.2 | -44.9 | 175.1 | -63.6 | 170.8 | 0 | 0 | 0 | 110.1 | M260 S261 Q267 Q268 H269 | M260-I265 HydrophobicContact CB-CG1 4.04Å; M260-I265 HydrophobicContact CE-CG1 4.17Å; S261-I265 PolarHBondContact O-N 3.42Å; I265-Q267 VanDerWaalsContact C-N 3.31Å; I265-Q267 PolarHBondContact O-N 3.15Å; I265-Q268 PolarHBondContact O-N 2.88Å; I265-H269 PolarHBondContact O-N 3.05Å |
| 266 | T | 94 | Very high | 89.1 | Confident | 67 Ų | 67 | 105.6 Ų | 105.6 | 41% | 0.411 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -64.1 | -37.8 | 178 | -54.3 | 0 | 0 | 0 | 0 | 111.6 | K262 E263 Q264 H269 K270 | K262-T266 WeakPolarHBondContact O-CB 3.37Å; K262-T266 PolarHBondContact O-N 3.37Å; K262-T266 PolarHBondContact O-OG1 3.26Å; E263-T266 PolarHBondContact O-N 2.77Å; Q264-T266 VanDerWaalsContact C-N 3.32Å; Q264-T266 PolarHBondContact O-N 3.42Å; T266-H269 PolarHBondContact O-N 3.44Å; T266-K270 WeakPolarHBondContact O-CG 2.95Å; T266-K270 PolarHBondContact O-N 2.7Å |
| 267 | Q | 96.7 | Very high | 90.8 | Very high | 134 Ų | 134 | 103.9 Ų | 103.9 | 63% | 0.626 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -71 | -41.9 | 179.6 | -167.9 | 163.7 | -4.5 | 0 | 0 | 112 | E263 Q264 I265 H269 K270 E271 | E263-Q267 WeakPolarHBondContact O-CB 3.39Å; E263-Q267 PolarHBondContact O-N 3.06Å; Q264-Q267 PolarHBondContact O-N 2.89Å; I265-Q267 VanDerWaalsContact C-N 3.31Å; I265-Q267 PolarHBondContact O-N 3.15Å; Q267-H269 VanDerWaalsContact C-N 3.32Å; Q267-H269 PolarHBondContact O-N 3.26Å; Q267-K270 PolarHBondContact O-N 3.24Å; Q267-E271 PolarHBondContact O-N 3.15Å |
| 268 | Q | 94.8 | Very high | 92.3 | Very high | 107 Ų | 107 | 105.3 Ų | 105.3 | 50% | 0.5 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -58.2 | -44.7 | 170.8 | -100.3 | -163.8 | -35.7 | 0 | 0 | 111.6 | M260 Q264 I265 K270 E271 L272 | M260-Q268 HydrophobicContact CE-CG 4.15Å; Q264-Q268 PolarHBondContact O-N 3.04Å; I265-Q268 PolarHBondContact O-N 2.88Å; Q268-K270 PolarHBondContact O-N 3.2Å; Q268-E271 PolarHBondContact O-N 3.35Å; Q268-L272 WeakPolarHBondContact O-CB 2.91Å; Q268-L272 PolarHBondContact O-N 3.03Å |
| 269 | H | 93.8 | Very high | 93.9 | Very high | 128 Ų | 128 | 104 Ų | 104 | 59% | 0.593 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -63.3 | -41.8 | 178.7 | -166.2 | -88.4 | 0 | 0 | 0 | 111.9 | I265 T266 Q267 E271 L272 V273 | I265-H269 PolarHBondContact O-N 3.05Å; T266-H269 PolarHBondContact O-N 3.44Å; Q267-H269 VanDerWaalsContact C-N 3.32Å; Q267-H269 PolarHBondContact O-N 3.26Å; H269-E271 VanDerWaalsContact C-N 3.32Å; H269-E271 PolarHBondContact O-N 3.11Å; H269-L272 PolarHBondContact O-N 3.27Å; H269-V273 WeakPolarHBondContact O-CG2 3.41Å; H269-V273 PolarHBondContact O-N 2.82Å |
