| 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 | 28.7 | Very low | 28 | Very low | 244 Ų | 244 | 148.4 Ų | 148.4 | 100% | 1.202 | 72% | 0.718 | S | S | * | * | 0 | 110.6 | 0 | -79.5 | 175.4 | 174.5 | 0 | 0 | 109.2 | |||||
| 2 | I | 22.9 | Very low | 28.3 | Very low | 148 Ų | 148 | 142.5 Ų | 142.5 | 76% | 0.759 | 68% | 0.682 | S | S | * | * | trans | -142.5 | 117.6 | 157.8 | -58.6 | 177.4 | 0 | 0 | 0 | 105.3 | R4 | I2-R4 PolarHBondContact O-N 3.09Š| ||
| 3 | P | 24 | Very low | 28.3 | Very low | 120 Ų | 120 | 141.7 Ų | 141.7 | 78% | 0.779 | 68% | 0.677 | S | S | * | * | trans | -70.9 | 102.3 | 175 | 28.7 | -30.1 | 0 | 0 | 0 | 108.1 | R5 | P3-R5 VanDerWaalsContact C-N 3.33Å; P3-R5 PolarHBondContact O-N 3.45Å | ||
| 4 | R | 26.3 | Very low | 28.5 | Very low | 237 Ų | 237 | 144.1 Ų | 144.1 | 89% | 0.894 | 70% | 0.695 | S | S | * | * | trans | -74 | 87.7 | 170.4 | -76.8 | -179.3 | 167.1 | 155.5 | -3.8 | 108.4 | I2 R6 | I2-R4 PolarHBondContact O-N 3.09Å; R4-R6 PolarHBondContact O-N 2.79Å | ||
| 5 | R | 25.3 | Very low | 28.8 | Very low | 201 Ų | 201 | 137.3 Ų | 137.3 | 76% | 0.758 | 67% | 0.671 | S | S | * | * | trans | -68.7 | 110.4 | 165.4 | -86.7 | -175.6 | 172.8 | 178.2 | -1.4 | 108.4 | P3 L7 | P3-R5 VanDerWaalsContact C-N 3.33Å; P3-R5 PolarHBondContact O-N 3.45Å; R5-L7 PolarHBondContact O-N 3.3Å | ||
| 6 | R | 29.2 | Very low | 29.1 | Very low | 246 Ų | 246 | 134.6 Ų | 134.6 | 93% | 0.928 | 66% | 0.661 | S | S | * | * | trans | -80.9 | 101.7 | 175.6 | -120.8 | 178.6 | 178.6 | -172.9 | -0.4 | 107.1 | R4 | R4-R6 PolarHBondContact O-N 2.79Š| ||
| 7 | L | 28.4 | Very low | 29.5 | Very low | 96 Ų | 96 | 131.7 Ų | 131.7 | 50% | 0.503 | 65% | 0.654 | S | S | . | * | trans | -83.6 | 116 | 167.2 | -94 | 153.1 | 0 | 0 | 0 | 108.3 | R5 | R5-L7 PolarHBondContact O-N 3.3Š| ||
| 8 | S | 31 | Very low | 29.7 | Very low | 82 Ų | 82 | 132.5 Ų | 132.5 | 57% | 0.573 | 66% | 0.656 | S | S | * | * | trans | -75 | 131.3 | -165.2 | 42.1 | 0 | 0 | 0 | 0 | 112.8 | L10 | S8-L10 PolarHBondContact O-N 2.87Š| ||
| 9 | L | 30.5 | Very low | 29.8 | Very low | 53 Ų | 53 | 127.8 Ų | 127.8 | 28% | 0.277 | 64% | 0.637 | S | S | . | * | trans | -80.5 | 35.7 | 179.3 | -134.8 | 133.1 | 0 | 0 | 0 | 113.8 | A11 W12 V55 W57 | L9-A11 PolarHBondContact O-N 3.33Å; L9-W12 HydrophobicContact CD2-CB 4.46Å; L9-V55 HydrophobicContact CD1-CB 3.16Å; L9-V55 HydrophobicContact CD1-CG1 3.49Å; L9-V55 VanDerWaalsContact CD1-CG1 3.49Å; L9-V55 HydrophobicContact CD1-CG2 3.29Å; L9-W57 HydrophobicContact CD1-CE3 3.98Å; L9-W57 HydrophobicContact CD1-CZ3 4.15Å; L9-W57 HydrophobicContact CD2-CD2 4.01Å; L9-W57 HydrophobicContact CD2-CE3 3.18Å; L9-W57 HydrophobicContact CD2-CZ3 3.54Å; L9-W57 HydrophobicContact CG-CE3 4.18Å; L9-W57 HydrophobicContact CG-CZ3 4.35Å | ||
| 10 | L | 28.3 | Very low | 30 | Very low | 157 Ų | 157 | 125.6 Ų | 125.6 | 82% | 0.822 | 63% | 0.63 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.7 | 7.5 | -168.3 | -97.2 | 161.2 | 0 | 0 | 0 | 114.8 | S8 | S8-L10 PolarHBondContact O-N 2.87Š|
| 11 | A | 33 | Very low | 30.3 | Very low | 48 Ų | 48 | 119.9 Ų | 119.9 | 40% | 0.397 | 60% | 0.603 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -111.8 | 1.4 | -169.8 | 0 | 0 | 0 | 0 | 0 | 115.5 | L9 A21 | L9-A11 PolarHBondContact O-N 3.33Å; A11-A21 HydrophobicContact CB-CB 3.74Å |
| 12 | W | 32.4 | Very low | 30.6 | Very low | 78 Ų | 78 | 111.3 Ų | 111.3 | 30% | 0.295 | 57% | 0.566 | S | S | . | * | S | Bend | trans | -101 | -18.8 | -167.7 | -101 | 77.5 | 0 | 0 | 0 | 116.7 | L9 A21 V39 W57 | L9-W12 HydrophobicContact CD2-CB 4.46Å; W12-A21 VanDerWaalsContact CD1-CB 3.42Å; W12-A21 HydrophobicContact CG-CB 4.31Å; W12-V39 HydrophobicContact CH2-CG2 3.6Å; W12-V39 HydrophobicContact CZ2-CG2 3.92Å; W12-W57 HydrophobicContact CD2-CH2 4.17Å; W12-W57 HydrophobicContact CD2-CZ2 4.1Å; W12-W57 HydrophobicContact CE3-CH2 4.48Å; W12-W57 AromaticContact CE3-CZ2 3.95Å; W12-W57 HydrophobicContact CE3-CZ2 3.95Å; W12-W57 HydrophobicContact CZ3-CZ2 4.17Å |
