| 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 | 32.2 | Very low | 32.7 | Very low | 244 Ų | 244 | 148.2 Ų | 148.2 | 100% | 1.202 | 84% | 0.839 | S | S | * | * | 0 | 129.6 | 0 | -79.1 | 173.7 | 83.5 | 0 | 0 | 107 | |||||
| 2 | F | 31.9 | Very low | 33.3 | Very low | 200 Ų | 200 | 141.3 Ų | 141.3 | 88% | 0.877 | 82% | 0.815 | S | S | * | * | trans | -50.6 | 140.8 | 167.9 | -70.4 | -98.2 | 0 | 0 | 0 | 110.6 | ||||
| 3 | D | 33.8 | Very low | 33.8 | Very low | 153 Ų | 153 | 140.1 Ų | 140.1 | 82% | 0.818 | 80% | 0.803 | S | S | * | * | -175.7 | 144.1 | 101 | -107.9 | -19.9 | 0 | 0 | 0 | 113.2 | |||||
| 4 | D | 31.2 | Very low | 34.4 | Very low | 145 Ų | 145 | 136.9 Ų | 136.9 | 78% | 0.775 | 78% | 0.776 | S | S | * | * | trans | -61.1 | 142.4 | 172.8 | -74 | -50.6 | 0 | 0 | 0 | 112.8 | ||||
| 5 | S | 35.7 | Very low | 35 | Very low | 119 Ų | 119 | 137.8 Ų | 137.8 | 83% | 0.832 | 77% | 0.771 | S | S | * | * | trans | -146.5 | 95.1 | 142.2 | 48.6 | 0 | 0 | 0 | 0 | 110 | ||||
| 6 | V | 33.3 | Very low | 35.5 | Very low | 122 Ų | 122 | 136.7 Ų | 136.7 | 74% | 0.739 | 76% | 0.761 | S | S | * | * | trans | -72.3 | 127.5 | 158.3 | 174.7 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 7 | S | 33.8 | Very low | 35.6 | Very low | 102 Ų | 102 | 136.1 Ų | 136.1 | 71% | 0.713 | 76% | 0.755 | S | S | * | * | trans | -159 | 91.6 | 148.7 | 54.4 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 8 | D | 28.9 | Very low | 35.6 | Very low | 143 Ų | 143 | 138.1 Ų | 138.1 | 77% | 0.765 | 76% | 0.758 | S | S | * | * | 56 | 89.8 | 125.9 | -59.1 | -25.9 | 0 | 0 | 0 | 119.7 | |||||
| 9 | V | 31.5 | Very low | 35.4 | Very low | 143 Ų | 143 | 135.4 Ų | 135.4 | 87% | 0.867 | 75% | 0.75 | S | S | * | * | trans | -135.9 | 93.4 | 140.6 | -175.7 | 0 | 0 | 0 | 0 | 109.4 | L11 | V9-L11 PolarHBondContact O-N 2.84Š| ||
| 10 | A | 32 | Very low | 35.3 | Very low | 94 Ų | 94 | 134.4 Ų | 134.4 | 78% | 0.777 | 75% | 0.75 | S | S | * | * | trans | -3.5 | 101.9 | 164.1 | 0 | 0 | 0 | 0 | 0 | 117.2 | A12 | A10-A12 PolarHBondContact O-N 3.09Š| ||
| 11 | L | 35 | Very low | 34.9 | Very low | 165 Ų | 165 | 132.8 Ų | 132.8 | 86% | 0.864 | 75% | 0.747 | S | S | * | * | trans | -60.8 | 106.9 | 141.3 | -95.2 | 134.3 | 0 | 0 | 0 | 106.3 | V9 D13 | V9-L11 PolarHBondContact O-N 2.84Å; L11-D13 PolarHBondContact O-N 3.5Å | ||
| 12 | A | 40.2 | Very low | 34.8 | Very low | 66 Ų | 66 | 126.7 Ų | 126.7 | 55% | 0.545 | 72% | 0.723 | S | S | . | * | trans | -52.7 | 127.9 | 171.9 | 0 | 0 | 0 | 0 | 0 | 109 | A10 F14 | A10-A12 PolarHBondContact O-N 3.09Å; A12-F14 WeakPolarHBondContact O-CD2 3.4Å; A12-F14 PolarHBondContact O-N 3.27Å | ||
| 13 | D | 40.4 | Very low | 34.8 | Very low | 125 Ų | 125 | 124.6 Ų | 124.6 | 67% | 0.668 | 72% | 0.721 | S | S | * | * | trans | -55.8 | 96.7 | -178.1 | -66.8 | -53.1 | 0 | 0 | 0 | 111.4 | L11 | L11-D13 PolarHBondContact O-N 3.5Š| ||
| 14 | F | 42.5 | Very low | 34.9 | Very low | 95 Ų | 95 | 123 Ų | 123 | 42% | 0.417 | 72% | 0.717 | S | S | . | * | trans | -92 | 89.4 | 159.9 | -63.3 | -78.3 | 0 | 0 | 0 | 107.1 | A12 L34 V79 V83 | A12-F14 WeakPolarHBondContact O-CD2 3.4Å; A12-F14 PolarHBondContact O-N 3.27Å; F14-L34 HydrophobicContact CE1-CD2 3.65Å; F14-L34 HydrophobicContact CE1-CG 4.34Å; F14-L34 HydrophobicContact CZ-CD2 4Å; F14-V79 HydrophobicContact CE1-CG1 4.39Å; F14-V79 HydrophobicContact CZ-CG1 3.79Å; F14-V83 HydrophobicContact CE1-CG2 4Å | ||
| 15 | Q | 42.4 | Very low | 35.2 | Very low | 151 Ų | 151 | 121.2 Ų | 121.2 | 71% | 0.706 | 71% | 0.713 | S | S | * | * | trans | -77 | 127.1 | 165.2 | -84.3 | 179.9 | -14 | 0 | 0 | 109.1 | L17 | Q15-L17 VanDerWaalsContact C-N 3.35Å; Q15-L17 PolarHBondContact O-N 2.99Å; Q15-L17 VanDerWaalsContact O-N 3.08Å | ||
| 16 | I | 43.2 | Very low | 35.5 | Very low | 120 Ų | 120 | 124.9 Ų | 124.9 | 62% | 0.615 | 71% | 0.714 | S | S | * | * | trans | -67.1 | 102.7 | 156.9 | -61 | 172.3 | 0 | 0 | 0 | 104.7 | E18 F32 | I16-E18 HydrophobicContact CG2-CG 4.38Å; I16-E18 PolarHBondContact O-N 3.13Å; I16-F32 HydrophobicContact CD1-CZ 4.5Å; I16-F32 HydrophobicContact CG1-CE1 3.88Å; I16-F32 HydrophobicContact CG1-CZ 4.24Å | ||
| 17 | L | 37.8 | Very low | 36 | Very low | 126 Ų | 126 | 126.4 Ų | 126.4 | 66% | 0.66 | 72% | 0.718 | S | S | * | * | trans | -68.9 | 90.1 | 167 | -95.7 | 146.3 | 0 | 0 | 0 | 107.1 | Q15 S19 | Q15-L17 VanDerWaalsContact C-N 3.35Å; Q15-L17 PolarHBondContact O-N 2.99Å; Q15-L17 VanDerWaalsContact O-N 3.08Å; L17-S19 PolarHBondContact O-N 3.07Å | ||
| 18 | E | 34.9 | Very low | 36.4 | Very low | 173 Ų | 173 | 131.3 Ų | 131.3 | 81% | 0.808 | 72% | 0.721 | S | S | * | * | trans | -65.1 | 86.3 | 150.5 | -71.6 | -172.4 | 170.4 | 0 | 0 | 105.8 | I16 P20 | I16-E18 HydrophobicContact CG2-CG 4.38Å; I16-E18 PolarHBondContact O-N 3.13Å; E18-P20 WeakPolarHBondContact O-CD 3.2Å; E18-P20 VanDerWaalsContact O-N 3.08Å | ||
| 19 | S | 32.4 | Very low | 37.6 | Very low | 87 Ų | 87 | 125.6 Ų | 125.6 | 61% | 0.608 | 70% | 0.696 | S | S | * | * | trans | -56.4 | 111.1 | 173.7 | 169.1 | 0 | 0 | 0 | 0 | 108.7 | L17 C21 | L17-S19 PolarHBondContact O-N 3.07Å; S19-C21 PolarHBondContact O-N 3.46Å | ||
| 20 | P | 33 | Very low | 38.7 | Very low | 115 Ų | 115 | 123.2 Ų | 123.2 | 75% | 0.747 | 68% | 0.683 | S | S | * | * | trans | -88.7 | 91.8 | 165 | 29.2 | -12.5 | 0 | 0 | 0 | 105 | E18 | E18-P20 WeakPolarHBondContact O-CD 3.2Å; E18-P20 VanDerWaalsContact O-N 3.08Å | ||
| 21 | C | 27.5 | Very low | 39.6 | Very low | 101 Ų | 101 | 123.4 Ų | 123.4 | 68% | 0.682 | 67% | 0.668 | S | S | * | * | S | Bend | trans | 166.2 | 114.2 | 151.7 | -87.7 | 0 | 0 | 0 | 0 | 111 | S19 | S19-C21 PolarHBondContact O-N 3.46Š|
| 22 | V | 29.5 | Very low | 40.5 | Very low | 116 Ų | 116 | 118.1 Ų | 118.1 | 70% | 0.703 | 64% | 0.638 | S | S | * | * | S | Bend | trans | 65.2 | 111.6 | 136.1 | -168.2 | 0 | 0 | 0 | 0 | 117.9 | ||
| 23 | D | 32 | Very low | 41.1 | Very low | 156 Ų | 156 | 120.3 Ų | 120.3 | 83% | 0.834 | 64% | 0.637 | S | S | * | * | trans | 50.2 | 74.8 | 153.9 | -58.5 | -30.8 | 0 | 0 | 0 | 118 | ||||
| 24 | V | 36.4 | Very low | 41.8 | Very low | 120 Ų | 120 | 116 Ų | 116 | 73% | 0.727 | 61% | 0.613 | S | S | * | * | trans | -113.9 | 124.5 | 155.1 | -170.9 | 0 | 0 | 0 | 0 | 107.7 | F26 | V24-F26 PolarHBondContact O-N 3.22Š| ||
| 25 | P | 37.3 | Very low | 42.4 | Very low | 107 Ų | 107 | 114.8 Ų | 114.8 | 70% | 0.695 | 61% | 0.612 | S | S | * | * | trans | -59.4 | 133.3 | 180 | 23.6 | -32 | 0 | 0 | 0 | 110 | D27 | P25-D27 PolarHBondContact O-N 3.44Š| ||
| 26 | F | 42.2 | Very low | 43 | Very low | 196 Ų | 196 | 109.4 Ų | 109.4 | 86% | 0.86 | 59% | 0.587 | S | S | * | * | S | Bend | trans | -56.5 | 13.1 | -171.6 | -106.9 | -92 | 0 | 0 | 0 | 117 | V24 | V24-F26 PolarHBondContact O-N 3.22Š|
| 27 | D | 42.9 | Very low | 43.6 | Very low | 153 Ų | 153 | 108.3 Ų | 108.3 | 82% | 0.818 | 58% | 0.58 | S | S | * | * | S | Bend | trans | -95.4 | 8.5 | -172 | -86.1 | -13.9 | 0 | 0 | 0 | 114.8 | P25 | P25-D27 PolarHBondContact O-N 3.44Š|
| 28 | R | 43.3 | Very low | 44.4 | Very low | 206 Ų | 206 | 102.3 Ų | 102.3 | 78% | 0.777 | 55% | 0.548 | S | S | * | . | S | Bend | trans | -137.4 | 97.1 | 170.2 | -63.2 | -174.6 | -174.5 | -176.2 | 3.8 | 108.7 | ||
| 29 | G | 52.6 | Low | 45.4 | Very low | 22 Ų | 22 | 103.1 Ų | 103.1 | 23% | 0.227 | 54% | 0.544 | C | S | . | . | trans | -53.1 | 176.2 | 171.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | Q31 | G29-Q31 PolarHBondContact O-N 3.41Š| ||
| 30 | P | 55.4 | Low | 46.4 | Very low | 94 Ų | 94 | 102.6 Ų | 102.6 | 61% | 0.61 | 54% | 0.537 | S | S | * | . | trans | -56.5 | 123.2 | -169 | 21.6 | -32 | 0 | 0 | 0 | 112.1 | I90 | P30-I90 HydrophobicContact CG-CG2 4.26Š| ||
| 31 | Q | 50.2 | Low | 47.8 | Very low | 97 Ų | 97 | 100.2 Ų | 100.2 | 45% | 0.453 | 52% | 0.522 | S | S | . | . | trans | -110.9 | 131.2 | 175.2 | -70.1 | -173.8 | 7.1 | 0 | 0 | 110.7 | G29 | G29-Q31 PolarHBondContact O-N 3.41Š| ||
| 32 | F | 53.9 | Low | 49.2 | Very low | 55 Ų | 55 | 102 Ų | 102 | 24% | 0.241 | 52% | 0.521 | C | S | . | . | trans | -82.2 | 131.8 | 171.3 | -70.9 | -88.7 | 0 | 0 | 0 | 110.4 | I16 V83 L86 N87 I90 | I16-F32 HydrophobicContact CD1-CZ 4.5Å; I16-F32 HydrophobicContact CG1-CE1 3.88Å; I16-F32 HydrophobicContact CG1-CZ 4.24Å; F32-V83 HydrophobicContact CB-CG1 3.9Å; F32-V83 WeakPolarHBondContact O-CG1 3.23Å; F32-L86 HydrophobicContact CD2-CD2 3.71Å; F32-L86 HydrophobicContact CE2-CD2 3.64Å; F32-L86 HydrophobicContact CG-CD2 4.36Å; F32-L86 HydrophobicContact CZ-CD2 4.2Å; F32-N87 PolarHBondContact N-OD1 3.35Å; F32-N87 PolarHBondContact O-ND2 2.98Å; F32-I90 HydrophobicContact CD2-CD1 3.91Å; F32-I90 HydrophobicContact CE2-CD1 3.54Å | ||
| 33 | H | 53.9 | Low | 50.4 | Low | 111 Ų | 111 | 98.4 Ų | 98.4 | 51% | 0.514 | 50% | 0.501 | S | S | . | . | trans | -119.6 | 148.3 | 174.4 | -66.4 | -83.9 | 0 | 0 | 0 | 111 | ||||
| 34 | L | 53.8 | Low | 51.6 | Low | 34 Ų | 34 | 96.2 Ų | 96.2 | 18% | 0.178 | 48% | 0.484 | C | S | . | . | trans | -87.9 | 105.2 | 175.3 | -84 | 158.4 | 0 | 0 | 0 | 110.1 | F14 V79 R80 V83 | F14-L34 HydrophobicContact CE1-CD2 3.65Å; F14-L34 HydrophobicContact CE1-CG 4.34Å; F14-L34 HydrophobicContact CZ-CD2 4Å; L34-V79 HydrophobicContact CD1-CB 4.4Å; L34-V79 HydrophobicContact CD1-CG1 3.99Å; L34-V79 HydrophobicContact CD2-CB 4.44Å; L34-V79 HydrophobicContact CD2-CG1 3.47Å; L34-V79 VanDerWaalsContact CD2-CG1 3.47Å; L34-V79 HydrophobicContact CG-CG1 4.21Å; L34-R80 HydrophobicContact CD1-CB 3.96Å; L34-V83 HydrophobicContact CD1-CG2 4.44Å; L34-V83 HydrophobicContact CG-CG2 4.28Å | ||
| 35 | N | 56.3 | Low | 52.4 | Low | 71 Ų | 71 | 95.4 Ų | 95.4 | 38% | 0.38 | 47% | 0.471 | S | S | . | . | trans | -86.5 | 109 | 170 | -76.3 | -22.9 | 0 | 0 | 0 | 109.4 | F44 | N35-F44 HydrophobicContact CB-CB 4.36Å; N35-F44 HydrophobicContact CB-CD1 4.09Å | ||
| 36 | L | 54.8 | Low | 53 | Low | 37 Ų | 37 | 97 Ų | 97 | 19% | 0.194 | 47% | 0.469 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.6 | 128.2 | 175.8 | -68.9 | 163.3 | 0 | 0 | 0 | 109.2 | C38 K45 F48 I76 | L36-C38 PolarHBondContact O-N 2.92Å; L36-K45 PolarHBondContact N-O 3.26Å; L36-K45 PolarHBondContact O-N 3.13Å; L36-F48 HydrophobicContact CD1-CD2 3.73Å; L36-F48 HydrophobicContact CD1-CE2 3.75Å; L36-F48 HydrophobicContact CD2-CE2 3.81Å; L36-F48 HydrophobicContact CD2-CZ 4.37Å; L36-F48 HydrophobicContact CG-CE2 4.29Å; L36-I76 HydrophobicContact CD1-CG1 4.45Å |
| 37 | Q | 56.4 | Low | 53.3 | Low | 97 Ų | 97 | 91.4 Ų | 91.4 | 45% | 0.453 | 45% | 0.451 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -73.6 | 125.1 | 178.7 | -161 | -179.1 | 14.3 | 0 | 0 | 110.2 | R39 E42 F44 | Q37-R39 PolarHBondContact O-N 2.81Å; Q37-E42 HydrophobicContact CG-CB 4.43Å; Q37-E42 WeakPolarHBondContact CG-O 3.45Å; Q37-F44 HydrophobicContact CB-CD1 4.12Å; Q37-F44 HydrophobicContact CB-CE1 3.83Å; Q37-F44 HydrophobicContact CB-CZ 4.33Å; Q37-F44 HydrophobicContact CG-CD1 4.42Å; Q37-F44 HydrophobicContact CG-CE1 4.04Å; Q37-F44 HydrophobicContact CG-CE2 4.43Å; Q37-F44 HydrophobicContact CG-CZ 4.04Å |