| 270 | K | 96.8 | Very high | 94.3 | Very high | 135 Ų | 135 | 105.9 Ų | 105.9 | 59% | 0.587 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -61 | -39.4 | 174.5 | -77.5 | 178.3 | 179.5 | 179.2 | 0 | 112.6 | T266 Q267 Q268 K274 | T266-K270 WeakPolarHBondContact O-CG 2.95Å; T266-K270 PolarHBondContact O-N 2.7Å; Q267-K270 PolarHBondContact O-N 3.24Å; Q268-K270 PolarHBondContact O-N 3.2Å; K270-K274 WeakPolarHBondContact O-CG 3.23Å; K270-K274 PolarHBondContact O-N 2.83Å; K270-K274 VanDerWaalsContact O-N 3.11Å |
| 271 | E | 97.3 | Very high | 94.7 | Very high | 118 Ų | 118 | 110.4 Ų | 110.4 | 55% | 0.551 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -69.6 | -40 | 178.5 | -166.6 | 172.9 | -172.6 | 0 | 0 | 111.8 | Q267 Q268 H269 V273 K274 N275 | Q267-E271 PolarHBondContact O-N 3.15Å; Q268-E271 PolarHBondContact O-N 3.35Å; H269-E271 VanDerWaalsContact C-N 3.32Å; H269-E271 PolarHBondContact O-N 3.11Å; E271-V273 PolarHBondContact O-N 3.24Å; E271-K274 PolarHBondContact O-N 3.45Å; E271-N275 PolarHBondContact O-N 3.28Å |
| 272 | L | 94.4 | Very high | 94.8 | Very high | 106 Ų | 106 | 114.3 Ų | 114.3 | 56% | 0.555 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -63.4 | -42.4 | 176.9 | -156.2 | 120.9 | 0 | 0 | 0 | 111.9 | Q268 H269 N275 F276 | Q268-L272 WeakPolarHBondContact O-CB 2.91Å; Q268-L272 PolarHBondContact O-N 3.03Å; H269-L272 PolarHBondContact O-N 3.27Å; L272-N275 PolarHBondContact O-N 3.08Å; L272-F276 HydrophobicContact CD2-CD2 4.4Å; L272-F276 PolarHBondContact O-N 3.16Å |
| 273 | V | 96.2 | Very high | 94.9 | Very high | 63 Ų | 63 | 110 Ų | 110 | 38% | 0.382 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -63 | -44.6 | 174.6 | 173.3 | 0 | 0 | 0 | 0 | 111.2 | H269 E271 N275 F276 E277 | H269-V273 WeakPolarHBondContact O-CG2 3.41Å; H269-V273 PolarHBondContact O-N 2.82Å; E271-V273 PolarHBondContact O-N 3.24Å; V273-N275 VanDerWaalsContact C-N 3.33Å; V273-N275 PolarHBondContact O-N 2.95Å; V273-F276 PolarHBondContact O-N 3.44Å; V273-E277 PolarHBondContact O-N 3.47Å |
| 274 | K | 97.7 | Very high | 94.7 | Very high | 144 Ų | 144 | 110.3 Ų | 110.3 | 63% | 0.626 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -60.1 | -40.7 | 175.9 | -77.9 | 179 | 179.4 | -176.9 | 0 | 112.7 | K270 E271 E277 K278 | K270-K274 WeakPolarHBondContact O-CG 3.23Å; K270-K274 PolarHBondContact O-N 2.83Å; K270-K274 VanDerWaalsContact O-N 3.11Å; E271-K274 PolarHBondContact O-N 3.45Å; K274-E277 PolarHBondContact O-N 3.05Å; K274-K278 WeakPolarHBondContact O-CB 3.37Å; K274-K278 PolarHBondContact O-N 3.15Å |
| 275 | N | 96.1 | Very high | 94.3 | Very high | 88 Ų | 88 | 111 Ų | 111 | 47% | 0.471 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -66.1 | -40.8 | 177.6 | -72.4 | -17.5 | 0 | 0 | 0 | 111.5 | E271 L272 V273 K278 L279 | E271-N275 PolarHBondContact O-N 3.28Å; L272-N275 PolarHBondContact O-N 3.08Å; V273-N275 VanDerWaalsContact C-N 3.33Å; V273-N275 PolarHBondContact O-N 2.95Å; N275-K278 PolarHBondContact O-N 3.35Å; N275-L279 WeakPolarHBondContact O-CG 2.98Å; N275-L279 PolarHBondContact O-N 3.24Å |