| 13 | E | 28.3 | Very low | 31.4 | Very low | 132 Ų | 132 | 107.3 Ų | 107.3 | 62% | 0.617 | 55% | 0.546 | S | S | * | . | S | Bend | trans | -101.9 | -8.1 | -168.4 | -75.2 | -169.3 | 146.2 | 0 | 0 | 116.5 | P60 | E13-P60 WeakPolarHBondContact OE1-CD 3.41Š|
| 14 | L | 31.1 | Very low | 31.8 | Very low | 176 Ų | 176 | 104.3 Ų | 104.3 | 92% | 0.921 | 53% | 0.526 | S | S | * | . | S | Bend | trans | -115.7 | 13 | 175.9 | -84.5 | 155.9 | 0 | 0 | 0 | 112.7 | D16 | L14-D16 PolarHBondContact O-N 3.49Š|
| 15 | A | 33 | Very low | 32.2 | Very low | 41 Ų | 41 | 97.1 Ų | 97.1 | 34% | 0.339 | 51% | 0.505 | S | S | . | . | trans | -82.8 | 98.5 | -174.1 | 0 | 0 | 0 | 0 | 0 | 109.5 | S19 | A15-S19 VanDerWaalsContact C-CB 3.48Å; A15-S19 WeakPolarHBondContact CA-OG 2.85Å | ||
| 16 | D | 33.3 | Very low | 32.6 | Very low | 95 Ų | 95 | 93 Ų | 93 | 51% | 0.508 | 50% | 0.498 | S | S | . | . | trans | -35 | 149.5 | 157.9 | -168.3 | -65.3 | 0 | 0 | 0 | 110.3 | L14 H18 S19 | L14-D16 PolarHBondContact O-N 3.49Å; D16-H18 CarbonylContact O-C 3.56Å; D16-H18 PolarHBondContact O-N 2.99Å; D16-H18 IonicContact OD1-CD2 3.48Å; D16-H18 PolarHBondContact OD1-CD2 2.07Å; D16-H18 IonicContact OD1-CG 3.93Å; D16-H18 PolarHBondContact OD1-N 3.27Å; D16-S19 WeakPolarHBondContact CB-OG 3.47Å; D16-S19 PolarHBondContact N-OG 3.2Å; D16-S19 VanDerWaalsContact N-OG 3.1Å; D16-S19 WeakPolarHBondContact O-CB 3.26Å; D16-S19 PolarHBondContact O-N 3Å; D16-S19 PolarHBondContact O-OG 3.47Å | ||
| 17 | P | 36.6 | Very low | 32.9 | Very low | 85 Ų | 85 | 85 Ų | 85 | 55% | 0.552 | 48% | 0.48 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -47.6 | -13.1 | 174.3 | 15 | -29.8 | 0 | 0 | 0 | 115.5 | ||
| 18 | H | 33.2 | Very low | 33.2 | Very low | 146 Ų | 146 | 84.7 Ų | 84.7 | 68% | 0.676 | 49% | 0.486 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -97.7 | 9.8 | 170.3 | -60.7 | -50.7 | 0 | 0 | 0 | 117.2 | D16 | D16-H18 CarbonylContact O-C 3.56Å; D16-H18 PolarHBondContact O-N 2.99Å; D16-H18 IonicContact OD1-CD2 3.48Å; D16-H18 PolarHBondContact OD1-CD2 2.07Å; D16-H18 IonicContact OD1-CG 3.93Å; D16-H18 PolarHBondContact OD1-N 3.27Å |
| 19 | S | 31.1 | Very low | 33.6 | Very low | 43 Ų | 43 | 87.1 Ų | 87.1 | 30% | 0.301 | 48% | 0.482 | S | S | . | . | trans | -99.6 | 129.9 | -167.5 | -70.4 | 0 | 0 | 0 | 0 | 113.2 | A15 D16 | A15-S19 VanDerWaalsContact C-CB 3.48Å; A15-S19 WeakPolarHBondContact CA-OG 2.85Å; D16-S19 WeakPolarHBondContact CB-OG 3.47Å; D16-S19 PolarHBondContact N-OG 3.2Å; D16-S19 VanDerWaalsContact N-OG 3.1Å; D16-S19 WeakPolarHBondContact O-CB 3.26Å; D16-S19 PolarHBondContact O-N 3Å; D16-S19 PolarHBondContact O-OG 3.47Å | ||
| 20 | V | 34.2 | Very low | 33.8 | Very low | 83 Ų | 83 | 85.6 Ų | 85.6 | 50% | 0.503 | 48% | 0.476 | S | S | . | . | trans | -98.1 | 114 | -171.6 | 179.9 | 0 | 0 | 0 | 0 | 110 | M31 I33 | V20-M31 HydrophobicContact CG1-SD 4.37Å; V20-I33 HydrophobicContact CG1-CD1 4.42Å; V20-I33 HydrophobicContact CG1-CG1 3.97Å; V20-I33 HydrophobicContact CG2-CG2 4.18Å | ||
| 21 | A | 36.2 | Very low | 34.3 | Very low | 6 Ų | 6 | 81.3 Ų | 81.3 | 5% | 0.05 | 45% | 0.452 | C | S | . | . | trans | -94.1 | 100 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | A11 W12 L23 | A11-A21 HydrophobicContact CB-CB 3.74Å; W12-A21 VanDerWaalsContact CD1-CB 3.42Å; W12-A21 HydrophobicContact CG-CB 4.31Å; A21-L23 PolarHBondContact O-N 3.17Å; A21-L23 VanDerWaalsContact O-N 3.17Å | ||
| 22 | C | 33.9 | Very low | 34.6 | Very low | 64 Ų | 64 | 79.5 Ų | 79.5 | 43% | 0.432 | 44% | 0.438 | S | S | . | . | trans | -77.2 | 100.9 | 177.3 | -168 | 0 | 0 | 0 | 0 | 111.2 | M31 | C22-M31 HydrophobicContact CB-CG 4.21Š| ||
| 23 | L | 39.9 | Very low | 34.9 | Very low | 65 Ų | 65 | 78.3 Ų | 78.3 | 34% | 0.34 | 44% | 0.436 | S | S | . | . | trans | -93.6 | 100.8 | 172 | -80.1 | 159.1 | 0 | 0 | 0 | 110.2 | A21 | A21-L23 PolarHBondContact O-N 3.17Å; A21-L23 VanDerWaalsContact O-N 3.17Å | ||