| 38 | C | 54.2 | Low | 53.6 | Low | 1 Ų | 1 | 87.3 Ų | 87.3 | 1% | 0.007 | 43% | 0.426 | C | S | . | . | P | Polyproline II helix | trans | -65.6 | 118.7 | 174.5 | 179.2 | 0 | 0 | 0 | 0 | 109.7 | L36 T40 C41 E42 S43 C50 | L36-C38 PolarHBondContact O-N 2.92Å; C38-T40 PolarHBondContact O-N 3.5Å; C38-C41 PolarHBondContact O-N 3.04Å; C38-C41 VanDerWaalsContact SG-SG 3.63Å; C38-E42 WeakPolarHBondContact O-CA 3.36Å; C38-E42 PolarHBondContact O-N 3.23Å; C38-S43 VanDerWaalsContact CB-O 3.23Å; C38-S43 WeakPolarHBondContact CB-O 3.42Å; C38-S43 PolarHBondContact N-O 3.35Å; C38-C50 HydrophobicContact CB-CB 4.42Å; C38-C50 PolarHBondContact SG-N 2.9Å; C38-C50 VanDerWaalsContact SG-N 3.41Å |
| 39 | R | 55.8 | Low | 54 | Low | 189 Ų | 189 | 80.2 Ų | 80.2 | 71% | 0.713 | 41% | 0.405 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.2 | -11 | -177.7 | -75.8 | -168.3 | 174 | -169.2 | -1 | 115.3 | Q37 | Q37-R39 PolarHBondContact O-N 2.81Š|
| 40 | T | 53.4 | Low | 54.3 | Low | 77 Ų | 77 | 79.3 Ų | 79.3 | 47% | 0.472 | 40% | 0.395 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -99.1 | -33.1 | -175.8 | -38 | 0 | 0 | 0 | 0 | 112.7 | C38 C53 | C38-T40 PolarHBondContact O-N 3.5Å; T40-C53 HydrophobicContact CG2-CB 4.3Å |
| 41 | C | 62.2 | Low | 54.2 | Low | 64 Ų | 64 | 78.8 Ų | 78.8 | 43% | 0.432 | 39% | 0.393 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -135.6 | 8.7 | -176 | 65.2 | 0 | 0 | 0 | 0 | 113.9 | C38 S43 C53 | C38-C41 PolarHBondContact O-N 3.04Å; C38-C41 VanDerWaalsContact SG-SG 3.63Å; C41-S43 PolarHBondContact O-N 3.49Å; C41-S43 PolarHBondContact SG-OG 3.17Å; C41-C53 VanDerWaalsContact SG-SG 3.62Å |
| 42 | E | 57.5 | Low | 54.4 | Low | 140 Ų | 140 | 78.3 Ų | 78.3 | 65% | 0.654 | 39% | 0.394 | S | S | * | . | trans | 60 | 4.9 | 178.3 | -62.7 | -177.4 | 172.6 | 0 | 0 | 115.8 | Q37 C38 | Q37-E42 HydrophobicContact CG-CB 4.43Å; Q37-E42 WeakPolarHBondContact CG-O 3.45Å; C38-E42 WeakPolarHBondContact O-CA 3.36Å; C38-E42 PolarHBondContact O-N 3.23Å | ||
| 43 | S | 53.7 | Low | 54.4 | Low | 39 Ų | 39 | 76.5 Ų | 76.5 | 27% | 0.273 | 39% | 0.387 | S | S | . | . | trans | -71 | 133.2 | 176.5 | 71 | 0 | 0 | 0 | 0 | 111.8 | C38 C41 K45 | C38-S43 VanDerWaalsContact CB-O 3.23Å; C38-S43 WeakPolarHBondContact CB-O 3.42Å; C38-S43 PolarHBondContact N-O 3.35Å; C41-S43 PolarHBondContact O-N 3.49Å; C41-S43 PolarHBondContact SG-OG 3.17Å; S43-K45 PolarHBondContact O-N 3.13Å | ||
| 44 | F | 57.1 | Low | 54.5 | Low | 110 Ų | 110 | 75.1 Ų | 75.1 | 48% | 0.482 | 39% | 0.387 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.7 | 116.2 | 175.3 | -68 | -86.4 | 0 | 0 | 0 | 111.1 | N35 Q37 | N35-F44 HydrophobicContact CB-CB 4.36Å; N35-F44 HydrophobicContact CB-CD1 4.09Å; Q37-F44 HydrophobicContact CB-CD1 4.12Å; Q37-F44 HydrophobicContact CB-CE1 3.83Å; Q37-F44 HydrophobicContact CB-CZ 4.33Å; Q37-F44 HydrophobicContact CG-CD1 4.42Å; Q37-F44 HydrophobicContact CG-CE1 4.04Å; Q37-F44 HydrophobicContact CG-CE2 4.43Å; Q37-F44 HydrophobicContact CG-CZ 4.04Å |
| 45 | K | 52.8 | Low | 54.5 | Low | 104 Ų | 104 | 83.3 Ų | 83.3 | 45% | 0.452 | 42% | 0.415 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -144.1 | 167.4 | 173.3 | -69.2 | -159.5 | 176.7 | -175.2 | 0 | 110.8 | L36 S43 T47 C50 | L36-K45 PolarHBondContact N-O 3.26Å; L36-K45 PolarHBondContact O-N 3.13Å; S43-K45 PolarHBondContact O-N 3.13Å; K45-T47 PolarHBondContact O-N 3.37Å; K45-T47 VanDerWaalsContact O-N 3.13Å; K45-C50 HydrophobicContact CD-CB 4.28Å |
| 46 | E | 50.8 | Low | 54.1 | Low | 140 Ų | 140 | 88 Ų | 88 | 65% | 0.654 | 43% | 0.432 | S | S | * | . | S | Bend | trans | -64.2 | -13.4 | -177.5 | -73.9 | -172.9 | 137.4 | 0 | 0 | 114.9 | ||
| 47 | T | 48 | Very low | 53.4 | Low | 79 Ų | 79 | 93.5 Ų | 93.5 | 49% | 0.485 | 46% | 0.462 | S | S | . | . | S | Bend | trans | -120.9 | 143.6 | -177.4 | 50.2 | 0 | 0 | 0 | 0 | 112.2 | K45 V49 | K45-T47 PolarHBondContact O-N 3.37Å; K45-T47 VanDerWaalsContact O-N 3.13Å; T47-V49 PolarHBondContact O-N 3.43Å; T47-V49 PolarHBondContact OG1-O 2.97Å |
| 48 | F | 49.9 | Very low | 52.7 | Low | 67 Ų | 67 | 92 Ų | 92 | 29% | 0.294 | 46% | 0.463 | S | S | . | . | S | Bend | trans | -56.3 | -21.1 | -173 | -115 | -95.7 | 0 | 0 | 0 | 115.3 | L36 N72 I76 | L36-F48 HydrophobicContact CD1-CD2 3.73Å; L36-F48 HydrophobicContact CD1-CE2 3.75Å; L36-F48 HydrophobicContact CD2-CE2 3.81Å; L36-F48 HydrophobicContact CD2-CZ 4.37Å; L36-F48 HydrophobicContact CG-CE2 4.29Å; F48-N72 WeakPolarHBondContact CE1-ND2 3.36Å; F48-N72 WeakPolarHBondContact CZ-ND2 3.47Å; F48-I76 HydrophobicContact CD2-CD1 3.49Å; F48-I76 VanDerWaalsContact CD2-CD1 3.49Å; F48-I76 HydrophobicContact CD2-CG1 4.43Å; F48-I76 HydrophobicContact CE2-CD1 3.1Å; F48-I76 HydrophobicContact CE2-CG1 3.69Å; F48-I76 HydrophobicContact CZ-CD1 4.06Å |
| 49 | V | 51.7 | Low | 52 | Low | 56 Ų | 56 | 97.1 Ų | 97.1 | 34% | 0.339 | 49% | 0.489 | S | S | . | . | S | Bend | trans | -136.2 | 128 | 174 | -173 | 0 | 0 | 0 | 0 | 107.2 | T47 C53 V54 | T47-V49 PolarHBondContact O-N 3.43Å; T47-V49 PolarHBondContact OG1-O 2.97Å; V49-C53 HydrophobicContact CG1-CB 3.72Å; V49-V54 HydrophobicContact CB-CG2 4.13Å; V49-V54 HydrophobicContact CG1-CG2 3.76Å |
| 50 | C | 57.8 | Low | 51 | Low | 3 Ų | 3 | 98.4 Ų | 98.4 | 2% | 0.02 | 50% | 0.5 | C | S | . | . | trans | -70.5 | 151.8 | 179.7 | 76.7 | 0 | 0 | 0 | 0 | 110.9 | C38 K45 D52 C53 V54 | C38-C50 HydrophobicContact CB-CB 4.42Å; C38-C50 PolarHBondContact SG-N 2.9Å; C38-C50 VanDerWaalsContact SG-N 3.41Å; K45-C50 HydrophobicContact CD-CB 4.28Å; C50-D52 PolarHBondContact O-N 3.32Å; C50-C53 PolarHBondContact O-N 3.03Å; C50-C53 PolarHBondContact SG-SG 3.3Å; C50-V54 PolarHBondContact O-N 3.37Å; C50-V54 VanDerWaalsContact O-N 3.13Å | ||
| 51 | C | 54.8 | Low | 50.3 | Low | 83 Ų | 83 | 100.7 Ų | 100.7 | 56% | 0.561 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -56.9 | -26.7 | -177.3 | -59.8 | 0 | 0 | 0 | 0 | 113.6 | R55 | C51-R55 WeakPolarHBondContact O-CG 3.37Å; C51-R55 PolarHBondContact O-N 3.49Å |
| 52 | D | 52.8 | Low | 48.9 | Very low | 88 Ų | 88 | 107.2 Ų | 107.2 | 47% | 0.471 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -75.2 | -32.4 | 177.8 | -60.8 | -42.6 | 0 | 0 | 0 | 112.7 | C50 R55 | C50-D52 PolarHBondContact O-N 3.32Å; D52-R55 PolarHBondContact O-N 3.06Å |
| 53 | C | 55.1 | Low | 47.7 | Very low | 16 Ų | 16 | 110.1 Ų | 110.1 | 11% | 0.108 | 55% | 0.55 | C | S | . | * | H | α-helix | trans | -78 | -29.1 | 175.1 | -70.8 | 0 | 0 | 0 | 0 | 112.2 | T40 C41 V49 C50 R55 | T40-C53 HydrophobicContact CG2-CB 4.3Å; C41-C53 VanDerWaalsContact SG-SG 3.62Å; V49-C53 HydrophobicContact CG1-CB 3.72Å; C50-C53 PolarHBondContact O-N 3.03Å; C50-C53 PolarHBondContact SG-SG 3.3Å; C53-R55 VanDerWaalsContact C-N 3.3Å |
| 54 | V | 55.7 | Low | 47 | Very low | 82 Ų | 82 | 114.1 Ų | 114.1 | 50% | 0.497 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -67.9 | -31.6 | 171.1 | 176.6 | 0 | 0 | 0 | 0 | 111.5 | V49 C50 | V49-V54 HydrophobicContact CB-CG2 4.13Å; V49-V54 HydrophobicContact CG1-CG2 3.76Å; C50-V54 PolarHBondContact O-N 3.37Å; C50-V54 VanDerWaalsContact O-N 3.13Å |
| 55 | R | 54.1 | Low | 46.1 | Very low | 206 Ų | 206 | 112.2 Ų | 112.2 | 78% | 0.777 | 59% | 0.59 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.1 | -8.5 | -179.5 | -78 | 177.1 | 177.3 | 165.2 | -1.8 | 115.1 | C51 D52 C53 | C51-R55 WeakPolarHBondContact O-CG 3.37Å; C51-R55 PolarHBondContact O-N 3.49Å; D52-R55 PolarHBondContact O-N 3.06Å; C53-R55 VanDerWaalsContact C-N 3.3Å |
| 56 | K | 48.5 | Very low | 45.5 | Very low | 169 Ų | 169 | 116 Ų | 116 | 74% | 0.735 | 61% | 0.607 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108.8 | 12.7 | -171.6 | -78.1 | -173.8 | 176.3 | -178.7 | 0 | 115.5 | S58 | K56-S58 PolarHBondContact O-N 3.4Š|
| 57 | D | 38.3 | Very low | 45.4 | Very low | 153 Ų | 153 | 113.3 Ų | 113.3 | 82% | 0.818 | 60% | 0.596 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 47 | 21.8 | 177.2 | -82.9 | -12.9 | 0 | 0 | 0 | 116.2 | I59 | D57-I59 VanDerWaalsContact C-N 3.27Å; D57-I59 PolarHBondContact O-N 3.3Å; D57-I59 VanDerWaalsContact O-N 3.09Å |
| 58 | S | 41.9 | Very low | 45.5 | Very low | 67 Ų | 67 | 112.3 Ų | 112.3 | 47% | 0.469 | 59% | 0.592 | S | S | . | * | trans | -89 | 63.5 | 175.6 | 63.6 | 0 | 0 | 0 | 0 | 109.9 | K56 | K56-S58 PolarHBondContact O-N 3.4Š| ||
| 59 | I | 39.1 | Very low | 45.7 | Very low | 108 Ų | 108 | 117.9 Ų | 117.9 | 55% | 0.554 | 62% | 0.617 | S | S | * | * | trans | -126.4 | 48.1 | 178.1 | -42.2 | -179.5 | 0 | 0 | 0 | 111.1 | D57 | D57-I59 VanDerWaalsContact C-N 3.27Å; D57-I59 PolarHBondContact O-N 3.3Å; D57-I59 VanDerWaalsContact O-N 3.09Å | ||
| 60 | F | 35.6 | Very low | 45.9 | Very low | 215 Ų | 215 | 119 Ų | 119 | 94% | 0.943 | 63% | 0.625 | S | S | * | * | trans | -154.7 | 96.5 | 158.2 | -71.4 | -70.3 | 0 | 0 | 0 | 111.4 | ||||
| 61 | S | 38.6 | Very low | 45.9 | Very low | 126 Ų | 126 | 124.1 Ų | 124.1 | 88% | 0.881 | 65% | 0.649 | S | S | * | * | trans | -155.3 | 118.4 | 154.9 | -175.6 | 0 | 0 | 0 | 0 | 111 | ||||
| 62 | K | 32.4 | Very low | 46 | Very low | 201 Ų | 201 | 121.7 Ų | 121.7 | 87% | 0.874 | 63% | 0.63 | S | S | * | * | trans | -71.6 | 131.3 | 178.9 | -75.9 | 172.2 | 173.2 | 173.2 | 0 | 110.2 | ||||
| 63 | K | 33.8 | Very low | 46.2 | Very low | 200 Ų | 200 | 120 Ų | 120 | 87% | 0.87 | 63% | 0.625 | S | S | * | * | trans | -171 | 139.9 | 132.9 | -105.8 | 166.6 | -174.1 | -176.6 | 0 | 112.9 | ||||
| 64 | S | 37.5 | Very low | 46.7 | Very low | 123 Ų | 123 | 124.4 Ų | 124.4 | 86% | 0.86 | 65% | 0.647 | S | S | * | * | trans | 75.2 | 122.8 | 169.2 | 77.6 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 65 | G | 39.1 | Very low | 47 | Very low | 71 Ų | 71 | 128 Ų | 128 | 73% | 0.732 | 65% | 0.652 | S | S | * | * | trans | -71.4 | 150 | -172.7 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 66 | K | 40 | Very low | 47.4 | Very low | 183 Ų | 183 | 120 Ų | 120 | 80% | 0.796 | 62% | 0.624 | S | S | * | * | trans | 169.3 | 124.4 | 143.5 | -94.8 | 163.9 | -176.3 | -177 | 0 | 108.9 | ||||
| 67 | I | 48.8 | Very low | 48.4 | Very low | 83 Ų | 83 | 115.7 Ų | 115.7 | 43% | 0.426 | 61% | 0.612 | S | S | . | * | trans | 73.9 | 125.4 | 163.2 | -51.1 | 168.7 | 0 | 0 | 0 | 114.9 | Q71 | I67-Q71 HydrophobicContact CG2-CB 3.43Å; I67-Q71 VanDerWaalsContact CG2-CB 3.43Å | ||
| 68 | S | 50.9 | Low | 50 | Low | 59 Ų | 59 | 111 Ų | 111 | 41% | 0.413 | 60% | 0.595 | S | S | . | * | trans | -73.1 | 150.4 | 176.5 | 65.2 | 0 | 0 | 0 | 0 | 111 | P70 Q71 N72 | S68-P70 VanDerWaalsContact C-N 3.3Å; S68-Q71 WeakPolarHBondContact O-CB 3.06Å; S68-Q71 PolarHBondContact O-N 3.35Å; S68-Q71 WeakPolarHBondContact OG-CG 3.5Å; S68-N72 PolarHBondContact O-N 3.19Å | ||
| 69 | F | 53.9 | Low | 51.2 | Low | 184 Ų | 184 | 110.3 Ų | 110.3 | 81% | 0.807 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -49.2 | -40 | 179.3 | -174.4 | -93.9 | 0 | 0 | 0 | 114.5 | Q71 N72 S73 | F69-Q71 PolarHBondContact O-N 3.49Å; F69-N72 PolarHBondContact O-N 3.46Å; F69-S73 PolarHBondContact O-N 3.44Å; F69-S73 VanDerWaalsContact O-N 3.13Å |
| 70 | P | 56.4 | Low | 52.6 | Low | 80 Ų | 80 | 111.6 Ų | 111.6 | 52% | 0.519 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -60.8 | -40.7 | 174.9 | -21.7 | 32.7 | 0 | 0 | 0 | 113.4 | S68 N72 S73 D74 | S68-P70 VanDerWaalsContact C-N 3.3Å; P70-N72 VanDerWaalsContact C-N 3.33Å; P70-N72 PolarHBondContact O-N 2.94Å; P70-S73 WeakPolarHBondContact O-CB 3.5Å; P70-S73 PolarHBondContact O-N 3.17Å; P70-D74 PolarHBondContact O-N 2.82Å |