| 276 | F | 94.8 | Very high | 93.9 | Very high | 131 Ų | 131 | 113.9 Ų | 113.9 | 58% | 0.575 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -63.1 | -44.3 | 174.4 | -108.1 | -85.2 | 0 | 0 | 0 | 112.6 | L272 V273 K278 L279 L280 | L272-F276 HydrophobicContact CD2-CD2 4.4Å; L272-F276 PolarHBondContact O-N 3.16Å; V273-F276 PolarHBondContact O-N 3.44Å; F276-K278 VanDerWaalsContact C-N 3.3Å; F276-K278 PolarHBondContact O-N 3.41Å; F276-L279 PolarHBondContact O-N 3.15Å; F276-L280 WeakPolarHBondContact O-CG 3.37Å; F276-L280 PolarHBondContact O-N 3.43Å |
| 277 | E | 96 | Very high | 93.3 | Very high | 104 Ų | 104 | 119.1 Ų | 119.1 | 49% | 0.486 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -62.7 | -36.3 | 175.8 | -74.2 | -176.2 | 171.5 | 0 | 0 | 112.7 | V273 K274 L280 K281 | V273-E277 PolarHBondContact O-N 3.47Å; K274-E277 PolarHBondContact O-N 3.05Å; E277-L280 PolarHBondContact O-N 2.76Å; E277-K281 WeakPolarHBondContact O-CG 3.33Å; E277-K281 PolarHBondContact O-N 3.07Å; E277-K281 VanDerWaalsContact O-N 3.14Å |
| 278 | K | 97.2 | Very high | 92.5 | Very high | 125 Ų | 125 | 118.7 Ų | 118.7 | 54% | 0.543 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -64.5 | -46.6 | 175.6 | -173.9 | -178.5 | 173.8 | -169.5 | 0 | 111.3 | K274 N275 F276 L280 K281 E282 | K274-K278 WeakPolarHBondContact O-CB 3.37Å; K274-K278 PolarHBondContact O-N 3.15Å; N275-K278 PolarHBondContact O-N 3.35Å; F276-K278 VanDerWaalsContact C-N 3.3Å; F276-K278 PolarHBondContact O-N 3.41Å; K278-L280 VanDerWaalsContact C-N 3.31Å; K278-L280 PolarHBondContact O-N 3.39Å; K278-K281 PolarHBondContact O-N 2.97Å; K278-E282 WeakPolarHBondContact CE-OE1 3.01Å; K278-E282 IonicContact NZ-OE1 2.75Å; K278-E282 WeakPolarHBondContact O-CG 3.5Å; K278-E282 PolarHBondContact O-N 3.42Å |
| 279 | L | 94.4 | Very high | 91.8 | Very high | 105 Ų | 105 | 123 Ų | 123 | 55% | 0.55 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -62.1 | -38.3 | 176.9 | -70.8 | 172 | 0 | 0 | 0 | 112.1 | N275 F276 K281 E282 A283 | N275-L279 WeakPolarHBondContact O-CG 2.98Å; N275-L279 PolarHBondContact O-N 3.24Å; F276-L279 PolarHBondContact O-N 3.15Å; L279-K281 VanDerWaalsContact C-N 3.33Å; L279-K281 PolarHBondContact O-N 3.26Å; L279-E282 PolarHBondContact O-N 2.83Å; L279-A283 WeakPolarHBondContact O-CB 3.23Å; L279-A283 PolarHBondContact O-N 2.81Å |
| 280 | L | 94.5 | Very high | 90.8 | Very high | 115 Ų | 115 | 121.6 Ų | 121.6 | 60% | 0.602 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -63.6 | -37.7 | 175.4 | -73.5 | 172.7 | 0 | 0 | 0 | 112.4 | F276 E277 K278 E284 | F276-L280 WeakPolarHBondContact O-CG 3.37Å; F276-L280 PolarHBondContact O-N 3.43Å; E277-L280 PolarHBondContact O-N 2.76Å; K278-L280 VanDerWaalsContact C-N 3.31Å; K278-L280 PolarHBondContact O-N 3.39Å; L280-E284 PolarHBondContact O-N 3.18Å |