| 24 | T | 32.1 | Very low | 35.3 | Very low | 57 Ų | 57 | 73.2 Ų | 73.2 | 35% | 0.35 | 42% | 0.415 | S | S | . | . | trans | -97.8 | 136.3 | 171.1 | 57.9 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 25 | N | 35.1 | Very low | 35.4 | Very low | 86 Ų | 86 | 69.3 Ų | 69.3 | 46% | 0.46 | 40% | 0.395 | S | S | . | . | trans | -86 | 177.4 | 160.2 | 88 | -11.7 | 0 | 0 | 0 | 109.1 | S27 S28 | N25-S27 PolarHBondContact O-N 3.25Å; N25-S27 PolarHBondContact OD1-N 3.1Å; N25-S27 PolarHBondContact OD1-OG 3.36Å; N25-S28 PolarHBondContact O-N 3.21Å | ||
| 26 | D | 34.7 | Very low | 35.6 | Very low | 113 Ų | 113 | 74 Ų | 74 | 60% | 0.604 | 41% | 0.414 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -52.3 | -7.4 | -177.9 | -68.9 | -41.4 | 0 | 0 | 0 | 115.9 | ||
| 27 | S | 34.7 | Very low | 35.7 | Very low | 79 Ų | 79 | 72.9 Ų | 72.9 | 55% | 0.552 | 43% | 0.426 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -105.2 | 12.6 | 172.2 | 23 | 0 | 0 | 0 | 0 | 116 | N25 R29 | N25-S27 PolarHBondContact O-N 3.25Å; N25-S27 PolarHBondContact OD1-N 3.1Å; N25-S27 PolarHBondContact OD1-OG 3.36Å; S27-R29 WeakPolarHBondContact O-CG 3.46Å; S27-R29 PolarHBondContact O-N 2.71Å; S27-R29 VanDerWaalsContact O-N 3.11Å |
| 28 | S | 35.5 | Very low | 35.6 | Very low | 90 Ų | 90 | 72.9 Ų | 72.9 | 63% | 0.629 | 42% | 0.424 | S | S | * | . | trans | 58.5 | 21.8 | 160.6 | -43 | 0 | 0 | 0 | 0 | 118.6 | N25 | N25-S28 PolarHBondContact O-N 3.21Š| ||
| 29 | R | 38.9 | Very low | 35.9 | Very low | 133 Ų | 133 | 67.6 Ų | 67.6 | 50% | 0.502 | 40% | 0.402 | S | S | . | . | trans | -134.3 | 11.9 | -168.2 | -69.6 | -175.4 | -172 | -166.3 | -1.2 | 118.6 | S27 G46 | S27-R29 WeakPolarHBondContact O-CG 3.46Å; S27-R29 PolarHBondContact O-N 2.71Å; S27-R29 VanDerWaalsContact O-N 3.11Å; R29-G46 PolarHBondContact NH1-O 3.14Å | ||
| 30 | C | 34.6 | Very low | 36.1 | Very low | 20 Ų | 20 | 72.1 Ų | 72.1 | 14% | 0.135 | 42% | 0.416 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.2 | 140.5 | 172.2 | -57.9 | 0 | 0 | 0 | 0 | 109.6 | C50 | C30-C50 HydrophobicContact CB-CB 4.28Å; C30-C50 WeakPolarHBondContact CB-SG 2.95Å; C30-C50 VanDerWaalsContact SG-CA 3.53Å; C30-C50 WeakPolarHBondContact SG-CB 3.19Å; C30-C50 CovalentContact SG-SG 2.06Å; C30-C50 PolarHBondContact SG-SG 3.48Å |
| 31 | M | 37.9 | Very low | 36.4 | Very low | 67 Ų | 67 | 71 Ų | 71 | 33% | 0.33 | 42% | 0.415 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -132 | 127.5 | 178.9 | -168.2 | -179.2 | -60.6 | 0 | 0 | 107.9 | V20 C22 I33 T42 | V20-M31 HydrophobicContact CG1-SD 4.37Å; C22-M31 HydrophobicContact CB-CG 4.21Å; M31-I33 HydrophobicContact CG-CG1 4.32Å; M31-I33 HydrophobicContact SD-CD1 4.37Å; M31-T42 PolarHBondContact O-N 3.28Å |
| 32 | A | 40.5 | Very low | 36.4 | Very low | 11 Ų | 11 | 74.9 Ų | 74.9 | 9% | 0.091 | 44% | 0.439 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.1 | 134.6 | 172.4 | 0 | 0 | 0 | 0 | 0 | 108.3 | V39 | A32-V39 HydrophobicContact CB-CG1 4.29Å |
| 33 | I | 37.7 | Very low | 36.6 | Very low | 52 Ų | 52 | 76.4 Ų | 76.4 | 27% | 0.267 | 44% | 0.438 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.1 | 124.1 | -178.7 | -55.1 | -177.2 | 0 | 0 | 0 | 106.8 | V20 M31 L35 K40 | V20-I33 HydrophobicContact CG1-CD1 4.42Å; V20-I33 HydrophobicContact CG1-CG1 3.97Å; V20-I33 HydrophobicContact CG2-CG2 4.18Å; M31-I33 HydrophobicContact CG-CG1 4.32Å; M31-I33 HydrophobicContact SD-CD1 4.37Å; I33-L35 HydrophobicContact CG2-CD1 4.39Å; I33-K40 PolarHBondContact N-O 3.17Å; I33-K40 PolarHBondContact O-N 3.19Å; I33-K40 VanDerWaalsContact O-O 3.05Å |
| 34 | S | 37.5 | Very low | 36.4 | Very low | 26 Ų | 26 | 77 Ų | 77 | 18% | 0.182 | 44% | 0.441 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.8 | 128.8 | 168.1 | -171.8 | 0 | 0 | 0 | 0 | 108.9 | V38 | S34-V38 WeakPolarHBondContact CA-O 3.37Å |
| 35 | L | 32.6 | Very low | 36.5 | Very low | 93 Ų | 93 | 80.4 Ų | 80.4 | 49% | 0.487 | 46% | 0.464 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.1 | 123.1 | 166.1 | -96.9 | 148.5 | 0 | 0 | 0 | 105.5 | I33 G37 V38 | I33-L35 HydrophobicContact CG2-CD1 4.39Å; L35-G37 PolarHBondContact O-N 3.16Å; L35-V38 PolarHBondContact N-O 3.13Å; L35-V38 VanDerWaalsContact N-O 3.14Å; L35-V38 PolarHBondContact O-N 2.72Å; L35-V38 VanDerWaalsContact O-N 3.13Å |