| 71 | Q | 57.2 | Low | 54.4 | Low | 110 Ų | 110 | 108.6 Ų | 108.6 | 51% | 0.514 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -68.6 | -31.2 | -178.3 | -72.4 | 175.3 | -16.9 | 0 | 0 | 112.7 | I67 S68 F69 R75 | I67-Q71 HydrophobicContact CG2-CB 3.43Å; I67-Q71 VanDerWaalsContact CG2-CB 3.43Å; S68-Q71 WeakPolarHBondContact O-CB 3.06Å; S68-Q71 PolarHBondContact O-N 3.35Å; S68-Q71 WeakPolarHBondContact OG-CG 3.5Å; F69-Q71 PolarHBondContact O-N 3.49Å; Q71-R75 WeakPolarHBondContact O-CG 3.22Å; Q71-R75 PolarHBondContact O-N 3.4Å |
| 72 | N | 56.3 | Low | 56.1 | Low | 32 Ų | 32 | 106.3 Ų | 106.3 | 17% | 0.171 | 56% | 0.556 | C | S | . | * | H | α-helix | trans | -74.3 | -39.1 | 173.9 | -114.5 | 9.7 | 0 | 0 | 0 | 111.7 | F48 S68 F69 P70 D74 R75 I76 | F48-N72 WeakPolarHBondContact CE1-ND2 3.36Å; F48-N72 WeakPolarHBondContact CZ-ND2 3.47Å; S68-N72 PolarHBondContact O-N 3.19Å; F69-N72 PolarHBondContact O-N 3.46Å; P70-N72 VanDerWaalsContact C-N 3.33Å; P70-N72 PolarHBondContact O-N 2.94Å; N72-D74 PolarHBondContact O-N 3.49Å; N72-R75 PolarHBondContact O-N 3.03Å; N72-I76 WeakPolarHBondContact O-CD1 3.42Å; N72-I76 WeakPolarHBondContact O-CG1 3.45Å; N72-I76 PolarHBondContact O-N 3.35Å |
| 73 | S | 57 | Low | 58 | Low | 51 Ų | 51 | 97.4 Ų | 97.4 | 36% | 0.357 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -55 | -49.9 | 172.3 | 157.7 | 0 | 0 | 0 | 0 | 111.7 | F69 P70 R75 I76 V77 | F69-S73 PolarHBondContact O-N 3.44Å; F69-S73 VanDerWaalsContact O-N 3.13Å; P70-S73 WeakPolarHBondContact O-CB 3.5Å; P70-S73 PolarHBondContact O-N 3.17Å; S73-R75 VanDerWaalsContact C-N 3.35Å; S73-R75 PolarHBondContact O-N 2.93Å; S73-I76 PolarHBondContact O-N 2.74Å; S73-V77 WeakPolarHBondContact O-CG2 3.13Å; S73-V77 PolarHBondContact O-N 3.24Å |
| 74 | D | 66.4 | Low | 59.8 | Low | 109 Ų | 109 | 92.5 Ų | 92.5 | 58% | 0.583 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -64.9 | -38 | -178.3 | -69 | -19.5 | 0 | 0 | 0 | 112.4 | P70 N72 V77 A78 | P70-D74 PolarHBondContact O-N 2.82Å; N72-D74 PolarHBondContact O-N 3.49Å; D74-V77 PolarHBondContact O-N 2.98Å; D74-A78 WeakPolarHBondContact O-CB 3.18Å; D74-A78 PolarHBondContact O-N 2.92Å |
| 75 | R | 61.7 | Low | 61.7 | Low | 159 Ų | 159 | 91 Ų | 91 | 60% | 0.6 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -63.3 | -41.4 | 173.7 | -75.7 | -178.1 | 88.4 | 178.1 | 5.6 | 111.9 | Q71 N72 S73 V77 A78 V79 | Q71-R75 WeakPolarHBondContact O-CG 3.22Å; Q71-R75 PolarHBondContact O-N 3.4Å; N72-R75 PolarHBondContact O-N 3.03Å; S73-R75 VanDerWaalsContact C-N 3.35Å; S73-R75 PolarHBondContact O-N 2.93Å; R75-V77 VanDerWaalsContact C-N 3.35Å; R75-V77 PolarHBondContact O-N 3Å; R75-A78 PolarHBondContact O-N 2.92Å; R75-V79 WeakPolarHBondContact O-CB 3.19Å; R75-V79 WeakPolarHBondContact O-CG2 3.45Å; R75-V79 PolarHBondContact O-N 3.41Å |
| 76 | I | 62.7 | Low | 63.4 | Low | 37 Ų | 37 | 91.8 Ų | 91.8 | 19% | 0.19 | 47% | 0.468 | C | S | . | . | H | α-helix | trans | -63.5 | -43.1 | 177.1 | -61.1 | 155.6 | 0 | 0 | 0 | 110.6 | L36 F48 N72 S73 V79 R80 | L36-I76 HydrophobicContact CD1-CG1 4.45Å; F48-I76 HydrophobicContact CD2-CD1 3.49Å; F48-I76 VanDerWaalsContact CD2-CD1 3.49Å; F48-I76 HydrophobicContact CD2-CG1 4.43Å; F48-I76 HydrophobicContact CE2-CD1 3.1Å; F48-I76 HydrophobicContact CE2-CG1 3.69Å; F48-I76 HydrophobicContact CZ-CD1 4.06Å; N72-I76 WeakPolarHBondContact O-CD1 3.42Å; N72-I76 WeakPolarHBondContact O-CG1 3.45Å; N72-I76 PolarHBondContact O-N 3.35Å; S73-I76 PolarHBondContact O-N 2.74Å; I76-V79 PolarHBondContact O-N 3.4Å; I76-R80 WeakPolarHBondContact O-CB 3.39Å; I76-R80 PolarHBondContact O-N 3.21Å |
| 77 | V | 69.6 | Low | 64.9 | Low | 79 Ų | 79 | 84.4 Ų | 84.4 | 48% | 0.479 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -64.3 | -43.2 | 179.1 | 174.2 | 0 | 0 | 0 | 0 | 111 | S73 D74 R75 R80 K81 | S73-V77 WeakPolarHBondContact O-CG2 3.13Å; S73-V77 PolarHBondContact O-N 3.24Å; D74-V77 PolarHBondContact O-N 2.98Å; R75-V77 VanDerWaalsContact C-N 3.35Å; R75-V77 PolarHBondContact O-N 3Å; V77-R80 PolarHBondContact O-N 2.91Å; V77-K81 PolarHBondContact O-N 3.41Å |
| 78 | A | 71.4 | Confident | 66.2 | Low | 55 Ų | 55 | 88.8 Ų | 88.8 | 46% | 0.455 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -62.1 | -47.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | D74 R75 R80 K81 S82 | D74-A78 WeakPolarHBondContact O-CB 3.18Å; D74-A78 PolarHBondContact O-N 2.92Å; R75-A78 PolarHBondContact O-N 2.92Å; A78-R80 PolarHBondContact O-N 2.87Å; A78-K81 WeakPolarHBondContact O-CB 3.19Å; A78-K81 PolarHBondContact O-N 2.91Å; A78-S82 PolarHBondContact O-N 3.24Å; A78-S82 PolarHBondContact O-OG 2.96Å |
| 79 | V | 67.6 | Low | 67.4 | Low | 52 Ų | 52 | 91.5 Ų | 91.5 | 32% | 0.315 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -67.2 | -38.7 | 179.6 | -179.5 | 0 | 0 | 0 | 0 | 111.1 | F14 L34 R75 I76 K81 S82 V83 | F14-V79 HydrophobicContact CE1-CG1 4.39Å; F14-V79 HydrophobicContact CZ-CG1 3.79Å; L34-V79 HydrophobicContact CD1-CB 4.4Å; L34-V79 HydrophobicContact CD1-CG1 3.99Å; L34-V79 HydrophobicContact CD2-CB 4.44Å; L34-V79 HydrophobicContact CD2-CG1 3.47Å; L34-V79 VanDerWaalsContact CD2-CG1 3.47Å; L34-V79 HydrophobicContact CG-CG1 4.21Å; R75-V79 WeakPolarHBondContact O-CB 3.19Å; R75-V79 WeakPolarHBondContact O-CG2 3.45Å; R75-V79 PolarHBondContact O-N 3.41Å; I76-V79 PolarHBondContact O-N 3.4Å; V79-K81 VanDerWaalsContact C-N 3.31Å; V79-K81 PolarHBondContact O-N 2.89Å; V79-S82 PolarHBondContact O-N 3.27Å; V79-S82 VanDerWaalsContact O-N 3.15Å; V79-V83 HydrophobicContact CG1-CG2 4.34Å; V79-V83 WeakPolarHBondContact O-CG2 3.49Å; V79-V83 PolarHBondContact O-N 3.08Å |
| 80 | R | 68.5 | Low | 68.1 | Low | 134 Ų | 134 | 85 Ų | 85 | 51% | 0.506 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -62.8 | -37.3 | 175 | -171.4 | 177.2 | -78.9 | -179.5 | -6.1 | 111.6 | L34 I76 V77 A78 N84 | L34-R80 HydrophobicContact CD1-CB 3.96Å; I76-R80 WeakPolarHBondContact O-CB 3.39Å; I76-R80 PolarHBondContact O-N 3.21Å; V77-R80 PolarHBondContact O-N 2.91Å; A78-R80 PolarHBondContact O-N 2.87Å; R80-N84 WeakPolarHBondContact O-CB 3.49Å; R80-N84 PolarHBondContact O-N 3.15Å; R80-N84 PolarHBondContact O-ND2 2.95Å |
| 81 | K | 73.6 | Confident | 68.7 | Low | 153 Ų | 153 | 88.1 Ų | 88.1 | 67% | 0.665 | 43% | 0.431 | S | S | * | . | H | α-helix | trans | -63.1 | -45.8 | 170.7 | -82.9 | -174.9 | 177.3 | -179.6 | 0 | 112 | V77 A78 V79 V83 N84 E85 | V77-K81 PolarHBondContact O-N 3.41Å; A78-K81 WeakPolarHBondContact O-CB 3.19Å; A78-K81 PolarHBondContact O-N 2.91Å; V79-K81 VanDerWaalsContact C-N 3.31Å; V79-K81 PolarHBondContact O-N 2.89Å; K81-V83 PolarHBondContact O-N 3.45Å; K81-N84 PolarHBondContact O-N 3.37Å; K81-E85 WeakPolarHBondContact O-CB 3.35Å; K81-E85 PolarHBondContact O-N 3.32Å |
| 82 | S | 73.6 | Confident | 69.4 | Low | 78 Ų | 78 | 87.2 Ų | 87.2 | 55% | 0.545 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -61.6 | -42.1 | 178 | -62.2 | 0 | 0 | 0 | 0 | 112.5 | A78 V79 E85 L86 | A78-S82 PolarHBondContact O-N 3.24Å; A78-S82 PolarHBondContact O-OG 2.96Å; V79-S82 PolarHBondContact O-N 3.27Å; V79-S82 VanDerWaalsContact O-N 3.15Å; S82-E85 PolarHBondContact O-N 3.48Å; S82-L86 PolarHBondContact O-N 3.01Å |
| 83 | V | 71.5 | Confident | 69.8 | Low | 14 Ų | 14 | 92.7 Ų | 92.7 | 9% | 0.085 | 45% | 0.452 | C | S | . | . | H | α-helix | trans | -64.6 | -43.2 | 176.4 | 169.4 | 0 | 0 | 0 | 0 | 111.2 | F14 F32 L34 V79 K81 E85 L86 N87 | F14-V83 HydrophobicContact CE1-CG2 4Å; F32-V83 HydrophobicContact CB-CG1 3.9Å; F32-V83 WeakPolarHBondContact O-CG1 3.23Å; L34-V83 HydrophobicContact CD1-CG2 4.44Å; L34-V83 HydrophobicContact CG-CG2 4.28Å; V79-V83 HydrophobicContact CG1-CG2 4.34Å; V79-V83 WeakPolarHBondContact O-CG2 3.49Å; V79-V83 PolarHBondContact O-N 3.08Å; K81-V83 PolarHBondContact O-N 3.45Å; V83-E85 VanDerWaalsContact C-N 3.33Å; V83-E85 PolarHBondContact O-N 3.29Å; V83-L86 PolarHBondContact O-N 3.37Å; V83-N87 WeakPolarHBondContact O-CB 3.39Å; V83-N87 PolarHBondContact O-N 3.37Å |
| 84 | N | 72.7 | Confident | 70 | Confident | 96 Ų | 96 | 93.4 Ų | 93.4 | 51% | 0.513 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -63.9 | -38.6 | 176.5 | -73.9 | -14 | 0 | 0 | 0 | 112.4 | R80 K81 R88 | R80-N84 WeakPolarHBondContact O-CB 3.49Å; R80-N84 PolarHBondContact O-N 3.15Å; R80-N84 PolarHBondContact O-ND2 2.95Å; K81-N84 PolarHBondContact O-N 3.37Å; N84-R88 WeakPolarHBondContact O-CB 3.48Å; N84-R88 PolarHBondContact O-N 3.34Å |
| 85 | E | 77.6 | Confident | 69.8 | Low | 91 Ų | 91 | 92.1 Ų | 92.1 | 43% | 0.425 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -66.8 | -38.5 | 175.2 | -173.6 | 60.3 | -160.2 | 0 | 0 | 111.7 | K81 S82 V83 R88 K89 | K81-E85 WeakPolarHBondContact O-CB 3.35Å; K81-E85 PolarHBondContact O-N 3.32Å; S82-E85 PolarHBondContact O-N 3.48Å; V83-E85 VanDerWaalsContact C-N 3.33Å; V83-E85 PolarHBondContact O-N 3.29Å; E85-R88 PolarHBondContact O-N 2.95Å; E85-K89 WeakPolarHBondContact O-CG 3.45Å; E85-K89 PolarHBondContact O-N 3.34Å |
| 86 | L | 73.4 | Confident | 70.1 | Confident | 89 Ų | 89 | 89.6 Ų | 89.6 | 47% | 0.466 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -63.9 | -48.2 | 175.3 | -141.6 | 102 | 0 | 0 | 0 | 111.3 | F32 S82 V83 R88 K89 I90 | F32-L86 HydrophobicContact CD2-CD2 3.71Å; F32-L86 HydrophobicContact CE2-CD2 3.64Å; F32-L86 HydrophobicContact CG-CD2 4.36Å; F32-L86 HydrophobicContact CZ-CD2 4.2Å; S82-L86 PolarHBondContact O-N 3.01Å; V83-L86 PolarHBondContact O-N 3.37Å; L86-R88 VanDerWaalsContact C-N 3.26Å; L86-R88 PolarHBondContact O-N 3.36Å; L86-K89 PolarHBondContact O-N 3.15Å; L86-K89 VanDerWaalsContact O-N 3.14Å; L86-I90 HydrophobicContact CD2-CD1 4.33Å; L86-I90 WeakPolarHBondContact O-CG1 3.37Å; L86-I90 PolarHBondContact O-N 2.98Å |
| 87 | N | 73.1 | Confident | 70 | Confident | 28 Ų | 28 | 93.2 Ų | 93.2 | 15% | 0.15 | 46% | 0.464 | C | S | . | . | H | α-helix | trans | -59.8 | -37.7 | 176.1 | -75.2 | -21.2 | 0 | 0 | 0 | 111.3 | F32 V83 K91 | F32-N87 PolarHBondContact N-OD1 3.35Å; F32-N87 PolarHBondContact O-ND2 2.98Å; V83-N87 WeakPolarHBondContact O-CB 3.39Å; V83-N87 PolarHBondContact O-N 3.37Å; N87-K91 PolarHBondContact O-N 3.01Å; N87-K91 VanDerWaalsContact O-N 3.15Å |
| 88 | R | 74.2 | Confident | 69.6 | Low | 174 Ų | 174 | 95.2 Ų | 95.2 | 66% | 0.657 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -65.4 | -42.7 | 175.1 | -176.6 | -178 | 156.9 | 161.2 | -4.4 | 112.1 | N84 E85 L86 K91 V92 | N84-R88 WeakPolarHBondContact O-CB 3.48Å; N84-R88 PolarHBondContact O-N 3.34Å; E85-R88 PolarHBondContact O-N 2.95Å; L86-R88 VanDerWaalsContact C-N 3.26Å; L86-R88 PolarHBondContact O-N 3.36Å; R88-K91 PolarHBondContact O-N 3.14Å; R88-V92 PolarHBondContact O-N 3.21Å |
| 89 | K | 76 | Confident | 69.1 | Low | 117 Ų | 117 | 100.8 Ų | 100.8 | 51% | 0.509 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -63 | -43.1 | 176.9 | -74.9 | 179.4 | -179.6 | -179.9 | 0 | 111.8 | E85 L86 K91 V92 Y93 | E85-K89 WeakPolarHBondContact O-CG 3.45Å; E85-K89 PolarHBondContact O-N 3.34Å; L86-K89 PolarHBondContact O-N 3.15Å; L86-K89 VanDerWaalsContact O-N 3.14Å; K89-K91 VanDerWaalsContact C-N 3.29Å; K89-K91 PolarHBondContact O-N 3.34Å; K89-V92 PolarHBondContact O-N 3.22Å; K89-V92 VanDerWaalsContact O-N 3.08Å; K89-Y93 WeakPolarHBondContact O-CD2 3.38Å; K89-Y93 PolarHBondContact O-N 3.18Å |