| 281 | K | 94.8 | Very high | 89.5 | Confident | 152 Ų | 152 | 123.9 Ų | 123.9 | 66% | 0.661 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -71.5 | -35.4 | 176.1 | -72.4 | 173 | -177.6 | 171.6 | 0 | 112.8 | E277 K278 L279 A283 E284 | E277-K281 WeakPolarHBondContact O-CG 3.33Å; E277-K281 PolarHBondContact O-N 3.07Å; E277-K281 VanDerWaalsContact O-N 3.14Å; K278-K281 PolarHBondContact O-N 2.97Å; L279-K281 VanDerWaalsContact C-N 3.33Å; L279-K281 PolarHBondContact O-N 3.26Å; K281-A283 VanDerWaalsContact C-N 3.32Å; K281-E284 PolarHBondContact O-N 2.03Å |
| 282 | E | 93.8 | Very high | 88.4 | Confident | 128 Ų | 128 | 127.9 Ų | 127.9 | 60% | 0.598 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -72 | -27.6 | 176.4 | -72.4 | 175.2 | 177.1 | 0 | 0 | 112.4 | K278 L279 | K278-E282 WeakPolarHBondContact CE-OE1 3.01Å; K278-E282 IonicContact NZ-OE1 2.75Å; K278-E282 WeakPolarHBondContact O-CG 3.5Å; K278-E282 PolarHBondContact O-N 3.42Å; L279-E282 PolarHBondContact O-N 2.83Å |
| 283 | A | 91.2 | Very high | 86.8 | Confident | 76 Ų | 76 | 133 Ų | 133 | 63% | 0.628 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.2 | -9.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 114.1 | L279 K281 P285 | L279-A283 WeakPolarHBondContact O-CB 3.23Å; L279-A283 PolarHBondContact O-N 2.81Å; K281-A283 VanDerWaalsContact C-N 3.32Å; A283-P285 VanDerWaalsContact O-CD 3.32Å; A283-P285 WeakPolarHBondContact O-CD 3.4Å |
| 284 | E | 89.8 | Confident | 85.5 | Confident | 134 Ų | 134 | 135.2 Ų | 135.2 | 63% | 0.626 | 69% | 0.693 | S | S | * | * | S | Bend | trans | -70.4 | 117.4 | 174.7 | -69.5 | -163.4 | 156 | 0 | 0 | 109.6 | L280 K281 | L280-E284 PolarHBondContact O-N 3.18Å; K281-E284 PolarHBondContact O-N 2.03Å |
| 285 | P | 85.1 | Confident | 83.5 | Confident | 107 Ų | 107 | 138 Ų | 138 | 70% | 0.695 | 71% | 0.705 | S | S | * | * | P | Polyproline II helix | trans | -59.5 | 141.6 | 177.8 | 24.7 | -32.8 | 0 | 0 | 0 | 109.4 | A283 K287 | A283-P285 VanDerWaalsContact O-CD 3.32Å; A283-P285 WeakPolarHBondContact O-CD 3.4Å; P285-K287 PolarHBondContact O-N 2.03Å |
| 286 | P | 81.4 | Confident | 82.1 | Confident | 124 Ų | 124 | 139.3 Ų | 139.3 | 81% | 0.805 | 72% | 0.721 | S | S | * | * | P | Polyproline II helix | trans | -55.2 | 118.6 | -179.7 | 22.3 | -32.3 | 0 | 0 | 0 | 108.8 | ||
| 287 | K | 82.5 | Confident | 80 | Confident | 178 Ų | 178 | 140.6 Ų | 140.6 | 77% | 0.774 | 73% | 0.734 | S | S | * | * | P | Polyproline II helix | trans | -53.5 | 126.9 | 177.2 | -74.3 | 178.9 | -178.2 | 170.9 | 0 | 107.9 | P285 K289 | P285-K287 PolarHBondContact O-N 2.03Å; K287-K289 PolarHBondContact O-N 2.92Å |
| 288 | P | 79.1 | Confident | 78.2 | Confident | 124 Ų | 124 | 141.2 Ų | 141.2 | 81% | 0.805 | 75% | 0.75 | S | S | * | * | P | Polyproline II helix | trans | -56.5 | 119.6 | 177.1 | 21.7 | -30.6 | 0 | 0 | 0 | 107.6 | A290 | P288-A290 PolarHBondContact O-N 3.49Å; P288-A290 VanDerWaalsContact O-N 3.12Å |
| 289 | K | 80.7 | Confident | 76.2 | Confident | 197 Ų | 197 | 139.9 Ų | 139.9 | 86% | 0.857 | 76% | 0.756 | S | S | * | * | P | Polyproline II helix | trans | -58.5 | 120.5 | 173.8 | -69.9 | 179.9 | 179.8 | 176.1 | 0 | 106.1 | K287 E291 | K287-K289 PolarHBondContact O-N 2.92Å; K289-E291 VanDerWaalsContact C-N 3.32Å; K289-E291 PolarHBondContact O-N 2.97Å |