| 36 | D | 36.4 | Very low | 36.4 | Very low | 139 Ų | 139 | 79 Ų | 79 | 74% | 0.743 | 47% | 0.469 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 57 | 40.1 | 178 | -64.1 | -35.7 | 0 | 0 | 0 | 115.7 | V38 | D36-V38 PolarHBondContact O-N 3.38Å; D36-V38 VanDerWaalsContact O-N 3.16Å |
| 37 | G | 35.7 | Very low | 36.5 | Very low | 73 Ų | 73 | 74.9 Ų | 74.9 | 75% | 0.753 | 45% | 0.45 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 74.5 | 0.4 | -179.8 | 0 | 0 | 0 | 0 | 0 | 114.2 | L35 | L35-G37 PolarHBondContact O-N 3.16Š|
| 38 | V | 34.4 | Very low | 36.7 | Very low | 85 Ų | 85 | 77.3 Ų | 77.3 | 52% | 0.515 | 46% | 0.464 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.9 | 114.1 | 170.3 | -174.7 | 0 | 0 | 0 | 0 | 108.5 | S34 L35 D36 K40 | S34-V38 WeakPolarHBondContact CA-O 3.37Å; L35-V38 PolarHBondContact N-O 3.13Å; L35-V38 VanDerWaalsContact N-O 3.14Å; L35-V38 PolarHBondContact O-N 2.72Å; L35-V38 VanDerWaalsContact O-N 3.13Å; D36-V38 PolarHBondContact O-N 3.38Å; D36-V38 VanDerWaalsContact O-N 3.16Å; V38-K40 HydrophobicContact CG1-CG 4.3Å; V38-K40 PolarHBondContact O-N 3.03Å |
| 39 | V | 40.2 | Very low | 36.7 | Very low | 35 Ų | 35 | 76.1 Ų | 76.1 | 21% | 0.212 | 46% | 0.455 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -78.2 | 111.9 | 172.7 | -177.2 | 0 | 0 | 0 | 0 | 108.8 | W12 A32 L83 | W12-V39 HydrophobicContact CH2-CG2 3.6Å; W12-V39 HydrophobicContact CZ2-CG2 3.92Å; A32-V39 HydrophobicContact CB-CG1 4.29Å; V39-L83 HydrophobicContact CB-CD2 4.12Å; V39-L83 HydrophobicContact CG2-CD2 4.07Å |
| 40 | K | 35.3 | Very low | 36.5 | Very low | 138 Ų | 138 | 70.9 Ų | 70.9 | 60% | 0.6 | 44% | 0.439 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -102.9 | 117 | 171.1 | -73 | -177.2 | 177.3 | 173.6 | 0 | 109.3 | I33 V38 | I33-K40 PolarHBondContact N-O 3.17Å; I33-K40 PolarHBondContact O-N 3.19Å; I33-K40 VanDerWaalsContact O-O 3.05Å; V38-K40 HydrophobicContact CG1-CG 4.3Å; V38-K40 PolarHBondContact O-N 3.03Å |
| 41 | A | 40.4 | Very low | 36.5 | Very low | 59 Ų | 59 | 76.5 Ų | 76.5 | 49% | 0.488 | 46% | 0.458 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.3 | 126.7 | 170.2 | 0 | 0 | 0 | 0 | 0 | 109.5 | L52 | A41-L52 HydrophobicContact CB-CD1 3.3Å |
| 42 | T | 36.4 | Very low | 36.5 | Very low | 88 Ų | 88 | 75.5 Ų | 75.5 | 54% | 0.54 | 45% | 0.453 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.9 | 131.8 | 176.2 | -79.8 | 0 | 0 | 0 | 0 | 109.4 | M31 | M31-T42 PolarHBondContact O-N 3.28Å |
| 43 | F | 37.4 | Very low | 36.1 | Very low | 96 Ų | 96 | 81.6 Ų | 81.6 | 42% | 0.421 | 48% | 0.483 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -75.2 | 134.1 | 173.1 | -106.4 | -90.5 | 0 | 0 | 0 | 110.7 | S47 C50 | F43-S47 VanDerWaalsContact CE1-O 3.26Å; F43-S47 WeakPolarHBondContact CE1-O 3.17Å; F43-C50 HydrophobicContact CD1-CB 4.41Å; F43-C50 VanDerWaalsContact CD1-SG 3.52Å; F43-C50 HydrophobicContact CD2-CB 3.98Å; F43-C50 HydrophobicContact CE1-CB 3.83Å; F43-C50 WeakPolarHBondContact CE1-SG 3.47Å; F43-C50 HydrophobicContact CE2-CB 3.37Å; F43-C50 HydrophobicContact CG-CB 4.5Å; F43-C50 HydrophobicContact CZ-CB 3.33Å; F43-C50 VanDerWaalsContact CZ-SG 3.59Å |
| 44 | L | 35.2 | Very low | 36.1 | Very low | 77 Ų | 77 | 80.4 Ų | 80.4 | 40% | 0.403 | 48% | 0.478 | S | S | . | . | P | Polyproline II helix | trans | -85.5 | 138.6 | 163 | -72.8 | 159.5 | 0 | 0 | 0 | 109.3 | G46 | L44-G46 PolarHBondContact O-N 3.36Š|
| 45 | P | 34.9 | Very low | 35.9 | Very low | 129 Ų | 129 | 82 Ų | 82 | 84% | 0.838 | 49% | 0.486 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.6 | 132.2 | -179.8 | 22.1 | -31 | 0 | 0 | 0 | 110.9 | ||
| 46 | G | 33.9 | Very low | 36 | Very low | 55 Ų | 55 | 82 Ų | 82 | 57% | 0.567 | 49% | 0.493 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 100.6 | 11.8 | 179.2 | 0 | 0 | 0 | 0 | 0 | 116.2 | R29 L44 | R29-G46 PolarHBondContact NH1-O 3.14Å; L44-G46 PolarHBondContact O-N 3.36Å |