| 90 | I | 70 | Confident | 68.8 | Low | 48 Ų | 48 | 101.3 Ų | 101.3 | 25% | 0.246 | 49% | 0.486 | C | S | . | . | H | α-helix | trans | -58.7 | -43.6 | 177.5 | -69 | 165 | 0 | 0 | 0 | 110.9 | P30 F32 L86 V92 Y93 E94 | P30-I90 HydrophobicContact CG-CG2 4.26Å; F32-I90 HydrophobicContact CD2-CD1 3.91Å; F32-I90 HydrophobicContact CE2-CD1 3.54Å; L86-I90 HydrophobicContact CD2-CD1 4.33Å; L86-I90 WeakPolarHBondContact O-CG1 3.37Å; L86-I90 PolarHBondContact O-N 2.98Å; I90-V92 PolarHBondContact O-N 3.37Å; I90-Y93 PolarHBondContact O-N 3.17Å; I90-Y93 VanDerWaalsContact O-N 3.09Å; I90-E94 PolarHBondContact O-N 3.33Å; I90-E94 VanDerWaalsContact O-N 3.14Å |
| 91 | K | 68.7 | Low | 68.5 | Low | 145 Ų | 145 | 98.3 Ų | 98.3 | 63% | 0.63 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -61.2 | -25.4 | 177.7 | -133.5 | 177.4 | -174.9 | -177.8 | 0 | 114.2 | N87 R88 K89 | N87-K91 PolarHBondContact O-N 3.01Å; N87-K91 VanDerWaalsContact O-N 3.15Å; R88-K91 PolarHBondContact O-N 3.14Å; K89-K91 VanDerWaalsContact C-N 3.29Å; K89-K91 PolarHBondContact O-N 3.34Å |
| 92 | V | 71 | Confident | 67.8 | Low | 90 Ų | 90 | 97.7 Ų | 97.7 | 55% | 0.545 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -81 | -31 | 176.9 | 174.7 | 0 | 0 | 0 | 0 | 111.8 | R88 K89 I90 P95 | R88-V92 PolarHBondContact O-N 3.21Å; K89-V92 PolarHBondContact O-N 3.22Å; K89-V92 VanDerWaalsContact O-N 3.08Å; I90-V92 PolarHBondContact O-N 3.37Å; V92-P95 WeakPolarHBondContact O-CD 3.46Å |
| 93 | Y | 65.5 | Low | 67.3 | Low | 147 Ų | 147 | 100.3 Ų | 100.3 | 58% | 0.576 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -87.1 | -20.2 | -178 | -74.2 | -70.4 | 0 | 0 | 0 | 114.2 | K89 I90 I96 L97 | K89-Y93 WeakPolarHBondContact O-CD2 3.38Å; K89-Y93 PolarHBondContact O-N 3.18Å; I90-Y93 PolarHBondContact O-N 3.17Å; I90-Y93 VanDerWaalsContact O-N 3.09Å; Y93-I96 HydrophobicContact CD1-CD1 4.42Å; Y93-I96 PolarHBondContact O-N 3.14Å; Y93-L97 PolarHBondContact O-N 3.09Å |
| 94 | E | 62.2 | Low | 66.9 | Low | 67 Ų | 67 | 103.5 Ų | 103.5 | 31% | 0.313 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -53.5 | -46 | -179.4 | -172.3 | 173.5 | -154.8 | 0 | 0 | 114.2 | I90 I96 F98 | I90-E94 PolarHBondContact O-N 3.33Å; I90-E94 VanDerWaalsContact O-N 3.14Å; E94-I96 VanDerWaalsContact C-N 3.32Å; E94-I96 PolarHBondContact O-N 3.18Å; E94-F98 PolarHBondContact O-N 3.08Å |
| 95 | P | 62.1 | Low | 66.4 | Low | 82 Ų | 82 | 105.2 Ų | 105.2 | 53% | 0.532 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -70.9 | -26.8 | -180 | -15.5 | 30.7 | 0 | 0 | 0 | 113.6 | V92 K99 | V92-P95 WeakPolarHBondContact O-CD 3.46Å; P95-K99 PolarHBondContact O-N 3.38Å |
| 96 | I | 66.9 | Low | 66 | Low | 106 Ų | 106 | 102.6 Ų | 102.6 | 54% | 0.544 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -75.5 | -41.5 | -177.2 | -59.4 | 174.5 | 0 | 0 | 0 | 109.8 | Y93 E94 S100 | Y93-I96 HydrophobicContact CD1-CD1 4.42Å; Y93-I96 PolarHBondContact O-N 3.14Å; E94-I96 VanDerWaalsContact C-N 3.32Å; E94-I96 PolarHBondContact O-N 3.18Å; I96-S100 PolarHBondContact O-N 3.36Å; I96-S100 PolarHBondContact O-OG 3.34Å |
| 97 | L | 60.5 | Low | 66.1 | Low | 112 Ų | 112 | 106.8 Ų | 106.8 | 59% | 0.586 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -67.1 | -39.6 | 175.5 | -74.9 | 163.7 | 0 | 0 | 0 | 111.8 | Y93 S100 V101 | Y93-L97 PolarHBondContact O-N 3.09Å; L97-S100 PolarHBondContact O-OG 3.27Å; L97-S100 VanDerWaalsContact O-OG 3.07Å; L97-V101 VanDerWaalsContact O-CG2 3.28Å; L97-V101 WeakPolarHBondContact O-CG2 3.29Å; L97-V101 PolarHBondContact O-N 3.31Å |
| 98 | F | 60.5 | Low | 66.3 | Low | 121 Ų | 121 | 109.6 Ų | 109.6 | 53% | 0.531 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -63.7 | -43.3 | 177.5 | -111.9 | -94.9 | 0 | 0 | 0 | 112.4 | E94 S100 F102 | E94-F98 PolarHBondContact O-N 3.08Å; F98-S100 PolarHBondContact O-N 3.33Å; F98-F102 AromaticContact CD1-CD2 3.94Å; F98-F102 HydrophobicContact CD1-CD2 3.94Å; F98-F102 AromaticContact CD1-CE2 3.53Å; F98-F102 HydrophobicContact CD1-CE2 3.53Å; F98-F102 HydrophobicContact CE1-CD2 4.44Å; F98-F102 AromaticContact CE1-CE2 3.6Å; F98-F102 HydrophobicContact CE1-CE2 3.6Å; F98-F102 HydrophobicContact CE1-CZ 4.44Å; F98-F102 WeakPolarHBondContact O-CD2 3.28Å; F98-F102 PolarHBondContact O-N 3.29Å |
| 99 | K | 61.2 | Low | 66.5 | Low | 172 Ų | 172 | 107.9 Ų | 107.9 | 75% | 0.748 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -65.1 | -38.9 | 179.5 | -95.4 | -177.1 | 175.6 | 178.8 | 0 | 113.9 | P95 H103 | P95-K99 PolarHBondContact O-N 3.38Å; K99-H103 PolarHBondContact O-N 3.35Å |
| 100 | S | 62.1 | Low | 66.6 | Low | 63 Ų | 63 | 107.4 Ų | 107.4 | 44% | 0.441 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -70.6 | -38.3 | -178.5 | 61.5 | 0 | 0 | 0 | 0 | 112.2 | I96 L97 F98 T104 | I96-S100 PolarHBondContact O-N 3.36Å; I96-S100 PolarHBondContact O-OG 3.34Å; L97-S100 PolarHBondContact O-OG 3.27Å; L97-S100 VanDerWaalsContact O-OG 3.07Å; F98-S100 PolarHBondContact O-N 3.33Å; S100-T104 PolarHBondContact O-N 3.48Å; S100-T104 PolarHBondContact O-OG1 2.91Å |
| 101 | V | 61.4 | Low | 67.3 | Low | 72 Ų | 72 | 110 Ų | 110 | 44% | 0.436 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -65.8 | -48.6 | 179.8 | 173.9 | 0 | 0 | 0 | 0 | 111.1 | L97 H103 T104 F105 | L97-V101 VanDerWaalsContact O-CG2 3.28Å; L97-V101 WeakPolarHBondContact O-CG2 3.29Å; L97-V101 PolarHBondContact O-N 3.31Å; V101-H103 PolarHBondContact O-N 3.26Å; V101-T104 WeakPolarHBondContact O-CB 3.19Å; V101-T104 PolarHBondContact O-N 3.18Å; V101-T104 VanDerWaalsContact O-N 3.14Å; V101-F105 HydrophobicContact CG1-CD2 3.83Å; V101-F105 HydrophobicContact CG1-CE2 3.51Å; V101-F105 VanDerWaalsContact O-CD2 3.29Å; V101-F105 WeakPolarHBondContact O-CD2 3.43Å; V101-F105 PolarHBondContact O-N 3.14Å |
| 102 | F | 60.3 | Low | 68.1 | Low | 139 Ų | 139 | 107.2 Ų | 107.2 | 61% | 0.61 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -63.4 | -37.3 | -179.9 | -88.2 | -87.3 | 0 | 0 | 0 | 113.7 | F98 T104 F105 G106 | F98-F102 AromaticContact CD1-CD2 3.94Å; F98-F102 HydrophobicContact CD1-CD2 3.94Å; F98-F102 AromaticContact CD1-CE2 3.53Å; F98-F102 HydrophobicContact CD1-CE2 3.53Å; F98-F102 HydrophobicContact CE1-CD2 4.44Å; F98-F102 AromaticContact CE1-CE2 3.6Å; F98-F102 HydrophobicContact CE1-CE2 3.6Å; F98-F102 HydrophobicContact CE1-CZ 4.44Å; F98-F102 WeakPolarHBondContact O-CD2 3.28Å; F98-F102 PolarHBondContact O-N 3.29Å; F102-T104 PolarHBondContact O-N 3.07Å; F102-F105 PolarHBondContact O-N 3.47Å; F102-G106 PolarHBondContact O-N 3.48Å |
| 103 | H | 62.1 | Low | 69 | Low | 134 Ų | 134 | 107.9 Ų | 107.9 | 62% | 0.62 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -68.3 | -25.7 | 177.9 | -140.9 | -46.3 | 0 | 0 | 0 | 112.8 | K99 V101 | K99-H103 PolarHBondContact O-N 3.35Å; V101-H103 PolarHBondContact O-N 3.26Å |
| 104 | T | 62.6 | Low | 70.1 | Confident | 81 Ų | 81 | 108.3 Ų | 108.3 | 50% | 0.497 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -75.9 | -40.5 | 176.4 | -46.3 | 0 | 0 | 0 | 0 | 110.7 | S100 V101 F102 R107 I108 | S100-T104 PolarHBondContact O-N 3.48Å; S100-T104 PolarHBondContact O-OG1 2.91Å; V101-T104 WeakPolarHBondContact O-CB 3.19Å; V101-T104 PolarHBondContact O-N 3.18Å; V101-T104 VanDerWaalsContact O-N 3.14Å; F102-T104 PolarHBondContact O-N 3.07Å; T104-R107 PolarHBondContact O-N 3.3Å; T104-I108 HydrophobicContact CG2-CD1 4.34Å; T104-I108 WeakPolarHBondContact O-CG1 3.48Å; T104-I108 PolarHBondContact O-N 3.36Å; T104-I108 VanDerWaalsContact O-N 3.17Å |
| 105 | F | 63.6 | Low | 71.5 | Confident | 131 Ų | 131 | 108.4 Ų | 108.4 | 58% | 0.575 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -60.3 | -46.5 | 175.2 | -83.3 | -73.1 | 0 | 0 | 0 | 113.1 | V101 F102 R107 I108 E109 | V101-F105 HydrophobicContact CG1-CD2 3.83Å; V101-F105 HydrophobicContact CG1-CE2 3.51Å; V101-F105 VanDerWaalsContact O-CD2 3.29Å; V101-F105 WeakPolarHBondContact O-CD2 3.43Å; V101-F105 PolarHBondContact O-N 3.14Å; F102-F105 PolarHBondContact O-N 3.47Å; F105-R107 VanDerWaalsContact C-N 3.3Å; F105-R107 PolarHBondContact O-N 3.24Å; F105-I108 WeakPolarHBondContact O-CB 3.33Å; F105-I108 PolarHBondContact O-N 3.01Å; F105-I108 VanDerWaalsContact O-N 3.08Å; F105-E109 PolarHBondContact O-N 3.17Å; F105-E109 VanDerWaalsContact O-N 3.11Å |
| 106 | G | 69.6 | Low | 72.9 | Confident | 37 Ų | 37 | 107.7 Ų | 107.7 | 38% | 0.381 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -62.9 | -33.9 | 179 | 0 | 0 | 0 | 0 | 0 | 113.9 | F102 E110 | F102-G106 PolarHBondContact O-N 3.48Å; G106-E110 PolarHBondContact O-N 2.72Å |
| 107 | R | 74.2 | Confident | 74.2 | Confident | 177 Ų | 177 | 106.1 Ų | 106.1 | 67% | 0.668 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -68.6 | -35.4 | 173.5 | -75.3 | -175.5 | 177.8 | -174.1 | 1 | 112.3 | T104 F105 L111 | T104-R107 PolarHBondContact O-N 3.3Å; F105-R107 VanDerWaalsContact C-N 3.3Å; F105-R107 PolarHBondContact O-N 3.24Å; R107-L111 WeakPolarHBondContact O-CB 3.46Å; R107-L111 PolarHBondContact O-N 3.33Å; R107-L111 VanDerWaalsContact O-N 3.07Å |
| 108 | I | 76.8 | Confident | 75.8 | Confident | 86 Ų | 86 | 105.9 Ų | 105.9 | 44% | 0.441 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -66.6 | -42.5 | 177.9 | -68.6 | 165.6 | 0 | 0 | 0 | 110.6 | T104 F105 L111 N112 | T104-I108 HydrophobicContact CG2-CD1 4.34Å; T104-I108 WeakPolarHBondContact O-CG1 3.48Å; T104-I108 PolarHBondContact O-N 3.36Å; T104-I108 VanDerWaalsContact O-N 3.17Å; F105-I108 WeakPolarHBondContact O-CB 3.33Å; F105-I108 PolarHBondContact O-N 3.01Å; F105-I108 VanDerWaalsContact O-N 3.08Å; I108-L111 PolarHBondContact O-N 3.11Å; I108-N112 PolarHBondContact O-N 3.08Å; I108-N112 PolarHBondContact O-ND2 2.83Å |
| 109 | E | 78.3 | Confident | 77.4 | Confident | 139 Ų | 139 | 105.9 Ų | 105.9 | 65% | 0.65 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -61.9 | -45.9 | 175.7 | -84.6 | 179.5 | 157.2 | 0 | 0 | 112.5 | F105 L111 N112 V113 | F105-E109 PolarHBondContact O-N 3.17Å; F105-E109 VanDerWaalsContact O-N 3.11Å; E109-L111 VanDerWaalsContact C-N 3.27Å; E109-L111 PolarHBondContact O-N 3.33Å; E109-N112 PolarHBondContact O-N 3.04Å; E109-V113 WeakPolarHBondContact O-CG2 3.45Å; E109-V113 PolarHBondContact O-N 3.36Å |
| 110 | E | 79.9 | Confident | 78.9 | Confident | 106 Ų | 106 | 104.1 Ų | 104.1 | 50% | 0.495 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -62.2 | -37.4 | 177.6 | -160.6 | -172.5 | 164.8 | 0 | 0 | 111.7 | G106 V113 R114 | G106-E110 PolarHBondContact O-N 2.72Å; E110-V113 PolarHBondContact O-N 2.92Å; E110-R114 WeakPolarHBondContact O-CG 3.5Å; E110-R114 PolarHBondContact O-N 3.41Å; E110-R114 VanDerWaalsContact O-N 3.11Å; E110-R114 IonicContact OE1-CZ 3.51Å; E110-R114 IonicContact OE1-NE 3.71Å; E110-R114 IonicContact OE1-NH2 2.73Å; E110-R114 PolarHBondContact OE1-NH2 3.37Å |
| 111 | L | 83.3 | Confident | 80.5 | Confident | 104 Ų | 104 | 104.4 Ų | 104.4 | 55% | 0.545 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -65.4 | -42.4 | 175.1 | -132.2 | 128.4 | 0 | 0 | 0 | 111.6 | R107 I108 E109 V113 R114 I115 | R107-L111 WeakPolarHBondContact O-CB 3.46Å; R107-L111 PolarHBondContact O-N 3.33Å; R107-L111 VanDerWaalsContact O-N 3.07Å; I108-L111 PolarHBondContact O-N 3.11Å; E109-L111 VanDerWaalsContact C-N 3.27Å; E109-L111 PolarHBondContact O-N 3.33Å; L111-V113 PolarHBondContact O-N 3.41Å; L111-R114 PolarHBondContact O-N 3.17Å; L111-I115 HydrophobicContact CD2-CD1 3.83Å; L111-I115 HydrophobicContact CD2-CG1 4.4Å; L111-I115 VanDerWaalsContact O-CG1 3.3Å; L111-I115 WeakPolarHBondContact O-CG1 3.42Å; L111-I115 PolarHBondContact O-N 3Å |