| 290 | A | 73.8 | Confident | 74.2 | Confident | 99 Ų | 99 | 141.7 Ų | 141.7 | 82% | 0.818 | 77% | 0.765 | S | S | * | * | trans | -59.8 | 96.7 | 175.6 | 0 | 0 | 0 | 0 | 0 | 108.7 | P288 K292 | P288-A290 PolarHBondContact O-N 3.49Å; P288-A290 VanDerWaalsContact O-N 3.12Å; A290-K292 PolarHBondContact O-N 2.96Å | ||
| 291 | E | 67.9 | Low | 72.3 | Confident | 184 Ų | 184 | 142.2 Ų | 142.2 | 86% | 0.86 | 77% | 0.773 | S | S | * | * | trans | -65.6 | 121.6 | 169.5 | -84 | -176.1 | 135.2 | 0 | 0 | 108.4 | K289 K293 | K289-E291 VanDerWaalsContact C-N 3.32Å; K289-E291 PolarHBondContact O-N 2.97Å; E291-K293 PolarHBondContact O-N 3.23Å; E291-K293 VanDerWaalsContact O-N 3.09Å | ||
| 292 | K | 74.5 | Confident | 70.1 | Confident | 202 Ų | 202 | 139.2 Ų | 139.2 | 88% | 0.878 | 77% | 0.771 | S | S | * | * | trans | -60.8 | 109.9 | 174.6 | -71.4 | 175.6 | 176.4 | 176.6 | 0 | 108.2 | A290 S294 | A290-K292 PolarHBondContact O-N 2.96Å; K292-S294 PolarHBondContact O-N 3.15Å | ||
| 293 | K | 62.3 | Low | 67.9 | Low | 212 Ų | 212 | 139.9 Ų | 139.9 | 92% | 0.922 | 78% | 0.784 | S | S | * | * | trans | -54.9 | 104.9 | 166.5 | -92.4 | 179.4 | 171.4 | 176 | 0 | 110.1 | E291 | E291-K293 PolarHBondContact O-N 3.23Å; E291-K293 VanDerWaalsContact O-N 3.09Å | ||
| 294 | S | 68.4 | Low | 65.9 | Low | 110 Ų | 110 | 139.5 Ų | 139.5 | 77% | 0.769 | 79% | 0.788 | S | S | * | * | trans | -91.9 | 122.5 | 156.1 | 48.9 | 0 | 0 | 0 | 0 | 109.1 | K292 | K292-S294 PolarHBondContact O-N 3.15Š| ||
| 295 | K | 54.6 | Low | 64.3 | Low | 204 Ų | 204 | 138.4 Ų | 138.4 | 89% | 0.887 | 79% | 0.794 | S | S | * | * | trans | -56.9 | 128.2 | 168.9 | -87.8 | 172.3 | 164.8 | 175.5 | 0 | 110.5 | ||||
| 296 | S | 67.8 | Low | 62.7 | Low | 115 Ų | 115 | 142.4 Ų | 142.4 | 80% | 0.804 | 80% | 0.804 | S | S | * | * | trans | -157.5 | 121 | 147.4 | -41.8 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 297 | D | 50.9 | Low | 61.4 | Low | 157 Ų | 157 | 141.1 Ų | 141.1 | 84% | 0.84 | 80% | 0.803 | S | S | * | * | trans | -60.7 | 139.5 | 167.5 | -65.1 | -75 | 0 | 0 | 0 | 111.5 | ||||
| 298 | S | 58.2 | Low | 60.2 | Low | 118 Ų | 118 | 138.2 Ų | 138.2 | 83% | 0.825 | 81% | 0.806 | S | S | * | * | 171.4 | 136.8 | 119.8 | 44.6 | 0 | 0 | 0 | 0 | 112 | |||||
| 299 | S | 53.8 | Low | 59.4 | Low | 97 Ų | 97 | 140.2 Ų | 140.2 | 68% | 0.678 | 81% | 0.809 | S | S | * | * | trans | -46.5 | 154 | 172.8 | 52 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 300 | I | 54.4 | Low | 58.7 | Low | 143 Ų | 143 | 136.6 Ų | 136.6 | 73% | 0.733 | 81% | 0.806 | S | S | * | * | 150.7 | 114.1 | 127.4 | -80 | 161.2 | 0 | 0 | 0 | 111.2 | |||||
| 301 | V | 53.6 | Low | 58.1 | Low | 126 Ų | 126 | 136.2 Ų | 136.2 | 76% | 0.764 | 80% | 0.797 | S | S | * | * | 54 | 135.6 | 125.3 | 175.6 | 0 | 0 | 0 | 0 | 116.9 | |||||