| 47 | S | 36.1 | Very low | 36 | Very low | 27 Ų | 27 | 78.4 Ų | 78.4 | 19% | 0.189 | 47% | 0.47 | C | S | . | . | trans | -105.3 | 122.1 | 168.5 | -163.8 | 0 | 0 | 0 | 0 | 110.5 | F43 S49 | F43-S47 VanDerWaalsContact CE1-O 3.26Å; F43-S47 WeakPolarHBondContact CE1-O 3.17Å; S47-S49 PolarHBondContact O-N 2.77Å; S47-S49 PolarHBondContact OG-O 3.48Å | ||
| 48 | P | 39 | Very low | 35.9 | Very low | 130 Ų | 130 | 84.9 Ų | 84.9 | 84% | 0.844 | 47% | 0.472 | S | S | * | . | S | Bend | trans | -78.3 | -5.7 | 179.9 | 29.9 | -33.3 | 0 | 0 | 0 | 113.3 | ||
| 49 | S | 35.3 | Very low | 35.7 | Very low | 65 Ų | 65 | 82.6 Ų | 82.6 | 46% | 0.455 | 46% | 0.459 | S | S | . | . | trans | -159.6 | 127.5 | -179 | -44.3 | 0 | 0 | 0 | 0 | 110 | S47 | S47-S49 PolarHBondContact O-N 2.77Å; S47-S49 PolarHBondContact OG-O 3.48Å | ||
| 50 | C | 34.3 | Very low | 35.4 | Very low | 24 Ų | 24 | 86 Ų | 86 | 16% | 0.162 | 48% | 0.482 | C | S | . | . | trans | -108.3 | 129.3 | 163.7 | -83.9 | 0 | 0 | 0 | 0 | 107.4 | C30 F43 | C30-C50 HydrophobicContact CB-CB 4.28Å; C30-C50 WeakPolarHBondContact CB-SG 2.95Å; C30-C50 VanDerWaalsContact SG-CA 3.53Å; C30-C50 WeakPolarHBondContact SG-CB 3.19Å; C30-C50 CovalentContact SG-SG 2.06Å; C30-C50 PolarHBondContact SG-SG 3.48Å; F43-C50 HydrophobicContact CD1-CB 4.41Å; F43-C50 VanDerWaalsContact CD1-SG 3.52Å; F43-C50 HydrophobicContact CD2-CB 3.98Å; F43-C50 HydrophobicContact CE1-CB 3.83Å; F43-C50 WeakPolarHBondContact CE1-SG 3.47Å; F43-C50 HydrophobicContact CE2-CB 3.37Å; F43-C50 HydrophobicContact CG-CB 4.5Å; F43-C50 HydrophobicContact CZ-CB 3.33Å; F43-C50 VanDerWaalsContact CZ-SG 3.59Å | ||
| 51 | W | 34.6 | Very low | 35.2 | Very low | 138 Ų | 138 | 81.9 Ų | 81.9 | 52% | 0.523 | 47% | 0.47 | S | S | . | . | trans | -114.3 | 115.6 | 170.1 | -60.5 | 90.5 | 0 | 0 | 0 | 105.5 | L53 R73 | W51-L53 PolarHBondContact O-N 3.32Å; W51-R73 HydrophobicContact CE3-CG 4.28Å; W51-R73 HydrophobicContact CH2-CG 4.45Å; W51-R73 HydrophobicContact CZ3-CG 3.88Å; W51-R73 VanDerWaalsContact CZ3-NE 3.28Å | ||
| 52 | L | 37.7 | Very low | 34.7 | Very low | 46 Ų | 46 | 83.4 Ų | 83.4 | 24% | 0.241 | 48% | 0.483 | C | S | . | . | trans | -82.5 | 112.6 | 166.4 | -117.6 | 91.8 | 0 | 0 | 0 | 107.4 | A41 V71 | A41-L52 HydrophobicContact CB-CD1 3.3Å; L52-V71 VanDerWaalsContact O-CG1 3.29Å; L52-V71 WeakPolarHBondContact O-CG1 3.46Å | ||
| 53 | L | 32.9 | Very low | 34.2 | Very low | 138 Ų | 138 | 87.9 Ų | 87.9 | 72% | 0.723 | 49% | 0.491 | S | S | * | . | trans | -88.7 | 113.1 | 171.3 | -148.9 | 90.4 | 0 | 0 | 0 | 107.9 | W51 | W51-L53 PolarHBondContact O-N 3.32Š| ||
| 54 | L | 38 | Very low | 33.8 | Very low | 28 Ų | 28 | 84.3 Ų | 84.3 | 15% | 0.147 | 48% | 0.477 | C | S | . | . | trans | -89.3 | 135.8 | 171.6 | -94.2 | 150.4 | 0 | 0 | 0 | 109.5 | W57 V70 V71 L83 | L54-W57 HydrophobicContact CD2-CH2 4.2Å; L54-V70 WeakPolarHBondContact CD1-O 3.43Å; L54-V71 HydrophobicContact CB-CG2 3.93Å; L54-L83 HydrophobicContact CD1-CD1 3.43Å; L54-L83 VanDerWaalsContact CD1-CD1 3.43Å; L54-L83 HydrophobicContact CD1-CD2 4.06Å; L54-L83 HydrophobicContact CD1-CG 3.87Å; L54-L83 HydrophobicContact CD2-CD2 4.17Å | ||
| 55 | V | 33.4 | Very low | 33.4 | Very low | 59 Ų | 59 | 83.7 Ų | 83.7 | 36% | 0.358 | 48% | 0.477 | S | S | . | . | trans | -120.1 | 140.8 | -178.7 | -173.7 | 0 | 0 | 0 | 0 | 106.8 | L9 W57 | L9-V55 HydrophobicContact CD1-CB 3.16Å; L9-V55 HydrophobicContact CD1-CG1 3.49Å; L9-V55 VanDerWaalsContact CD1-CG1 3.49Å; L9-V55 HydrophobicContact CD1-CG2 3.29Å; V55-W57 HydrophobicContact CB-CE3 4.35Å; V55-W57 WeakPolarHBondContact O-CZ3 3.37Å; V55-W57 PolarHBondContact O-N 3.39Å | ||