| 112 | N | 85.9 | Confident | 82.1 | Confident | 86 Ų | 86 | 105.9 Ų | 105.9 | 46% | 0.46 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -62.9 | -39.9 | 177.1 | -76.5 | -21.8 | 0 | 0 | 0 | 112.3 | I108 E109 I115 S116 | I108-N112 PolarHBondContact O-N 3.08Å; I108-N112 PolarHBondContact O-ND2 2.83Å; E109-N112 PolarHBondContact O-N 3.04Å; N112-I115 PolarHBondContact O-N 3.47Å; N112-S116 WeakPolarHBondContact O-CB 3.48Å; N112-S116 PolarHBondContact O-N 3.11Å; N112-S116 PolarHBondContact O-OG 2.73Å |
| 113 | V | 89.2 | Confident | 83.7 | Confident | 103 Ų | 103 | 105.5 Ų | 105.5 | 62% | 0.624 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -64 | -42.2 | 174.9 | 174.2 | 0 | 0 | 0 | 0 | 110.9 | E109 E110 L111 S116 S117 | E109-V113 WeakPolarHBondContact O-CG2 3.45Å; E109-V113 PolarHBondContact O-N 3.36Å; E110-V113 PolarHBondContact O-N 2.92Å; L111-V113 PolarHBondContact O-N 3.41Å; V113-S116 PolarHBondContact O-N 3.48Å; V113-S117 WeakPolarHBondContact O-CB 3.47Å; V113-S117 PolarHBondContact O-N 2.98Å |
| 114 | R | 90 | Very high | 85.3 | Confident | 156 Ų | 156 | 105.3 Ų | 105.3 | 59% | 0.589 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -66.8 | -40.4 | 176.2 | -72.5 | 179.2 | -171.2 | -171.5 | 5.1 | 112.6 | E110 L111 S117 L118 | E110-R114 WeakPolarHBondContact O-CG 3.5Å; E110-R114 PolarHBondContact O-N 3.41Å; E110-R114 VanDerWaalsContact O-N 3.11Å; E110-R114 IonicContact OE1-CZ 3.51Å; E110-R114 IonicContact OE1-NE 3.71Å; E110-R114 IonicContact OE1-NH2 2.73Å; E110-R114 PolarHBondContact OE1-NH2 3.37Å; L111-R114 PolarHBondContact O-N 3.17Å; R114-S117 PolarHBondContact O-N 3.43Å; R114-L118 WeakPolarHBondContact O-CB 3.27Å; R114-L118 WeakPolarHBondContact O-CG 3.46Å; R114-L118 PolarHBondContact O-N 3.4Å |
| 115 | I | 91.3 | Very high | 86.9 | Confident | 70 Ų | 70 | 105.5 Ų | 105.5 | 36% | 0.359 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -58.8 | -49.8 | 173.7 | -72.5 | 167.4 | 0 | 0 | 0 | 109.5 | L111 N112 S117 L118 E119 | L111-I115 HydrophobicContact CD2-CD1 3.83Å; L111-I115 HydrophobicContact CD2-CG1 4.4Å; L111-I115 VanDerWaalsContact O-CG1 3.3Å; L111-I115 WeakPolarHBondContact O-CG1 3.42Å; L111-I115 PolarHBondContact O-N 3Å; N112-I115 PolarHBondContact O-N 3.47Å; I115-S117 VanDerWaalsContact C-N 3.3Å; I115-S117 PolarHBondContact O-N 2.83Å; I115-L118 WeakPolarHBondContact O-CB 3.46Å; I115-L118 PolarHBondContact O-N 3.23Å; I115-L118 VanDerWaalsContact O-N 3.1Å; I115-E119 HydrophobicContact CG2-CG 4.27Å; I115-E119 WeakPolarHBondContact O-CG 3.3Å; I115-E119 PolarHBondContact O-N 2.99Å |
| 116 | S | 91.9 | Very high | 88.4 | Confident | 67 Ų | 67 | 103.4 Ų | 103.4 | 47% | 0.469 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -59.8 | -40.4 | 179.8 | -55.7 | 0 | 0 | 0 | 0 | 112.2 | N112 V113 E119 H120 | N112-S116 WeakPolarHBondContact O-CB 3.48Å; N112-S116 PolarHBondContact O-N 3.11Å; N112-S116 PolarHBondContact O-OG 2.73Å; V113-S116 PolarHBondContact O-N 3.48Å; S116-E119 PolarHBondContact O-N 3.48Å; S116-H120 PolarHBondContact O-N 3.07Å |
| 117 | S | 93.9 | Very high | 89.7 | Confident | 73 Ų | 73 | 108.1 Ų | 108.1 | 51% | 0.51 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -65.4 | -41.3 | 175.2 | 179.9 | 0 | 0 | 0 | 0 | 112.6 | V113 R114 I115 H120 T121 | V113-S117 WeakPolarHBondContact O-CB 3.47Å; V113-S117 PolarHBondContact O-N 2.98Å; R114-S117 PolarHBondContact O-N 3.43Å; I115-S117 VanDerWaalsContact C-N 3.3Å; I115-S117 PolarHBondContact O-N 2.83Å; S117-H120 PolarHBondContact O-N 3.26Å; S117-T121 WeakPolarHBondContact O-CB 3.49Å; S117-T121 PolarHBondContact O-N 3.1Å; S117-T121 PolarHBondContact O-OG1 2.93Å |
| 118 | L | 92.9 | Very high | 90.7 | Very high | 107 Ų | 107 | 102.9 Ų | 102.9 | 56% | 0.56 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -64.9 | -43.3 | 175 | -82.8 | 164.9 | 0 | 0 | 0 | 111.7 | R114 I115 H120 T121 I122 | R114-L118 WeakPolarHBondContact O-CB 3.27Å; R114-L118 WeakPolarHBondContact O-CG 3.46Å; R114-L118 PolarHBondContact O-N 3.4Å; I115-L118 WeakPolarHBondContact O-CB 3.46Å; I115-L118 PolarHBondContact O-N 3.23Å; I115-L118 VanDerWaalsContact O-N 3.1Å; L118-H120 VanDerWaalsContact C-N 3.34Å; L118-H120 PolarHBondContact O-N 2.9Å; L118-T121 PolarHBondContact O-N 3.32Å; L118-I122 WeakPolarHBondContact O-CB 3.49Å; L118-I122 VanDerWaalsContact O-CG1 3.27Å; L118-I122 WeakPolarHBondContact O-CG1 3.37Å; L118-I122 PolarHBondContact O-N 3.22Å |
| 119 | E | 93.8 | Very high | 91.6 | Very high | 120 Ų | 120 | 102.8 Ų | 102.8 | 56% | 0.561 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -58.4 | -46.5 | 175.6 | -73.9 | 176 | 161 | 0 | 0 | 111.1 | I115 S116 T121 I122 E123 | I115-E119 HydrophobicContact CG2-CG 4.27Å; I115-E119 WeakPolarHBondContact O-CG 3.3Å; I115-E119 PolarHBondContact O-N 2.99Å; S116-E119 PolarHBondContact O-N 3.48Å; E119-T121 VanDerWaalsContact C-N 3.32Å; E119-T121 PolarHBondContact O-N 2.8Å; E119-I122 PolarHBondContact O-N 3.47Å; E119-E123 WeakPolarHBondContact O-CB 3.33Å; E119-E123 PolarHBondContact O-N 3.44Å |
| 120 | H | 94.2 | Very high | 92.4 | Very high | 136 Ų | 136 | 98.6 Ų | 98.6 | 63% | 0.63 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -63.8 | -37.8 | 177.5 | -152.4 | 61.3 | 0 | 0 | 0 | 112.4 | S116 S117 L118 E123 F124 | S116-H120 PolarHBondContact O-N 3.07Å; S117-H120 PolarHBondContact O-N 3.26Å; L118-H120 VanDerWaalsContact C-N 3.34Å; L118-H120 PolarHBondContact O-N 2.9Å; H120-E123 PolarHBondContact O-N 2.83Å; H120-F124 WeakPolarHBondContact O-CB 3.49Å; H120-F124 PolarHBondContact O-N 2.84Å |
| 121 | T | 94.7 | Very high | 93.2 | Very high | 69 Ų | 69 | 98 Ų | 98 | 42% | 0.423 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -67.3 | -42.4 | 176.1 | -54.5 | 0 | 0 | 0 | 0 | 111.5 | S117 L118 E119 E123 F124 L125 | S117-T121 WeakPolarHBondContact O-CB 3.49Å; S117-T121 PolarHBondContact O-N 3.1Å; S117-T121 PolarHBondContact O-OG1 2.93Å; L118-T121 PolarHBondContact O-N 3.32Å; E119-T121 VanDerWaalsContact C-N 3.32Å; E119-T121 PolarHBondContact O-N 2.8Å; T121-E123 VanDerWaalsContact C-N 3.34Å; T121-F124 PolarHBondContact O-N 3.29Å; T121-L125 HydrophobicContact CG2-CD1 4.13Å; T121-L125 HydrophobicContact CG2-CG 4.45Å; T121-L125 WeakPolarHBondContact O-CB 3.42Å; T121-L125 VanDerWaalsContact O-CG 3.31Å; T121-L125 WeakPolarHBondContact O-CG 3.46Å; T121-L125 PolarHBondContact O-N 2.93Å |
| 122 | I | 94.8 | Very high | 93.8 | Very high | 102 Ų | 102 | 99 Ų | 99 | 52% | 0.523 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -60.7 | -46.7 | 175.1 | -71.6 | 166.7 | 0 | 0 | 0 | 109.4 | L118 E119 F124 L125 T126 | L118-I122 WeakPolarHBondContact O-CB 3.49Å; L118-I122 VanDerWaalsContact O-CG1 3.27Å; L118-I122 WeakPolarHBondContact O-CG1 3.37Å; L118-I122 PolarHBondContact O-N 3.22Å; E119-I122 PolarHBondContact O-N 3.47Å; I122-F124 PolarHBondContact O-N 2.97Å; I122-L125 PolarHBondContact O-N 3.44Å; I122-T126 WeakPolarHBondContact O-CB 3.31Å; I122-T126 PolarHBondContact O-N 3.38Å; I122-T126 PolarHBondContact O-OG1 3.34Å |
| 123 | E | 94.8 | Very high | 94.3 | Very high | 132 Ų | 132 | 103.8 Ų | 103.8 | 62% | 0.617 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -60.9 | -46 | 179.5 | -165.2 | 176.3 | -166 | 0 | 0 | 111.8 | E119 H120 T121 T126 K127 | E119-E123 WeakPolarHBondContact O-CB 3.33Å; E119-E123 PolarHBondContact O-N 3.44Å; H120-E123 PolarHBondContact O-N 2.83Å; T121-E123 VanDerWaalsContact C-N 3.34Å; E123-T126 PolarHBondContact O-N 3.29Å; E123-K127 PolarHBondContact O-N 2.94Å |
| 124 | F | 95.8 | Very high | 94.6 | Very high | 129 Ų | 129 | 104.8 Ų | 104.8 | 57% | 0.566 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -59 | -50 | 175.1 | 177.1 | -98.1 | 0 | 0 | 0 | 112.4 | H120 T121 I122 T126 K127 M128 | H120-F124 WeakPolarHBondContact O-CB 3.49Å; H120-F124 PolarHBondContact O-N 2.84Å; T121-F124 PolarHBondContact O-N 3.29Å; I122-F124 PolarHBondContact O-N 2.97Å; F124-T126 VanDerWaalsContact C-N 3.28Å; F124-T126 PolarHBondContact O-N 2.59Å; F124-K127 PolarHBondContact O-N 3.47Å; F124-M128 HydrophobicContact CE1-SD 4.29Å; F124-M128 HydrophobicContact CZ-SD 4.4Å; F124-M128 WeakPolarHBondContact O-CB 3.45Å; F124-M128 PolarHBondContact O-N 3.44Å |
| 125 | L | 95.3 | Very high | 94.9 | Very high | 85 Ų | 85 | 103.8 Ų | 103.8 | 45% | 0.445 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -63.2 | -36 | 179 | -72.4 | 176.2 | 0 | 0 | 0 | 111.9 | T121 I122 M128 N129 | T121-L125 HydrophobicContact CG2-CD1 4.13Å; T121-L125 HydrophobicContact CG2-CG 4.45Å; T121-L125 WeakPolarHBondContact O-CB 3.42Å; T121-L125 VanDerWaalsContact O-CG 3.31Å; T121-L125 WeakPolarHBondContact O-CG 3.46Å; T121-L125 PolarHBondContact O-N 2.93Å; I122-L125 PolarHBondContact O-N 3.44Å; L125-M128 PolarHBondContact O-N 3.36Å; L125-N129 VanDerWaalsContact O-CB 3.32Å; L125-N129 WeakPolarHBondContact O-CB 3.39Å; L125-N129 PolarHBondContact O-N 3.08Å |
| 126 | T | 95.8 | Very high | 95.1 | Very high | 87 Ų | 87 | 104.5 Ų | 104.5 | 53% | 0.534 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -65.4 | -45.6 | 177.5 | -51 | 0 | 0 | 0 | 0 | 110.5 | I122 E123 F124 N129 S130 | I122-T126 WeakPolarHBondContact O-CB 3.31Å; I122-T126 PolarHBondContact O-N 3.38Å; I122-T126 PolarHBondContact O-OG1 3.34Å; E123-T126 PolarHBondContact O-N 3.29Å; F124-T126 VanDerWaalsContact C-N 3.28Å; F124-T126 PolarHBondContact O-N 2.59Å; T126-N129 PolarHBondContact O-N 2.86Å; T126-S130 PolarHBondContact O-N 3.02Å |
| 127 | K | 95.9 | Very high | 95.3 | Very high | 137 Ų | 137 | 106.9 Ų | 106.9 | 60% | 0.596 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -61 | -47.5 | 175.1 | -172 | 177 | -179.9 | 179.4 | 0 | 111.2 | E123 F124 N129 S130 E131 | E123-K127 PolarHBondContact O-N 2.94Å; F124-K127 PolarHBondContact O-N 3.47Å; K127-N129 PolarHBondContact O-N 3.43Å; K127-S130 WeakPolarHBondContact O-CB 3.41Å; K127-S130 PolarHBondContact O-N 3.45Å; K127-S130 VanDerWaalsContact O-N 3.12Å; K127-S130 PolarHBondContact O-OG 2.96Å; K127-E131 PolarHBondContact O-N 3.44Å; K127-E131 VanDerWaalsContact O-N 3.08Å |
| 128 | M | 96.5 | Very high | 95.5 | Very high | 66 Ų | 66 | 111.2 Ų | 111.2 | 33% | 0.325 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -65.5 | -38.2 | -178.9 | -150.8 | -165.5 | 55.2 | 0 | 0 | 112.3 | F124 L125 E131 K132 | F124-M128 HydrophobicContact CE1-SD 4.29Å; F124-M128 HydrophobicContact CZ-SD 4.4Å; F124-M128 WeakPolarHBondContact O-CB 3.45Å; F124-M128 PolarHBondContact O-N 3.44Å; L125-M128 PolarHBondContact O-N 3.36Å; M128-E131 PolarHBondContact O-N 3.42Å; M128-K132 PolarHBondContact O-N 3.02Å |
| 129 | N | 94.5 | Very high | 95.6 | Very high | 85 Ų | 85 | 110.4 Ų | 110.4 | 46% | 0.455 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -64 | -39 | 171.9 | -94 | -26.7 | 0 | 0 | 0 | 112.2 | L125 T126 K127 E131 K132 R133 | L125-N129 VanDerWaalsContact O-CB 3.32Å; L125-N129 WeakPolarHBondContact O-CB 3.39Å; L125-N129 PolarHBondContact O-N 3.08Å; T126-N129 PolarHBondContact O-N 2.86Å; K127-N129 PolarHBondContact O-N 3.43Å; N129-E131 VanDerWaalsContact C-N 3.31Å; N129-E131 PolarHBondContact O-N 3.37Å; N129-K132 PolarHBondContact O-N 2.87Å; N129-R133 WeakPolarHBondContact O-CB 3.45Å; N129-R133 WeakPolarHBondContact O-CG 3.33Å; N129-R133 PolarHBondContact O-N 3.14Å |