| 302 | S | 47.6 | Very low | 57.8 | Low | 88 Ų | 88 | 131.5 Ų | 131.5 | 62% | 0.615 | 79% | 0.789 | S | S | * | * | cis | -173 | 162.4 | 2.8 | -104.9 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 303 | T | 48.5 | Very low | 57.2 | Low | 142 Ų | 142 | 128.5 Ų | 128.5 | 87% | 0.871 | 78% | 0.783 | S | S | * | * | trans | 55.2 | 118.1 | 143 | 56.5 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 304 | G | 48.9 | Very low | 57.1 | Low | 69 Ų | 69 | 127.7 Ų | 127.7 | 71% | 0.711 | 78% | 0.779 | S | S | * | * | trans | -175.5 | 80.5 | 158.4 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 305 | S | 57 | Low | 56.7 | Low | 110 Ų | 110 | 129.8 Ų | 129.8 | 77% | 0.769 | 78% | 0.78 | S | S | * | * | trans | 27.6 | 107.2 | 144.9 | 48.9 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 306 | E | 50.4 | Low | 57.1 | Low | 192 Ų | 192 | 124.4 Ų | 124.4 | 90% | 0.897 | 77% | 0.774 | S | S | * | * | 51.5 | 95 | 90.2 | -73.8 | -160.9 | 104.6 | 0 | 0 | 114.8 | |||||
| 307 | A | 53.9 | Low | 56.9 | Low | 96 Ų | 96 | 127.8 Ų | 127.8 | 79% | 0.793 | 77% | 0.774 | S | S | * | * | trans | -136.1 | 104.9 | 151.9 | 0 | 0 | 0 | 0 | 0 | 108 | L309 | A307-L309 PolarHBondContact O-N 3.21Š| ||
| 308 | S | 59.3 | Low | 57.4 | Low | 118 Ų | 118 | 129.1 Ų | 129.1 | 83% | 0.825 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -57.3 | 122.8 | 176.7 | -74.7 | 0 | 0 | 0 | 0 | 111.4 | ||
| 309 | L | 60.9 | Low | 57.5 | Low | 165 Ų | 165 | 131.7 Ų | 131.7 | 86% | 0.864 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -93.8 | 134.3 | 161.2 | -73.3 | 171.4 | 0 | 0 | 0 | 108.9 | A307 | A307-L309 PolarHBondContact O-N 3.21Š|
| 310 | P | 66.6 | Low | 57.7 | Low | 122 Ų | 122 | 135.4 Ų | 135.4 | 79% | 0.792 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -71.6 | 138.8 | -172 | 27.9 | -33.3 | 0 | 0 | 0 | 112.2 | ||
| 311 | S | 61 | Low | 57.8 | Low | 90 Ų | 90 | 140.2 Ų | 140.2 | 63% | 0.629 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -52.5 | 141.5 | 173.9 | -173.2 | 0 | 0 | 0 | 0 | 112.8 | D313 | S311-D313 PolarHBondContact O-N 3.18Å; S311-D313 PolarHBondContact OG-OD2 3.04Å |
| 312 | A | 61.8 | Low | 58.3 | Low | 85 Ų | 85 | 144.3 Ų | 144.3 | 70% | 0.702 | 80% | 0.802 | S | S | * | * | G | 310 helix | trans | -63.8 | -3.7 | -177.3 | 0 | 0 | 0 | 0 | 0 | 115.1 | K314 | A312-K314 PolarHBondContact O-N 3.05Š|
| 313 | D | 60.8 | Low | 59.4 | Low | 140 Ų | 140 | 149 Ų | 149 | 75% | 0.749 | 81% | 0.814 | S | S | * | * | G | 310 helix | trans | -80.9 | -2.6 | -172.8 | -72.8 | -52.3 | 0 | 0 | 0 | 116.1 | S311 | S311-D313 PolarHBondContact O-N 3.18Å; S311-D313 PolarHBondContact OG-OD2 3.04Å |
| 314 | K | 61 | Low | 60.5 | Low | 195 Ų | 195 | 147.9 Ų | 147.9 | 85% | 0.848 | 81% | 0.809 | S | S | * | * | G | 310 helix | trans | -98.4 | -4.9 | -179.2 | -85.4 | -176.4 | 178.6 | 178 | 0 | 116.2 | A312 | A312-K314 PolarHBondContact O-N 3.05Š|