| 56 | S | 33.6 | Very low | 33.1 | Very low | 92 Ų | 92 | 78.9 Ų | 78.9 | 64% | 0.643 | 45% | 0.448 | S | S | * | . | trans | -68.6 | 128.1 | 170.1 | 60.9 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 57 | W | 37.3 | Very low | 33.2 | Very low | 64 Ų | 64 | 76.7 Ų | 76.7 | 24% | 0.242 | 42% | 0.424 | C | S | . | . | B | Isolated β-bridge | trans | -123 | 151.1 | 171.3 | 45.1 | 74.7 | 0 | 0 | 0 | 110.9 | L9 W12 L54 V55 A67 | L9-W57 HydrophobicContact CD1-CE3 3.98Å; L9-W57 HydrophobicContact CD1-CZ3 4.15Å; L9-W57 HydrophobicContact CD2-CD2 4.01Å; L9-W57 HydrophobicContact CD2-CE3 3.18Å; L9-W57 HydrophobicContact CD2-CZ3 3.54Å; L9-W57 HydrophobicContact CG-CE3 4.18Å; L9-W57 HydrophobicContact CG-CZ3 4.35Å; W12-W57 HydrophobicContact CD2-CH2 4.17Å; W12-W57 HydrophobicContact CD2-CZ2 4.1Å; W12-W57 HydrophobicContact CE3-CH2 4.48Å; W12-W57 AromaticContact CE3-CZ2 3.95Å; W12-W57 HydrophobicContact CE3-CZ2 3.95Å; W12-W57 HydrophobicContact CZ3-CZ2 4.17Å; L54-W57 HydrophobicContact CD2-CH2 4.2Å; V55-W57 HydrophobicContact CB-CE3 4.35Å; V55-W57 WeakPolarHBondContact O-CZ3 3.37Å; V55-W57 PolarHBondContact O-N 3.39Å; W57-A67 PolarHBondContact O-N 3.03Å |
| 58 | W | 32.5 | Very low | 33.2 | Very low | 210 Ų | 210 | 83.9 Ų | 83.9 | 80% | 0.795 | 45% | 0.447 | S | S | * | . | trans | -90.3 | 127.1 | -178.5 | -132.6 | 45.8 | 0 | 0 | 0 | 108.1 | T65 | W58-T65 PolarHBondContact NE1-O 3.21Š| ||
| 59 | C | 32.1 | Very low | 33.2 | Very low | 37 Ų | 37 | 78.9 Ų | 78.9 | 25% | 0.25 | 42% | 0.419 | C | S | . | . | trans | -82.2 | 132.5 | 177.9 | -166.6 | 0 | 0 | 0 | 0 | 109.6 | C61 C64 | C59-C61 WeakPolarHBondContact CB-SG 3.2Å; C59-C61 PolarHBondContact O-N 3.42Å; C59-C61 WeakPolarHBondContact SG-CB 3.36Å; C59-C61 PolarHBondContact SG-N 3.02Å; C59-C61 CovalentContact SG-SG 2.07Å; C59-C61 PolarHBondContact SG-SG 3.27Å; C59-C64 HydrophobicContact CB-CB 3.78Å | ||
| 60 | P | 32.9 | Very low | 33.1 | Very low | 107 Ų | 107 | 80 Ų | 80 | 70% | 0.695 | 42% | 0.424 | S | S | * | . | trans | -78.4 | -1.7 | 174 | 29.6 | -33.1 | 0 | 0 | 0 | 112.6 | E13 | E13-P60 WeakPolarHBondContact OE1-CD 3.41Š| ||
| 61 | C | 30.9 | Very low | 33.4 | Very low | 50 Ų | 50 | 82.4 Ų | 82.4 | 34% | 0.338 | 44% | 0.437 | S | S | . | . | S | Bend | trans | -71.7 | 128.3 | 174.6 | 57.7 | 0 | 0 | 0 | 0 | 110.3 | C59 Y63 C64 | C59-C61 WeakPolarHBondContact CB-SG 3.2Å; C59-C61 PolarHBondContact O-N 3.42Å; C59-C61 WeakPolarHBondContact SG-CB 3.36Å; C59-C61 PolarHBondContact SG-N 3.02Å; C59-C61 CovalentContact SG-SG 2.07Å; C59-C61 PolarHBondContact SG-SG 3.27Å; C61-Y63 PolarHBondContact O-N 2.87Å; C61-C64 PolarHBondContact O-N 3.5Å; C61-C64 VanDerWaalsContact O-N 3.09Å; C61-C64 WeakPolarHBondContact SG-CB 2.96Å; C61-C64 PolarHBondContact SG-SG 3.33Å |
| 62 | A | 29.4 | Very low | 33.3 | Very low | 92 Ų | 92 | 78.3 Ų | 78.3 | 76% | 0.76 | 43% | 0.427 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.9 | -7.7 | -177.5 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||
| 63 | Y | 27 | Very low | 33.2 | Very low | 182 Ų | 182 | 84.9 Ų | 84.9 | 71% | 0.714 | 45% | 0.449 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -113.5 | 3.2 | -175.6 | -59.1 | -78.8 | 0 | 0 | 0 | 114.3 | C61 L89 P90 | C61-Y63 PolarHBondContact O-N 2.87Å; Y63-L89 WeakPolarHBondContact O-CA 3.44Å; Y63-L89 WeakPolarHBondContact O-CD2 3.4Å; Y63-P90 WeakPolarHBondContact O-CD 3.26Å |
| 64 | C | 28 | Very low | 33.3 | Very low | 20 Ų | 20 | 80.7 Ų | 80.7 | 14% | 0.135 | 43% | 0.434 | C | S | . | . | trans | -133.6 | 124.7 | 176.5 | -49.1 | 0 | 0 | 0 | 0 | 111.1 | C59 C61 L87 I88 L89 | C59-C64 HydrophobicContact CB-CB 3.78Å; C61-C64 PolarHBondContact O-N 3.5Å; C61-C64 VanDerWaalsContact O-N 3.09Å; C61-C64 WeakPolarHBondContact SG-CB 2.96Å; C61-C64 PolarHBondContact SG-SG 3.33Å; C64-L87 HydrophobicContact CB-CD2 4.15Å; C64-I88 CarbonylContact C-O 3.57Å; C64-I88 WeakPolarHBondContact CA-O 3.2Å; C64-L89 HydrophobicContact CB-CD2 4.48Å; C64-L89 WeakPolarHBondContact SG-CD2 3.29Å | ||
| 65 | T | 27.4 | Very low | 33.1 | Very low | 64 Ų | 64 | 84.5 Ų | 84.5 | 39% | 0.393 | 46% | 0.455 | S | S | . | . | S | Bend | trans | -93.5 | -18.3 | -174.3 | 21.6 | 0 | 0 | 0 | 0 | 114.1 | W58 I88 P90 | W58-T65 PolarHBondContact NE1-O 3.21Å; T65-I88 PolarHBondContact N-O 3.18Å; T65-I88 PolarHBondContact OG1-O 3.39Å; T65-P90 HydrophobicContact CG2-CB 4Å; T65-P90 HydrophobicContact CG2-CG 4.33Å |
| 66 | A | 29.5 | Very low | 33.1 | Very low | 29 Ų | 29 | 93.6 Ų | 93.6 | 24% | 0.24 | 48% | 0.483 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -171.3 | 146.9 | 169 | 0 | 0 | 0 | 0 | 0 | 111.4 | I88 | A66-I88 HydrophobicContact CB-CD1 4.49Å; A66-I88 WeakPolarHBondContact O-CB 3.15Å; A66-I88 PolarHBondContact O-N 3.36Å |