| 130 | S | 95.8 | Very high | 95.8 | Very high | 50 Ų | 50 | 112.4 Ų | 112.4 | 35% | 0.35 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -61.8 | -40 | 176.3 | 85.4 | 0 | 0 | 0 | 0 | 111.8 | T126 K127 R133 K134 | T126-S130 PolarHBondContact O-N 3.02Å; K127-S130 WeakPolarHBondContact O-CB 3.41Å; K127-S130 PolarHBondContact O-N 3.45Å; K127-S130 VanDerWaalsContact O-N 3.12Å; K127-S130 PolarHBondContact O-OG 2.96Å; S130-R133 PolarHBondContact O-N 2.66Å; S130-K134 WeakPolarHBondContact O-CG 3.47Å; S130-K134 PolarHBondContact O-N 3.12Å |
| 131 | E | 96.4 | Very high | 95.9 | Very high | 94 Ų | 94 | 110.3 Ų | 110.3 | 44% | 0.439 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -68.8 | -42.9 | 176.9 | -71.4 | -178 | -177.9 | 0 | 0 | 112.1 | K127 M128 N129 R133 K134 K135 | K127-E131 PolarHBondContact O-N 3.44Å; K127-E131 VanDerWaalsContact O-N 3.08Å; M128-E131 PolarHBondContact O-N 3.42Å; N129-E131 VanDerWaalsContact C-N 3.31Å; N129-E131 PolarHBondContact O-N 3.37Å; E131-R133 VanDerWaalsContact C-N 3.34Å; E131-R133 PolarHBondContact O-N 3.37Å; E131-K134 PolarHBondContact O-N 3.26Å; E131-K135 PolarHBondContact O-N 3.48Å |
| 132 | K | 95.8 | Very high | 96 | Very high | 125 Ų | 125 | 109.7 Ų | 109.7 | 54% | 0.543 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -60.9 | -42 | 174.3 | -76.4 | -173.3 | 177.7 | -178 | 0 | 111.6 | M128 N129 K135 L136 | M128-K132 PolarHBondContact O-N 3.02Å; N129-K132 PolarHBondContact O-N 2.87Å; K132-K135 PolarHBondContact O-N 2.91Å; K132-L136 WeakPolarHBondContact O-CB 3.32Å; K132-L136 PolarHBondContact O-N 2.9Å |
| 133 | R | 95.9 | Very high | 96 | Very high | 186 Ų | 186 | 111.3 Ų | 111.3 | 70% | 0.702 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -61.2 | -43.8 | 174.6 | -74.6 | 178.7 | -176.7 | -175.6 | 2.1 | 111.9 | N129 S130 E131 L136 Q137 | N129-R133 WeakPolarHBondContact O-CB 3.45Å; N129-R133 WeakPolarHBondContact O-CG 3.33Å; N129-R133 PolarHBondContact O-N 3.14Å; S130-R133 PolarHBondContact O-N 2.66Å; E131-R133 VanDerWaalsContact C-N 3.34Å; E131-R133 PolarHBondContact O-N 3.37Å; R133-L136 PolarHBondContact O-N 3.3Å; R133-Q137 PolarHBondContact O-N 2.92Å |
| 134 | K | 96.5 | Very high | 96 | Very high | 124 Ų | 124 | 109.2 Ų | 109.2 | 54% | 0.539 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -61.2 | -44 | 174.8 | -73.8 | 175.1 | -177.6 | 176.9 | 0 | 112 | S130 E131 Q137 R138 | S130-K134 WeakPolarHBondContact O-CG 3.47Å; S130-K134 PolarHBondContact O-N 3.12Å; E131-K134 PolarHBondContact O-N 3.26Å; K134-Q137 PolarHBondContact O-N 2.95Å; K134-R138 WeakPolarHBondContact O-CG 3.35Å; K134-R138 PolarHBondContact O-N 3.35Å; K134-R138 VanDerWaalsContact O-N 3.14Å |
| 135 | K | 96.7 | Very high | 96.1 | Very high | 136 Ų | 136 | 111.3 Ų | 111.3 | 59% | 0.591 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -62 | -46.2 | 175.8 | -75.1 | -178.6 | -180 | 178.3 | 0 | 111.5 | E131 K132 Q137 R138 V139 | E131-K135 PolarHBondContact O-N 3.48Å; K132-K135 PolarHBondContact O-N 2.91Å; K135-Q137 VanDerWaalsContact C-N 3.3Å; K135-Q137 PolarHBondContact O-N 2.91Å; K135-R138 PolarHBondContact O-N 3.42Å; K135-V139 WeakPolarHBondContact O-CG2 3.5Å; K135-V139 PolarHBondContact O-N 3.47Å |
| 136 | L | 95.3 | Very high | 96.1 | Very high | 84 Ų | 84 | 111.4 Ų | 111.4 | 44% | 0.44 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -58.9 | -41.7 | 176.9 | -176.9 | 66.4 | 0 | 0 | 0 | 111.8 | K132 R133 R138 V139 R140 | K132-L136 WeakPolarHBondContact O-CB 3.32Å; K132-L136 PolarHBondContact O-N 2.9Å; R133-L136 PolarHBondContact O-N 3.3Å; L136-R138 PolarHBondContact O-N 2.91Å; L136-V139 PolarHBondContact O-N 3.17Å; L136-R140 WeakPolarHBondContact O-CG 3.44Å; L136-R140 PolarHBondContact O-N 2.97Å |
| 137 | Q | 96.4 | Very high | 96.1 | Very high | 117 Ų | 117 | 112.7 Ų | 112.7 | 55% | 0.547 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -63.4 | -39.6 | 177.4 | -168.4 | 174.8 | 4.6 | 0 | 0 | 112.3 | R133 K134 K135 R140 Q141 | R133-Q137 PolarHBondContact O-N 2.92Å; K134-Q137 PolarHBondContact O-N 2.95Å; K135-Q137 VanDerWaalsContact C-N 3.3Å; K135-Q137 PolarHBondContact O-N 2.91Å; Q137-R140 PolarHBondContact O-N 3.38Å; Q137-Q141 WeakPolarHBondContact O-CG 3.4Å; Q137-Q141 PolarHBondContact O-N 3.32Å |
| 138 | R | 97.1 | Very high | 96.1 | Very high | 165 Ų | 165 | 109.5 Ų | 109.5 | 62% | 0.623 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -64.3 | -42.8 | 174.3 | -66.2 | 180 | -151.5 | 170.9 | 3.4 | 112.1 | K134 K135 L136 Q141 A142 | K134-R138 WeakPolarHBondContact O-CG 3.35Å; K134-R138 PolarHBondContact O-N 3.35Å; K134-R138 VanDerWaalsContact O-N 3.14Å; K135-R138 PolarHBondContact O-N 3.42Å; L136-R138 PolarHBondContact O-N 2.91Å; R138-Q141 PolarHBondContact O-N 3.3Å; R138-A142 WeakPolarHBondContact O-CB 3.47Å; R138-A142 PolarHBondContact O-N 3.03Å |
| 139 | V | 96.2 | Very high | 96.1 | Very high | 90 Ų | 90 | 109.2 Ų | 109.2 | 55% | 0.545 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -62.8 | -43.9 | 176.7 | 174 | 0 | 0 | 0 | 0 | 110.6 | K135 L136 Q141 A142 M143 | K135-V139 WeakPolarHBondContact O-CG2 3.5Å; K135-V139 PolarHBondContact O-N 3.47Å; L136-V139 PolarHBondContact O-N 3.17Å; V139-Q141 PolarHBondContact O-N 2.95Å; V139-A142 PolarHBondContact O-N 3.27Å; V139-M143 WeakPolarHBondContact O-CB 3.46Å; V139-M143 PolarHBondContact O-N 3.42Å |
| 140 | R | 96.6 | Very high | 96.2 | Very high | 161 Ų | 161 | 107.9 Ų | 107.9 | 61% | 0.608 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -59.1 | -45.8 | 174.8 | -74.5 | 177.5 | 178.2 | 173 | -2.2 | 111.8 | L136 Q137 A142 M143 T144 | L136-R140 WeakPolarHBondContact O-CG 3.44Å; L136-R140 PolarHBondContact O-N 2.97Å; Q137-R140 PolarHBondContact O-N 3.38Å; R140-A142 VanDerWaalsContact C-N 3.34Å; R140-A142 PolarHBondContact O-N 3.05Å; R140-M143 WeakPolarHBondContact O-CB 3.49Å; R140-M143 PolarHBondContact O-N 2.93Å; R140-T144 PolarHBondContact O-N 3.24Å; R140-T144 PolarHBondContact O-OG1 3.46Å |
| 141 | Q | 97 | Very high | 96.1 | Very high | 93 Ų | 93 | 109.5 Ų | 109.5 | 44% | 0.435 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -61.4 | -40.6 | 175.7 | -74 | 174.8 | -6.8 | 0 | 0 | 112.5 | Q137 R138 V139 T144 R145 | Q137-Q141 WeakPolarHBondContact O-CG 3.4Å; Q137-Q141 PolarHBondContact O-N 3.32Å; R138-Q141 PolarHBondContact O-N 3.3Å; V139-Q141 PolarHBondContact O-N 2.95Å; Q141-T144 PolarHBondContact O-N 2.86Å; Q141-R145 WeakPolarHBondContact O-CG 3.45Å; Q141-R145 PolarHBondContact O-N 2.98Å |
| 142 | A | 96.4 | Very high | 96.1 | Very high | 56 Ų | 56 | 110.5 Ų | 110.5 | 46% | 0.463 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -64.6 | -41.6 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | R138 V139 R140 R145 C146 | R138-A142 WeakPolarHBondContact O-CB 3.47Å; R138-A142 PolarHBondContact O-N 3.03Å; V139-A142 PolarHBondContact O-N 3.27Å; R140-A142 VanDerWaalsContact C-N 3.34Å; R140-A142 PolarHBondContact O-N 3.05Å; A142-R145 PolarHBondContact O-N 2.93Å; A142-C146 WeakPolarHBondContact O-CB 3.38Å; A142-C146 PolarHBondContact O-N 3.47Å |
| 143 | M | 94.6 | Very high | 96.1 | Very high | 135 Ų | 135 | 109.8 Ų | 109.8 | 67% | 0.665 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -62.1 | -43.1 | 175.6 | -173.3 | 176.9 | -88.1 | 0 | 0 | 111.3 | V139 R140 R145 C146 H147 | V139-M143 WeakPolarHBondContact O-CB 3.46Å; V139-M143 PolarHBondContact O-N 3.42Å; R140-M143 WeakPolarHBondContact O-CB 3.49Å; R140-M143 PolarHBondContact O-N 2.93Å; M143-R145 PolarHBondContact O-N 3.29Å; M143-C146 PolarHBondContact O-N 2.8Å; M143-H147 WeakPolarHBondContact O-CB 3.48Å; M143-H147 PolarHBondContact O-N 3.42Å |
| 144 | T | 96.1 | Very high | 96.1 | Very high | 89 Ų | 89 | 105.1 Ų | 105.1 | 55% | 0.546 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -60.8 | -44.5 | 174.5 | -45.9 | 0 | 0 | 0 | 0 | 111.7 | R140 Q141 C146 H147 T148 | R140-T144 PolarHBondContact O-N 3.24Å; R140-T144 PolarHBondContact O-OG1 3.46Å; Q141-T144 PolarHBondContact O-N 2.86Å; T144-C146 PolarHBondContact O-N 2.91Å; T144-H147 PolarHBondContact O-N 3.44Å; T144-T148 PolarHBondContact O-N 3.2Å; T144-T148 PolarHBondContact O-OG1 3.45Å |
| 145 | R | 96.7 | Very high | 96 | Very high | 173 Ų | 173 | 106 Ų | 106 | 65% | 0.653 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -62.9 | -42 | 177 | -70.2 | 175.7 | -168.7 | 175.6 | 2.9 | 112.5 | Q141 A142 M143 H147 T148 S149 | Q141-R145 WeakPolarHBondContact O-CG 3.45Å; Q141-R145 PolarHBondContact O-N 2.98Å; A142-R145 PolarHBondContact O-N 2.93Å; M143-R145 PolarHBondContact O-N 3.29Å; R145-H147 VanDerWaalsContact C-N 3.35Å; R145-T148 PolarHBondContact O-N 3.49Å; R145-S149 WeakPolarHBondContact O-CB 3.44Å; R145-S149 PolarHBondContact O-N 3.4Å; R145-S149 PolarHBondContact O-OG 3.04Å |
| 146 | C | 95.7 | Very high | 95.9 | Very high | 87 Ų | 87 | 105 Ų | 105 | 59% | 0.588 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -61.2 | -46.3 | 175.8 | -172.5 | 0 | 0 | 0 | 0 | 110.5 | A142 M143 T144 T148 S149 S150 | A142-C146 WeakPolarHBondContact O-CB 3.38Å; A142-C146 PolarHBondContact O-N 3.47Å; M143-C146 PolarHBondContact O-N 2.8Å; T144-C146 PolarHBondContact O-N 2.91Å; C146-T148 PolarHBondContact O-N 3.19Å; C146-S149 PolarHBondContact O-N 2.9Å; C146-S150 WeakPolarHBondContact O-CB 3.47Å; C146-S150 PolarHBondContact O-N 2.95Å |
| 147 | H | 95.8 | Very high | 95.9 | Very high | 113 Ų | 113 | 106.8 Ų | 106.8 | 52% | 0.523 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -59.8 | -45.7 | 176.5 | -172.1 | 77.3 | 0 | 0 | 0 | 112.1 | M143 T144 R145 S149 S150 Q151 | M143-H147 WeakPolarHBondContact O-CB 3.48Å; M143-H147 PolarHBondContact O-N 3.42Å; T144-H147 PolarHBondContact O-N 3.44Å; R145-H147 VanDerWaalsContact C-N 3.35Å; H147-S149 VanDerWaalsContact C-N 3.33Å; H147-S149 PolarHBondContact O-N 3.33Å; H147-S150 PolarHBondContact O-N 3.08Å; H147-Q151 WeakPolarHBondContact O-CG 3.49Å; H147-Q151 PolarHBondContact O-N 3.48Å |
| 148 | T | 96.6 | Very high | 95.7 | Very high | 70 Ų | 70 | 103.4 Ų | 103.4 | 43% | 0.429 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -60.8 | -41.3 | 175.4 | -50.4 | 0 | 0 | 0 | 0 | 112.3 | T144 R145 C146 Q151 Q152 | T144-T148 PolarHBondContact O-N 3.2Å; T144-T148 PolarHBondContact O-OG1 3.45Å; R145-T148 PolarHBondContact O-N 3.49Å; C146-T148 PolarHBondContact O-N 3.19Å; T148-Q151 PolarHBondContact O-N 2.88Å; T148-Q152 WeakPolarHBondContact O-CG 3.5Å; T148-Q152 PolarHBondContact O-N 2.95Å |
| 149 | S | 96.2 | Very high | 95.5 | Very high | 60 Ų | 60 | 99.4 Ų | 99.4 | 42% | 0.42 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -66.1 | -40.8 | 178.4 | -53.7 | 0 | 0 | 0 | 0 | 111.4 | R145 C146 H147 Q152 L153 | R145-S149 WeakPolarHBondContact O-CB 3.44Å; R145-S149 PolarHBondContact O-N 3.4Å; R145-S149 PolarHBondContact O-OG 3.04Å; C146-S149 PolarHBondContact O-N 2.9Å; H147-S149 VanDerWaalsContact C-N 3.33Å; H147-S149 PolarHBondContact O-N 3.33Å; S149-Q152 WeakPolarHBondContact O-CB 3.42Å; S149-Q152 PolarHBondContact O-N 3.25Å; S149-L153 WeakPolarHBondContact O-CG 3.48Å; S149-L153 PolarHBondContact O-N 3.39Å |