| 315 | I | 60.7 | Low | 61.7 | Low | 154 Ų | 154 | 150.6 Ų | 150.6 | 79% | 0.79 | 81% | 0.814 | S | S | * | * | S | Bend | trans | -89.4 | -15 | -178.2 | -57.3 | 177.7 | 0 | 0 | 0 | 112.2 | K317 | I315-K317 VanDerWaalsContact C-N 3.35Å; I315-K317 PolarHBondContact O-N 3.25Å |
| 316 | A | 61.4 | Low | 62.4 | Low | 91 Ų | 91 | 155.2 Ų | 155.2 | 75% | 0.752 | 82% | 0.82 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.6 | 5.2 | -174 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||
| 317 | K | 64.6 | Low | 63.2 | Low | 186 Ų | 186 | 155.6 Ų | 155.6 | 81% | 0.809 | 82% | 0.819 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -116.2 | 7.4 | -170.4 | -108.3 | 177.2 | -179.3 | 175.2 | 0 | 117.4 | I315 | I315-K317 VanDerWaalsContact C-N 3.35Å; I315-K317 PolarHBondContact O-N 3.25Å |
| 318 | Q | 61.2 | Low | 64 | Low | 184 Ų | 184 | 156.6 Ų | 156.6 | 86% | 0.86 | 82% | 0.817 | S | S | * | * | S | Bend | trans | -110.8 | 5.5 | -177.1 | -75.6 | -125.5 | 20.2 | 0 | 0 | 115.8 | ||
| 319 | L | 59.3 | Low | 64.7 | Low | 173 Ų | 173 | 156.6 Ų | 156.6 | 91% | 0.906 | 82% | 0.815 | S | S | * | * | S | Bend | trans | -110.5 | 4.8 | -178.3 | -83.7 | 160 | 0 | 0 | 0 | 115.5 | R321 | L319-R321 PolarHBondContact O-N 3.19Š|
| 320 | E | 59.1 | Low | 65.2 | Low | 174 Ų | 174 | 155.4 Ų | 155.4 | 81% | 0.813 | 81% | 0.814 | S | S | * | * | trans | -94.1 | 91.8 | 173 | -69.3 | -173.1 | 128 | 0 | 0 | 111.3 | ||||
| 321 | R | 56.5 | Low | 65.4 | Low | 244 Ų | 244 | 156 Ų | 156 | 92% | 0.921 | 82% | 0.816 | S | S | * | * | trans | 178.8 | 87.2 | 151 | -104.3 | 172.8 | -176.9 | -166.2 | 1.4 | 110.9 | L319 | L319-R321 PolarHBondContact O-N 3.19Š| ||
| 322 | K | 63.1 | Low | 65.7 | Low | 212 Ų | 212 | 161.3 Ų | 161.3 | 92% | 0.922 | 83% | 0.827 | S | S | * | * | trans | -142.9 | 122.2 | 143.5 | -77.2 | -162.3 | 177.5 | 176.9 | 0 | 108.7 | ||||
| 323 | E | 71.5 | Confident | 66 | Low | 188 Ų | 188 | 167.5 Ų | 167.5 | 88% | 0.879 | 84% | 0.839 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 146.9 | -172.3 | -62.4 | 175.6 | 133.7 | 0 | 0 | 112.4 | ||
| 324 | P | 71.6 | Confident | 66.1 | Low | 117 Ų | 117 | 164.2 Ų | 164.2 | 76% | 0.76 | 84% | 0.838 | S | S | * | * | P | Polyproline II helix | trans | -71.8 | 142 | 174.8 | 29.1 | -33.1 | 0 | 0 | 0 | 111.3 | ||
| 325 | P | 73.1 | Confident | 66.2 | Low | 127 Ų | 127 | 166.9 Ų | 166.9 | 83% | 0.825 | 84% | 0.842 | S | S | * | * | P | Polyproline II helix | trans | -66.1 | 146.4 | 173.5 | 26.1 | -32 | 0 | 0 | 0 | 112.1 | ||
| 326 | K | 71.7 | Confident | 66.1 | Low | 206 Ų | 206 | 166.9 Ų | 166.9 | 90% | 0.896 | 84% | 0.843 | S | S | * | * | P | Polyproline II helix | trans | -59.7 | 145.9 | -176.8 | -70.6 | 171.5 | 177.7 | 172.5 | 0 | 112.9 | ||
| 327 | K | 67.2 | Low | 66.2 | Low | 201 Ų | 201 | 167.1 Ų | 167.1 | 87% | 0.874 | 84% | 0.84 | S | S | * | * | trans | -39.1 | 138.5 | -178.6 | -66.2 | 173.7 | 178.3 | 177.8 | 0 | 115.1 | ||||