| 67 | A | 35.2 | Very low | 33.3 | Very low | 8 Ų | 8 | 92.4 Ų | 92.4 | 7% | 0.066 | 47% | 0.474 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.9 | 127.9 | 162.2 | 0 | 0 | 0 | 0 | 0 | 109.7 | W57 V85 | W57-A67 PolarHBondContact O-N 3.03Å; A67-V85 HydrophobicContact CB-CG1 4.3Å |
| 68 | R | 35.4 | Very low | 33 | Very low | 178 Ų | 178 | 94.2 Ų | 94.2 | 67% | 0.672 | 50% | 0.495 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -106 | 123.9 | 170.7 | -89.1 | -176.7 | 162.9 | -176.6 | -2.9 | 109.5 | E86 | R68-E86 PolarHBondContact N-O 2.77Å; R68-E86 PolarHBondContact O-N 2.87Å |
| 69 | G | 39.7 | Very low | 32.9 | Very low | 25 Ų | 25 | 92.5 Ų | 92.5 | 26% | 0.258 | 49% | 0.494 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.3 | 134.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||
| 70 | V | 33.5 | Very low | 32.9 | Very low | 90 Ų | 90 | 96.8 Ų | 96.8 | 55% | 0.545 | 52% | 0.518 | S | S | . | . | trans | -97.6 | 120.2 | 176.5 | -175.2 | 0 | 0 | 0 | 0 | 111.5 | L54 V72 | L54-V70 WeakPolarHBondContact CD1-O 3.43Å; V70-V72 PolarHBondContact O-N 2.88Å | ||
| 71 | V | 39.3 | Very low | 32.9 | Very low | 74 Ų | 74 | 93.7 Ų | 93.7 | 45% | 0.448 | 50% | 0.502 | S | S | . | . | trans | -66.5 | 128.3 | 173.8 | 172.1 | 0 | 0 | 0 | 0 | 110 | L52 L54 | L52-V71 VanDerWaalsContact O-CG1 3.29Å; L52-V71 WeakPolarHBondContact O-CG1 3.46Å; L54-V71 HydrophobicContact CB-CG2 3.93Å | ||
| 72 | V | 34.1 | Very low | 32.9 | Very low | 51 Ų | 51 | 96 Ų | 96 | 31% | 0.309 | 52% | 0.518 | S | S | . | . | trans | -117.7 | 126.6 | 172.4 | -169.8 | 0 | 0 | 0 | 0 | 109.6 | V70 A81 | V70-V72 PolarHBondContact O-N 2.88Å; V72-A81 HydrophobicContact CB-CB 3.53Å; V72-A81 HydrophobicContact CG1-CB 3.3Å; V72-A81 HydrophobicContact CG2-CB 4.35Å | ||
| 73 | R | 36 | Very low | 33.3 | Very low | 184 Ų | 184 | 94 Ų | 94 | 69% | 0.694 | 50% | 0.495 | S | S | * | . | trans | -86.6 | 115.2 | 175.9 | -162 | -178.8 | -170.3 | -172.3 | 1 | 107.8 | W51 | W51-R73 HydrophobicContact CE3-CG 4.28Å; W51-R73 HydrophobicContact CH2-CG 4.45Å; W51-R73 HydrophobicContact CZ3-CG 3.88Å; W51-R73 VanDerWaalsContact CZ3-NE 3.28Å | ||
| 74 | A | 34.2 | Very low | 33.7 | Very low | 50 Ų | 50 | 88.7 Ų | 88.7 | 41% | 0.413 | 49% | 0.488 | S | S | . | . | trans | -81 | 123.3 | 169.3 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 75 | D | 33.6 | Very low | 34.1 | Very low | 109 Ų | 109 | 91.2 Ų | 91.2 | 58% | 0.583 | 50% | 0.503 | S | S | * | . | trans | -65.7 | 161.8 | 165.6 | 167.2 | 35 | 0 | 0 | 0 | 110.1 | S77 C78 | D75-S77 PolarHBondContact O-N 2.99Å; D75-S77 PolarHBondContact OD2-OG 3.13Å; D75-C78 PolarHBondContact O-N 2.06Å | ||
| 76 | R | 34.2 | Very low | 34.4 | Very low | 250 Ų | 250 | 95 Ų | 95 | 94% | 0.943 | 52% | 0.516 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -48.9 | -14.6 | 173.5 | -64.8 | -175.4 | -176.5 | 174.3 | 2 | 114.1 | ||
| 77 | S | 36.6 | Very low | 34.5 | Very low | 66 Ų | 66 | 98.6 Ų | 98.6 | 46% | 0.462 | 53% | 0.531 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -83 | -0.6 | 177.7 | 52.1 | 0 | 0 | 0 | 0 | 114.9 | D75 K79 | D75-S77 PolarHBondContact O-N 2.99Å; D75-S77 PolarHBondContact OD2-OG 3.13Å; S77-K79 PolarHBondContact O-N 3.01Å |
| 78 | C | 31.3 | Very low | 34.4 | Very low | 102 Ų | 102 | 101.6 Ų | 101.6 | 69% | 0.689 | 55% | 0.545 | S | S | * | . | trans | 53.4 | 22.4 | 172.4 | -70.7 | 0 | 0 | 0 | 0 | 115.3 | D75 V80 | D75-C78 PolarHBondContact O-N 2.06Å; C78-V80 PolarHBondContact O-N 2.84Å; C78-V80 VanDerWaalsContact O-N 3.13Å | ||
| 79 | K | 29.9 | Very low | 34.1 | Very low | 175 Ų | 175 | 98.7 Ų | 98.7 | 76% | 0.761 | 54% | 0.542 | S | S | * | . | trans | -76.3 | 109.3 | 174.8 | -70.5 | -170.3 | 178.7 | -178.5 | 0 | 108.2 | S77 A81 | S77-K79 PolarHBondContact O-N 3.01Å; K79-A81 PolarHBondContact O-N 2.94Å | ||