| 150 | S | 95.8 | Very high | 95.3 | Very high | 57 Ų | 57 | 99.8 Ų | 99.8 | 40% | 0.399 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -60.2 | -45.8 | 174.3 | -178 | 0 | 0 | 0 | 0 | 111.8 | C146 H147 Q152 L153 L154 | C146-S150 WeakPolarHBondContact O-CB 3.47Å; C146-S150 PolarHBondContact O-N 2.95Å; H147-S150 PolarHBondContact O-N 3.08Å; S150-Q152 VanDerWaalsContact C-N 3.3Å; S150-Q152 PolarHBondContact O-N 3.05Å; S150-L153 PolarHBondContact O-N 3.18Å; S150-L154 WeakPolarHBondContact O-CG 3.44Å; S150-L154 PolarHBondContact O-N 3.35Å |
| 151 | Q | 95.1 | Very high | 95.1 | Very high | 84 Ų | 84 | 96 Ų | 96 | 39% | 0.393 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -61.8 | -35.9 | 175.5 | -69.2 | -67.5 | -12.7 | 0 | 0 | 112.8 | H147 T148 K155 | H147-Q151 WeakPolarHBondContact O-CG 3.49Å; H147-Q151 PolarHBondContact O-N 3.48Å; T148-Q151 PolarHBondContact O-N 2.88Å; Q151-K155 WeakPolarHBondContact O-CG 3.36Å; Q151-K155 PolarHBondContact O-N 3Å; Q151-K155 VanDerWaalsContact O-N 3.12Å |
| 152 | Q | 96.5 | Very high | 94.9 | Very high | 116 Ų | 116 | 98.5 Ų | 98.5 | 54% | 0.542 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -67 | -42.2 | 174.3 | -73.4 | 177 | -9.6 | 0 | 0 | 112.1 | T148 S149 S150 K155 Q156 | T148-Q152 WeakPolarHBondContact O-CG 3.5Å; T148-Q152 PolarHBondContact O-N 2.95Å; S149-Q152 WeakPolarHBondContact O-CB 3.42Å; S149-Q152 PolarHBondContact O-N 3.25Å; S150-Q152 VanDerWaalsContact C-N 3.3Å; S150-Q152 PolarHBondContact O-N 3.05Å; Q152-K155 PolarHBondContact O-N 3.35Å; Q152-Q156 WeakPolarHBondContact O-CG 3.41Å; Q152-Q156 PolarHBondContact O-N 3.22Å |
| 153 | L | 96 | Very high | 94.7 | Very high | 110 Ų | 110 | 101.4 Ų | 101.4 | 58% | 0.576 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -61.5 | -42.9 | 175.3 | -73.8 | 170.6 | 0 | 0 | 0 | 111.6 | S149 S150 K155 Q156 Q157 | S149-L153 WeakPolarHBondContact O-CG 3.48Å; S149-L153 PolarHBondContact O-N 3.39Å; S150-L153 PolarHBondContact O-N 3.18Å; L153-K155 VanDerWaalsContact C-N 3.33Å; L153-K155 PolarHBondContact O-N 2.96Å; L153-Q156 PolarHBondContact O-N 3.01Å; L153-Q157 WeakPolarHBondContact O-CB 3.44Å; L153-Q157 PolarHBondContact O-N 3.12Å |
| 154 | L | 94.4 | Very high | 94.5 | Very high | 87 Ų | 87 | 101.2 Ų | 101.2 | 46% | 0.455 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -59.9 | -41.7 | 175.1 | -72 | 172 | 0 | 0 | 0 | 112 | S150 Q157 A158 | S150-L154 WeakPolarHBondContact O-CG 3.44Å; S150-L154 PolarHBondContact O-N 3.35Å; L154-Q157 PolarHBondContact O-N 2.98Å; L154-A158 PolarHBondContact O-N 2.98Å |
| 155 | K | 95 | Very high | 94.3 | Very high | 143 Ų | 143 | 101.1 Ų | 101.1 | 62% | 0.622 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -63.8 | -41.6 | 174.5 | -72.9 | 177.3 | -178.4 | -176.6 | 0 | 112.3 | Q151 Q152 L153 A158 N159 | Q151-K155 WeakPolarHBondContact O-CG 3.36Å; Q151-K155 PolarHBondContact O-N 3Å; Q151-K155 VanDerWaalsContact O-N 3.12Å; Q152-K155 PolarHBondContact O-N 3.35Å; L153-K155 VanDerWaalsContact C-N 3.33Å; L153-K155 PolarHBondContact O-N 2.96Å; K155-A158 PolarHBondContact O-N 3.3Å; K155-N159 PolarHBondContact O-N 3.09Å; K155-N159 PolarHBondContact O-ND2 2.93Å |
| 156 | Q | 95 | Very high | 94.1 | Very high | 115 Ų | 115 | 95.7 Ų | 95.7 | 54% | 0.537 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -65.3 | -41.8 | 176.3 | -73.4 | -179.5 | -9.3 | 0 | 0 | 111.9 | Q152 L153 A158 N159 L160 | Q152-Q156 WeakPolarHBondContact O-CG 3.41Å; Q152-Q156 PolarHBondContact O-N 3.22Å; L153-Q156 PolarHBondContact O-N 3.01Å; Q156-A158 VanDerWaalsContact C-N 3.34Å; Q156-A158 PolarHBondContact O-N 3.13Å; Q156-N159 WeakPolarHBondContact O-CB 3.45Å; Q156-N159 PolarHBondContact O-N 3.39Å; Q156-N159 VanDerWaalsContact O-N 3.16Å; Q156-L160 PolarHBondContact O-N 3.15Å |
| 157 | Q | 93.8 | Very high | 93.9 | Very high | 122 Ų | 122 | 94.9 Ų | 94.9 | 57% | 0.57 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -59.1 | -45.3 | 174.4 | -173.4 | -178.7 | 6.5 | 0 | 0 | 111 | L153 L154 N159 L160 V161 | L153-Q157 WeakPolarHBondContact O-CB 3.44Å; L153-Q157 PolarHBondContact O-N 3.12Å; L154-Q157 PolarHBondContact O-N 2.98Å; Q157-N159 VanDerWaalsContact C-N 3.31Å; Q157-N159 PolarHBondContact O-N 3.03Å; Q157-L160 WeakPolarHBondContact O-CB 3.42Å; Q157-L160 PolarHBondContact O-N 3.2Å; Q157-V161 WeakPolarHBondContact O-CG2 3.37Å; Q157-V161 PolarHBondContact O-N 3.4Å |
| 158 | A | 92.2 | Very high | 93.5 | Very high | 45 Ų | 45 | 92.4 Ų | 92.4 | 37% | 0.372 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -62.9 | -35.7 | 176 | 0 | 0 | 0 | 0 | 0 | 113 | L154 K155 Q156 R162 | L154-A158 PolarHBondContact O-N 2.98Å; K155-A158 PolarHBondContact O-N 3.3Å; Q156-A158 VanDerWaalsContact C-N 3.34Å; Q156-A158 PolarHBondContact O-N 3.13Å; A158-R162 PolarHBondContact O-N 3.49Å; A158-R162 VanDerWaalsContact O-N 3.14Å; A158-R162 PolarHBondContact O-NE 3.18Å |
| 159 | N | 93.5 | Very high | 93.2 | Very high | 82 Ų | 82 | 94.6 Ų | 94.6 | 44% | 0.439 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -66 | -43.8 | 173.2 | -72.9 | -24.8 | 0 | 0 | 0 | 111.6 | K155 Q156 Q157 R162 H163 | K155-N159 PolarHBondContact O-N 3.09Å; K155-N159 PolarHBondContact O-ND2 2.93Å; Q156-N159 WeakPolarHBondContact O-CB 3.45Å; Q156-N159 PolarHBondContact O-N 3.39Å; Q156-N159 VanDerWaalsContact O-N 3.16Å; Q157-N159 VanDerWaalsContact C-N 3.31Å; Q157-N159 PolarHBondContact O-N 3.03Å; N159-R162 PolarHBondContact O-N 3.41Å; N159-R162 PolarHBondContact OD1-NH1 3.09Å; N159-R162 PolarHBondContact OD1-NH2 3.41Å; N159-H163 PolarHBondContact O-N 3.12Å |
| 160 | L | 92.2 | Very high | 92.9 | Very high | 98 Ų | 98 | 99.8 Ų | 99.8 | 51% | 0.513 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -60.6 | -46.9 | 177 | -102.2 | 152.7 | 0 | 0 | 0 | 111.6 | Q156 Q157 R162 H163 F164 | Q156-L160 PolarHBondContact O-N 3.15Å; Q157-L160 WeakPolarHBondContact O-CB 3.42Å; Q157-L160 PolarHBondContact O-N 3.2Å; L160-R162 VanDerWaalsContact C-N 3.33Å; L160-R162 PolarHBondContact O-N 2.83Å; L160-H163 WeakPolarHBondContact O-CB 3.47Å; L160-H163 PolarHBondContact O-N 3.27Å; L160-H163 VanDerWaalsContact O-N 3.13Å; L160-F164 HydrophobicContact CD2-CD2 4.35Å; L160-F164 HydrophobicContact CD2-CE2 3.73Å; L160-F164 HydrophobicContact CD2-CZ 4.49Å; L160-F164 WeakPolarHBondContact O-CD2 3.46Å; L160-F164 PolarHBondContact O-N 3.46Å |
| 161 | V | 92.8 | Very high | 92.6 | Very high | 81 Ų | 81 | 104.1 Ų | 104.1 | 49% | 0.491 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -59 | -44.7 | 176.4 | 172.6 | 0 | 0 | 0 | 0 | 111 | Q157 H163 F164 I165 | Q157-V161 WeakPolarHBondContact O-CG2 3.37Å; Q157-V161 PolarHBondContact O-N 3.4Å; V161-H163 VanDerWaalsContact C-N 3.34Å; V161-H163 PolarHBondContact O-N 3.45Å; V161-F164 PolarHBondContact O-N 3.22Å; V161-I165 HydrophobicContact CG1-CD1 4.12Å; V161-I165 WeakPolarHBondContact O-CG1 3.21Å; V161-I165 PolarHBondContact O-N 3.21Å |
| 162 | R | 92.5 | Very high | 92 | Very high | 146 Ų | 146 | 108 Ų | 108 | 55% | 0.551 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -59.9 | -43 | 174.6 | -84.4 | -177.6 | -84.7 | 134.9 | -5 | 112.2 | A158 N159 L160 I165 T166 | A158-R162 PolarHBondContact O-N 3.49Å; A158-R162 VanDerWaalsContact O-N 3.14Å; A158-R162 PolarHBondContact O-NE 3.18Å; N159-R162 PolarHBondContact O-N 3.41Å; N159-R162 PolarHBondContact OD1-NH1 3.09Å; N159-R162 PolarHBondContact OD1-NH2 3.41Å; L160-R162 VanDerWaalsContact C-N 3.33Å; L160-R162 PolarHBondContact O-N 2.83Å; R162-I165 PolarHBondContact O-N 3Å; R162-T166 PolarHBondContact O-N 2.91Å; R162-T166 VanDerWaalsContact O-N 3.07Å; R162-T166 PolarHBondContact O-OG1 3.16Å |
| 163 | H | 92.3 | Very high | 91.7 | Very high | 116 Ų | 116 | 108 Ų | 108 | 54% | 0.537 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -62 | -44.8 | 177.2 | -172.6 | 73.9 | 0 | 0 | 0 | 112.2 | N159 L160 V161 I165 T166 V167 | N159-H163 PolarHBondContact O-N 3.12Å; L160-H163 WeakPolarHBondContact O-CB 3.47Å; L160-H163 PolarHBondContact O-N 3.27Å; L160-H163 VanDerWaalsContact O-N 3.13Å; V161-H163 VanDerWaalsContact C-N 3.34Å; V161-H163 PolarHBondContact O-N 3.45Å; H163-I165 VanDerWaalsContact C-N 3.31Å; H163-I165 PolarHBondContact O-N 3.22Å; H163-T166 WeakPolarHBondContact O-CB 3.44Å; H163-T166 PolarHBondContact O-N 3.31Å; H163-T166 VanDerWaalsContact O-N 3.12Å; H163-V167 WeakPolarHBondContact O-CG2 3.36Å; H163-V167 PolarHBondContact O-N 3.14Å |
| 164 | F | 90.6 | Very high | 91.2 | Very high | 131 Ų | 131 | 108.4 Ų | 108.4 | 58% | 0.575 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -59.7 | -40 | 175.8 | -82.3 | -65.2 | 0 | 0 | 0 | 112.6 | L160 V161 T166 V167 A168 | L160-F164 HydrophobicContact CD2-CD2 4.35Å; L160-F164 HydrophobicContact CD2-CE2 3.73Å; L160-F164 HydrophobicContact CD2-CZ 4.49Å; L160-F164 WeakPolarHBondContact O-CD2 3.46Å; L160-F164 PolarHBondContact O-N 3.46Å; V161-F164 PolarHBondContact O-N 3.22Å; F164-T166 VanDerWaalsContact C-N 3.35Å; F164-T166 PolarHBondContact O-N 2.93Å; F164-V167 PolarHBondContact O-N 3.39Å; F164-A168 WeakPolarHBondContact O-CB 3.43Å; F164-A168 PolarHBondContact O-N 3.09Å |
| 165 | I | 90.8 | Very high | 90.5 | Very high | 88 Ų | 88 | 107.3 Ų | 107.3 | 45% | 0.451 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -61.2 | -44.6 | 174.7 | -67.3 | 165.9 | 0 | 0 | 0 | 110.5 | V161 R162 H163 V167 A168 Q169 | V161-I165 HydrophobicContact CG1-CD1 4.12Å; V161-I165 WeakPolarHBondContact O-CG1 3.21Å; V161-I165 PolarHBondContact O-N 3.21Å; R162-I165 PolarHBondContact O-N 3Å; H163-I165 VanDerWaalsContact C-N 3.31Å; H163-I165 PolarHBondContact O-N 3.22Å; I165-V167 PolarHBondContact O-N 2.66Å; I165-A168 PolarHBondContact O-N 2.92Å; I165-Q169 WeakPolarHBondContact O-CG 3.45Å; I165-Q169 PolarHBondContact O-N 3Å |
| 166 | T | 93.8 | Very high | 89.8 | Confident | 59 Ų | 59 | 102.6 Ų | 102.6 | 36% | 0.362 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62.6 | -42.2 | 176.9 | -54.5 | 0 | 0 | 0 | 0 | 112.3 | R162 H163 F164 Q169 R170 | R162-T166 PolarHBondContact O-N 2.91Å; R162-T166 VanDerWaalsContact O-N 3.07Å; R162-T166 PolarHBondContact O-OG1 3.16Å; H163-T166 WeakPolarHBondContact O-CB 3.44Å; H163-T166 PolarHBondContact O-N 3.31Å; H163-T166 VanDerWaalsContact O-N 3.12Å; F164-T166 VanDerWaalsContact C-N 3.35Å; F164-T166 PolarHBondContact O-N 2.93Å; T166-Q169 PolarHBondContact O-N 3.4Å; T166-R170 WeakPolarHBondContact O-CG 3.45Å; T166-R170 PolarHBondContact O-N 3.14Å |
| 167 | V | 90.6 | Very high | 89.2 | Confident | 70 Ų | 70 | 101.3 Ų | 101.3 | 42% | 0.424 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.7 | -44.1 | 176.4 | 172.5 | 0 | 0 | 0 | 0 | 110.9 | H163 F164 I165 Q169 R170 K171 | H163-V167 WeakPolarHBondContact O-CG2 3.36Å; H163-V167 PolarHBondContact O-N 3.14Å; F164-V167 PolarHBondContact O-N 3.39Å; I165-V167 PolarHBondContact O-N 2.66Å; V167-Q169 VanDerWaalsContact C-N 3.33Å; V167-Q169 PolarHBondContact O-N 2.87Å; V167-R170 PolarHBondContact O-N 2.92Å; V167-K171 PolarHBondContact O-N 3.12Å |
| 168 | A | 87.6 | Confident | 88.5 | Confident | 60 Ų | 60 | 99.2 Ų | 99.2 | 50% | 0.496 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -62.1 | -39.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | F164 I165 K171 K172 | F164-A168 WeakPolarHBondContact O-CB 3.43Å; F164-A168 PolarHBondContact O-N 3.09Å; I165-A168 PolarHBondContact O-N 2.92Å; A168-K171 PolarHBondContact O-N 3.07Å; A168-K172 PolarHBondContact O-N 2.94Å |