| 328 | P | 70.9 | Confident | 66.1 | Low | 116 Ų | 116 | 167.5 Ų | 167.5 | 75% | 0.753 | 84% | 0.841 | S | S | * | * | trans | -72.7 | 154.1 | 165.5 | 29.6 | -32.1 | 0 | 0 | 0 | 111.9 | ||||
| 329 | P | 73.7 | Confident | 66.3 | Low | 118 Ų | 118 | 168 Ų | 168 | 77% | 0.766 | 84% | 0.841 | S | S | * | * | trans | -66.6 | 136.9 | 178.9 | 26.7 | -33.3 | 0 | 0 | 0 | 112 | V331 | P329-V331 PolarHBondContact O-N 2.81Š| ||
| 330 | T | 73.3 | Confident | 66.5 | Low | 140 Ų | 140 | 171.2 Ų | 171.2 | 86% | 0.859 | 86% | 0.859 | S | S | * | * | trans | -67.1 | 114.3 | 174.1 | 47.2 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 331 | V | 69.4 | Low | 66.9 | Low | 136 Ų | 136 | 171.1 Ų | 171.1 | 82% | 0.824 | 86% | 0.862 | S | S | * | * | trans | -88.4 | 125.5 | 169.5 | -162.7 | 0 | 0 | 0 | 0 | 108.8 | P329 | P329-V331 PolarHBondContact O-N 2.81Š| ||
| 332 | K | 68.5 | Low | 67.4 | Low | 200 Ų | 200 | 167.3 Ų | 167.3 | 87% | 0.87 | 86% | 0.859 | S | S | * | * | trans | -66 | 129.8 | 178.8 | -70.3 | 177 | 177.1 | 175.5 | 0 | 110.2 | G334 | K332-G334 PolarHBondContact O-N 2.78Å; K332-G334 VanDerWaalsContact O-N 3.15Å | ||
| 333 | K | 66.9 | Low | 67.7 | Low | 216 Ų | 216 | 164.8 Ų | 164.8 | 94% | 0.939 | 86% | 0.855 | S | S | * | * | trans | -60.4 | 109.1 | 170.6 | -77.2 | 176.5 | 175.6 | 175.4 | 0 | 110.1 | ||||
| 334 | G | 62.6 | Low | 67.4 | Low | 71 Ų | 71 | 163.4 Ų | 163.4 | 73% | 0.732 | 85% | 0.854 | S | S | * | * | trans | -86.8 | 128.6 | 162.8 | 0 | 0 | 0 | 0 | 0 | 109.9 | K332 L336 | K332-G334 PolarHBondContact O-N 2.78Å; K332-G334 VanDerWaalsContact O-N 3.15Å; G334-L336 PolarHBondContact O-N 2.75Å | ||
| 335 | R | 63.1 | Low | 67.2 | Low | 250 Ų | 250 | 166.3 Ų | 166.3 | 94% | 0.943 | 86% | 0.86 | S | S | * | * | trans | -69.9 | 114.8 | -176.3 | -154.4 | 178.8 | -168.8 | -175.8 | 2.3 | 109.6 | ||||
| 336 | L | 58.4 | Low | 66.8 | Low | 155 Ų | 155 | 168.9 Ų | 168.9 | 81% | 0.812 | 86% | 0.862 | S | S | * | * | trans | -88.2 | 113.3 | 166.5 | -127.4 | 85.3 | 0 | 0 | 0 | 108.2 | G334 | G334-L336 PolarHBondContact O-N 2.75Š| ||
| 337 | S | 63.6 | Low | 66.4 | Low | 96 Ų | 96 | 166.3 Ų | 166.3 | 67% | 0.671 | 86% | 0.86 | S | S | * | * | trans | -83.2 | 116.8 | 167.3 | 47.5 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 338 | F | 63.7 | Low | 66.4 | Low | 193 Ų | 193 | 163.6 Ų | 163.6 | 85% | 0.846 | 86% | 0.858 | S | S | * | * | trans | -72.8 | 131.5 | 160.2 | -85.3 | -99.5 | 0 | 0 | 0 | 108.8 | ||||
| 339 | F | 64.8 | Low | 66 | Low | 195 Ų | 195 | 167.6 Ų | 167.6 | 86% | 0.855 | 87% | 0.867 | S | S | * | * | trans | -119.9 | 131.8 | 156.1 | -92.8 | -87.9 | 0 | 0 | 0 | 107.2 | ||||
| 340 | N | 64.1 | Low | 65.3 | Low | 241 Ų | 241 | 172.1 Ų | 172.1 | 100% | 1.289 | 88% | 0.876 | S | S | * | * | trans | -54.1 | 0 | 178.6 | -81.8 | -40.5 | 0 | 0 | 0 | 113.7 |
Retrieved 340 of 340 residues in 658.8 ms
(Link to these results)