| 80 | V | 31.8 | Very low | 33.6 | Very low | 127 Ų | 127 | 100.5 Ų | 100.5 | 77% | 0.77 | 55% | 0.549 | S | S | * | . | trans | -17.4 | 116.1 | 175.6 | -179.6 | 0 | 0 | 0 | 0 | 113 | C78 S82 | C78-V80 PolarHBondContact O-N 2.84Å; C78-V80 VanDerWaalsContact O-N 3.13Å; V80-S82 PolarHBondContact O-N 2.61Å | ||
| 81 | A | 33 | Very low | 34 | Very low | 41 Ų | 41 | 105.3 Ų | 105.3 | 34% | 0.339 | 59% | 0.587 | S | S | . | * | trans | -80.6 | 101.7 | 165.5 | 0 | 0 | 0 | 0 | 0 | 108.5 | V72 K79 L83 | V72-A81 HydrophobicContact CB-CB 3.53Å; V72-A81 HydrophobicContact CG1-CB 3.3Å; V72-A81 HydrophobicContact CG2-CB 4.35Å; K79-A81 PolarHBondContact O-N 2.94Å; A81-L83 PolarHBondContact O-N 3.11Å | ||
| 82 | S | 32.7 | Very low | 33.7 | Very low | 99 Ų | 99 | 106.9 Ų | 106.9 | 69% | 0.692 | 59% | 0.594 | S | S | * | * | P | Polyproline II helix | trans | -66.7 | 121.2 | 171.4 | -60 | 0 | 0 | 0 | 0 | 109.6 | V80 | V80-S82 PolarHBondContact O-N 2.61Š|
| 83 | L | 37.5 | Very low | 33.7 | Very low | 51 Ų | 51 | 109.8 Ų | 109.8 | 27% | 0.267 | 61% | 0.609 | S | S | . | * | P | Polyproline II helix | trans | -84.2 | 119.8 | 171.1 | -140.3 | 86.2 | 0 | 0 | 0 | 108.3 | V39 L54 A81 V85 | V39-L83 HydrophobicContact CB-CD2 4.12Å; V39-L83 HydrophobicContact CG2-CD2 4.07Å; L54-L83 HydrophobicContact CD1-CD1 3.43Å; L54-L83 VanDerWaalsContact CD1-CD1 3.43Å; L54-L83 HydrophobicContact CD1-CD2 4.06Å; L54-L83 HydrophobicContact CD1-CG 3.87Å; L54-L83 HydrophobicContact CD2-CD2 4.17Å; A81-L83 PolarHBondContact O-N 3.11Å; L83-V85 HydrophobicContact CD2-CG2 3.94Å |
| 84 | A | 34.1 | Very low | 33.6 | Very low | 69 Ų | 69 | 105.7 Ų | 105.7 | 57% | 0.57 | 60% | 0.604 | S | S | * | * | P | Polyproline II helix | trans | -100.5 | 117.7 | 164.3 | 0 | 0 | 0 | 0 | 0 | 107.9 | ||
| 85 | V | 37.8 | Very low | 33.5 | Very low | 73 Ų | 73 | 109 Ų | 109 | 44% | 0.442 | 62% | 0.616 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -100.2 | 115.7 | 170.1 | -179.4 | 0 | 0 | 0 | 0 | 106.5 | A67 L83 | A67-V85 HydrophobicContact CB-CG1 4.3Å; L83-V85 HydrophobicContact CD2-CG2 3.94Å |
| 86 | E | 32.7 | Very low | 33.5 | Very low | 143 Ų | 143 | 109 Ų | 109 | 67% | 0.668 | 62% | 0.618 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -90.7 | 114.3 | 173 | -126.4 | 179.4 | -178.4 | 0 | 0 | 108.2 | R68 | R68-E86 PolarHBondContact N-O 2.77Å; R68-E86 PolarHBondContact O-N 2.87Å |
| 87 | L | 33.1 | Very low | 33.5 | Very low | 105 Ų | 105 | 99.6 Ų | 99.6 | 55% | 0.55 | 60% | 0.596 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -84.4 | 114.6 | 171.2 | -85.4 | 154.1 | 0 | 0 | 0 | 108.2 | C64 L89 | C64-L87 HydrophobicContact CB-CD2 4.15Å; L87-L89 PolarHBondContact O-N 2.83Å |
| 88 | I | 32.7 | Very low | 33.2 | Very low | 71 Ų | 71 | 102 Ų | 102 | 36% | 0.364 | 61% | 0.605 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -86.9 | 108.3 | 172.9 | -55.1 | 176.6 | 0 | 0 | 0 | 107 | C64 T65 A66 | C64-I88 CarbonylContact C-O 3.57Å; C64-I88 WeakPolarHBondContact CA-O 3.2Å; T65-I88 PolarHBondContact N-O 3.18Å; T65-I88 PolarHBondContact OG1-O 3.39Å; A66-I88 HydrophobicContact CB-CD1 4.49Å; A66-I88 WeakPolarHBondContact O-CB 3.15Å; A66-I88 PolarHBondContact O-N 3.36Å |
| 89 | L | 28.7 | Very low | 33.4 | Very low | 117 Ų | 117 | 102 Ų | 102 | 61% | 0.613 | 60% | 0.599 | S | S | * | * | trans | -82.9 | 139.5 | 170.7 | -57.7 | 170.8 | 0 | 0 | 0 | 108.6 | Y63 C64 L87 | Y63-L89 WeakPolarHBondContact O-CA 3.44Å; Y63-L89 WeakPolarHBondContact O-CD2 3.4Å; C64-L89 HydrophobicContact CB-CD2 4.48Å; C64-L89 WeakPolarHBondContact SG-CD2 3.29Å; L87-L89 PolarHBondContact O-N 2.83Å | ||
| 90 | P | 30 | Very low | 33.7 | Very low | 63 Ų | 63 | 95.9 Ų | 95.9 | 41% | 0.409 | 59% | 0.586 | S | S | . | * | trans | -68.5 | 137.3 | 169.4 | 29.4 | -25.1 | 0 | 0 | 0 | 109.2 | Y63 T65 | Y63-P90 WeakPolarHBondContact O-CD 3.26Å; T65-P90 HydrophobicContact CG2-CB 4Å; T65-P90 HydrophobicContact CG2-CG 4.33Å | ||
| 91 | S | 40.3 | Very low | 33.9 | Very low | 192 Ų | 192 | 93.1 Ų | 93.1 | 100% | 1.343 | 57% | 0.569 | S | S | * | * | trans | -61.5 | 0 | 171 | 51.8 | 0 | 0 | 0 | 0 | 112.9 |
Retrieved 91 of 91 residues in 47.3 ms
(Link to these results)