| 169 | Q | 89.7 | Confident | 87.9 | Confident | 117 Ų | 117 | 99 Ų | 99 | 55% | 0.547 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -64.3 | -45.1 | 174.5 | -73.7 | 173.7 | -11.2 | 0 | 0 | 112 | I165 T166 V167 K171 K172 L173 | I165-Q169 WeakPolarHBondContact O-CG 3.45Å; I165-Q169 PolarHBondContact O-N 3Å; T166-Q169 PolarHBondContact O-N 3.4Å; V167-Q169 VanDerWaalsContact C-N 3.33Å; V167-Q169 PolarHBondContact O-N 2.87Å; Q169-K171 PolarHBondContact O-N 3.49Å; Q169-K172 WeakPolarHBondContact O-CB 3.49Å; Q169-K172 PolarHBondContact O-N 3.09Å; Q169-L173 PolarHBondContact O-N 3.13Å |
| 170 | R | 91.4 | Very high | 87.3 | Confident | 169 Ų | 169 | 98.7 Ų | 98.7 | 64% | 0.638 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -61.1 | -43.2 | 175.7 | -74.6 | -179.7 | 178.1 | -176.9 | -1 | 112.1 | T166 V167 K172 L173 L174 | T166-R170 WeakPolarHBondContact O-CG 3.45Å; T166-R170 PolarHBondContact O-N 3.14Å; V167-R170 PolarHBondContact O-N 2.92Å; R170-K172 VanDerWaalsContact C-N 3.29Å; R170-K172 PolarHBondContact O-N 3.5Å; R170-L173 PolarHBondContact O-N 3.33Å; R170-L174 WeakPolarHBondContact O-CG 3.48Å; R170-L174 PolarHBondContact O-N 3.16Å |
| 171 | K | 87.8 | Confident | 86.7 | Confident | 147 Ų | 147 | 97.2 Ų | 97.2 | 64% | 0.639 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -56.5 | -44.8 | 173.7 | -179.7 | -178.4 | 176.5 | 178.9 | 0 | 111.2 | V167 A168 Q169 L173 L174 V175 | V167-K171 PolarHBondContact O-N 3.12Å; A168-K171 PolarHBondContact O-N 3.07Å; Q169-K171 PolarHBondContact O-N 3.49Å; K171-L173 VanDerWaalsContact C-N 3.34Å; K171-L173 PolarHBondContact O-N 3.44Å; K171-L174 PolarHBondContact O-N 2.93Å; K171-V175 VanDerWaalsContact O-CG2 3.31Å; K171-V175 WeakPolarHBondContact O-CG2 3.44Å; K171-V175 PolarHBondContact O-N 2.98Å |
| 172 | K | 83.5 | Confident | 86 | Confident | 166 Ų | 166 | 94.2 Ų | 94.2 | 72% | 0.722 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -61.9 | -40.7 | 178.8 | -171.1 | -178.9 | 178.5 | -176.2 | 0 | 112.3 | A168 Q169 R170 A176 | A168-K172 PolarHBondContact O-N 2.94Å; Q169-K172 WeakPolarHBondContact O-CB 3.49Å; Q169-K172 PolarHBondContact O-N 3.09Å; R170-K172 VanDerWaalsContact C-N 3.29Å; R170-K172 PolarHBondContact O-N 3.5Å; K172-A176 PolarHBondContact O-N 3.38Å; K172-A176 VanDerWaalsContact O-N 3.14Å |
| 173 | L | 89.9 | Confident | 85.4 | Confident | 116 Ų | 116 | 94 Ų | 94 | 61% | 0.607 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -64.6 | -47.3 | 175.4 | -68.9 | 172 | 0 | 0 | 0 | 111.5 | Q169 R170 K171 V175 A176 D177 | Q169-L173 PolarHBondContact O-N 3.13Å; R170-L173 PolarHBondContact O-N 3.33Å; K171-L173 VanDerWaalsContact C-N 3.34Å; K171-L173 PolarHBondContact O-N 3.44Å; L173-V175 VanDerWaalsContact C-N 3.3Å; L173-V175 PolarHBondContact O-N 3.29Å; L173-A176 WeakPolarHBondContact O-CA 3.35Å; L173-A176 WeakPolarHBondContact O-CB 3.44Å; L173-A176 PolarHBondContact O-N 3.42Å; L173-D177 PolarHBondContact O-N 3.07Å |
| 174 | L | 84.9 | Confident | 84.8 | Confident | 118 Ų | 118 | 94.2 Ų | 94.2 | 62% | 0.618 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -60.8 | -37.7 | 178.2 | -72.3 | 170 | 0 | 0 | 0 | 112.9 | R170 K171 A176 D177 L178 | R170-L174 WeakPolarHBondContact O-CG 3.48Å; R170-L174 PolarHBondContact O-N 3.16Å; K171-L174 PolarHBondContact O-N 2.93Å; L174-A176 VanDerWaalsContact C-N 3.34Å; L174-D177 PolarHBondContact O-N 3.32Å; L174-L178 WeakPolarHBondContact O-CB 3.4Å; L174-L178 PolarHBondContact O-N 3.05Å |
| 175 | V | 80.2 | Confident | 84.3 | Confident | 64 Ų | 64 | 90.6 Ų | 90.6 | 39% | 0.388 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -63.7 | -41.4 | 173.6 | 170.9 | 0 | 0 | 0 | 0 | 110.9 | K171 L173 D177 L178 D179 | K171-V175 VanDerWaalsContact O-CG2 3.31Å; K171-V175 WeakPolarHBondContact O-CG2 3.44Å; K171-V175 PolarHBondContact O-N 2.98Å; L173-V175 VanDerWaalsContact C-N 3.3Å; L173-V175 PolarHBondContact O-N 3.29Å; V175-D177 VanDerWaalsContact C-N 3.34Å; V175-D177 PolarHBondContact O-N 2.88Å; V175-L178 PolarHBondContact O-N 3.22Å; V175-D179 PolarHBondContact O-N 3.39Å |
| 176 | A | 81 | Confident | 83.8 | Confident | 44 Ų | 44 | 88 Ų | 88 | 36% | 0.364 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -66.6 | -34.8 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | K172 L173 L174 D179 I180 | K172-A176 PolarHBondContact O-N 3.38Å; K172-A176 VanDerWaalsContact O-N 3.14Å; L173-A176 WeakPolarHBondContact O-CA 3.35Å; L173-A176 WeakPolarHBondContact O-CB 3.44Å; L173-A176 PolarHBondContact O-N 3.42Å; L174-A176 VanDerWaalsContact C-N 3.34Å; A176-D179 WeakPolarHBondContact O-CB 3.31Å; A176-D179 PolarHBondContact O-N 3.01Å; A176-I180 WeakPolarHBondContact O-CG1 3.39Å; A176-I180 PolarHBondContact O-N 2.9Å |
| 177 | D | 81.5 | Confident | 83.2 | Confident | 89 Ų | 89 | 91.3 Ų | 91.3 | 48% | 0.476 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -68.1 | -42.4 | 174.1 | -67.8 | -23.7 | 0 | 0 | 0 | 111 | L173 L174 V175 D179 I180 V181 | L173-D177 PolarHBondContact O-N 3.07Å; L174-D177 PolarHBondContact O-N 3.32Å; V175-D177 VanDerWaalsContact C-N 3.34Å; V175-D177 PolarHBondContact O-N 2.88Å; D177-D179 VanDerWaalsContact C-N 3.26Å; D177-D179 PolarHBondContact O-N 2.96Å; D177-I180 WeakPolarHBondContact O-CB 3.32Å; D177-I180 PolarHBondContact O-N 2.95Å; D177-V181 PolarHBondContact O-N 3.43Å |
| 178 | L | 80.3 | Confident | 82.8 | Confident | 78 Ų | 78 | 91 Ų | 91 | 41% | 0.408 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -59.4 | -38.3 | 174.3 | -174.2 | 66.8 | 0 | 0 | 0 | 111.6 | L174 V175 I180 V181 N182 | L174-L178 WeakPolarHBondContact O-CB 3.4Å; L174-L178 PolarHBondContact O-N 3.05Å; V175-L178 PolarHBondContact O-N 3.22Å; L178-I180 VanDerWaalsContact C-N 3.31Å; L178-I180 PolarHBondContact O-N 3.28Å; L178-V181 PolarHBondContact O-N 2.97Å; L178-N182 WeakPolarHBondContact O-CB 3.45Å; L178-N182 VanDerWaalsContact O-CG 3.29Å; L178-N182 PolarHBondContact O-N 3.15Å; L178-N182 PolarHBondContact O-ND2 2.85Å |
| 179 | D | 78.4 | Confident | 82.6 | Confident | 41 Ų | 41 | 90.3 Ų | 90.3 | 22% | 0.219 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -61.8 | -35.5 | 173.3 | -86.4 | -36.4 | 0 | 0 | 0 | 113.7 | V175 A176 D177 R183 Y346 | V175-D179 PolarHBondContact O-N 3.39Å; A176-D179 WeakPolarHBondContact O-CB 3.31Å; A176-D179 PolarHBondContact O-N 3.01Å; D177-D179 VanDerWaalsContact C-N 3.26Å; D177-D179 PolarHBondContact O-N 2.96Å; D179-R183 VanDerWaalsContact O-CG 3.32Å; D179-R183 WeakPolarHBondContact O-CG 3.37Å; D179-R183 PolarHBondContact O-N 3.24Å; D179-R183 PolarHBondContact O-NE 2.94Å; D179-R183 VanDerWaalsContact O-NE 3.09Å; D179-Y346 WeakPolarHBondContact OD1-CE1 3.14Å; D179-Y346 PolarHBondContact OD1-OH 3.49Å; D179-Y346 PolarHBondContact OD2-OH 3.47Å |
| 180 | I | 81 | Confident | 82.3 | Confident | 75 Ų | 75 | 85.7 Ų | 85.7 | 39% | 0.385 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -69.9 | -47 | 176.5 | -66.4 | 165.2 | 0 | 0 | 0 | 109.5 | A176 D177 L178 R183 Q184 | A176-I180 WeakPolarHBondContact O-CG1 3.39Å; A176-I180 PolarHBondContact O-N 2.9Å; D177-I180 WeakPolarHBondContact O-CB 3.32Å; D177-I180 PolarHBondContact O-N 2.95Å; L178-I180 VanDerWaalsContact C-N 3.31Å; L178-I180 PolarHBondContact O-N 3.28Å; I180-R183 WeakPolarHBondContact O-CB 3.44Å; I180-R183 PolarHBondContact O-N 3.33Å; I180-Q184 WeakPolarHBondContact O-CG 3.43Å; I180-Q184 PolarHBondContact O-N 3.37Å |
| 181 | V | 79.9 | Confident | 81.9 | Confident | 67 Ų | 67 | 80.7 Ų | 80.7 | 41% | 0.406 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -63 | -44.4 | 179 | 176.7 | 0 | 0 | 0 | 0 | 111.3 | D177 L178 R183 Q184 I185 | D177-V181 PolarHBondContact O-N 3.43Å; L178-V181 PolarHBondContact O-N 2.97Å; V181-R183 VanDerWaalsContact C-N 3.27Å; V181-R183 PolarHBondContact O-N 3.06Å; V181-Q184 WeakPolarHBondContact O-CB 3.45Å; V181-Q184 PolarHBondContact O-N 3.33Å; V181-I185 HydrophobicContact CG1-CD1 3.91Å; V181-I185 HydrophobicContact CG1-CG1 4.34Å; V181-I185 WeakPolarHBondContact O-CG1 3.36Å; V181-I185 PolarHBondContact O-N 2.91Å |
| 182 | N | 78.9 | Confident | 81.8 | Confident | 17 Ų | 17 | 77.2 Ų | 77.2 | 9% | 0.091 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -59.5 | -38.3 | 176.4 | -77.8 | -26 | 0 | 0 | 0 | 112.1 | L178 K186 Y346 | L178-N182 WeakPolarHBondContact O-CB 3.45Å; L178-N182 VanDerWaalsContact O-CG 3.29Å; L178-N182 PolarHBondContact O-N 3.15Å; L178-N182 PolarHBondContact O-ND2 2.85Å; N182-K186 VanDerWaalsContact O-CB 3.3Å; N182-K186 WeakPolarHBondContact O-CB 2.82Å; N182-K186 PolarHBondContact O-N 3.06Å; N182-Y346 WeakPolarHBondContact ND2-CD1 3.44Å |
| 183 | R | 78.9 | Confident | 82 | Confident | 143 Ų | 143 | 69.3 Ų | 69.3 | 54% | 0.54 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -65.3 | -39.2 | 174 | -78.8 | -178.1 | -77.4 | 169.5 | -6.5 | 112.3 | D179 I180 V181 H187 T344 | D179-R183 VanDerWaalsContact O-CG 3.32Å; D179-R183 WeakPolarHBondContact O-CG 3.37Å; D179-R183 PolarHBondContact O-N 3.24Å; D179-R183 PolarHBondContact O-NE 2.94Å; D179-R183 VanDerWaalsContact O-NE 3.09Å; I180-R183 WeakPolarHBondContact O-CB 3.44Å; I180-R183 PolarHBondContact O-N 3.33Å; V181-R183 VanDerWaalsContact C-N 3.27Å; V181-R183 PolarHBondContact O-N 3.06Å; R183-H187 WeakPolarHBondContact O-CB 3.41Å; R183-H187 PolarHBondContact O-N 3.4Å; R183-T344 HydrophobicContact CG-CG2 4.31Å |
| 184 | Q | 81 | Confident | 81.7 | Confident | 119 Ų | 119 | 69 Ų | 69 | 56% | 0.556 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -66.1 | -46.9 | 175.8 | -70.3 | 175.8 | -12.2 | 0 | 0 | 111.9 | I180 V181 K186 H187 V188 | I180-Q184 WeakPolarHBondContact O-CG 3.43Å; I180-Q184 PolarHBondContact O-N 3.37Å; V181-Q184 WeakPolarHBondContact O-CB 3.45Å; V181-Q184 PolarHBondContact O-N 3.33Å; Q184-K186 VanDerWaalsContact C-N 3.3Å; Q184-K186 PolarHBondContact O-N 3.33Å; Q184-H187 WeakPolarHBondContact O-CB 3.44Å; Q184-H187 PolarHBondContact O-N 2.9Å; Q184-V188 WeakPolarHBondContact O-CG2 3.28Å; Q184-V188 PolarHBondContact O-N 3.03Å |
| 185 | I | 79.6 | Confident | 81.7 | Confident | 56 Ų | 56 | 64.5 Ų | 64.5 | 29% | 0.287 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -57.9 | -46.8 | 176.3 | -68.2 | 171 | 0 | 0 | 0 | 110.1 | V181 H187 V188 H189 F347 | V181-I185 HydrophobicContact CG1-CD1 3.91Å; V181-I185 HydrophobicContact CG1-CG1 4.34Å; V181-I185 WeakPolarHBondContact O-CG1 3.36Å; V181-I185 PolarHBondContact O-N 2.91Å; I185-H187 VanDerWaalsContact C-N 3.34Å; I185-H187 PolarHBondContact O-N 3.33Å; I185-V188 PolarHBondContact O-N 3.18Å; I185-H189 PolarHBondContact O-CD2 3.46Å; I185-H189 PolarHBondContact O-N 2.72Å; I185-F347 HydrophobicContact CG2-CE2 4.22Å |
| 186 | K | 80.1 | Confident | 82.2 | Confident | 34 Ų | 34 | 61.5 Ų | 61.5 | 15% | 0.148 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -58.8 | -46 | 176.5 | -179.8 | 177.9 | 173.8 | -179 | 0 | 111.8 | N182 Q184 V188 H189 D190 N340 S343 | N182-K186 VanDerWaalsContact O-CB 3.3Å; N182-K186 WeakPolarHBondContact O-CB 2.82Å; N182-K186 PolarHBondContact O-N 3.06Å; Q184-K186 VanDerWaalsContact C-N 3.3Å; Q184-K186 PolarHBondContact O-N 3.33Å; K186-V188 VanDerWaalsContact C-N 3.32Å; K186-V188 PolarHBondContact O-N 2.97Å; K186-H189 PolarHBondContact O-N 2.94Å; K186-D190 WeakPolarHBondContact O-CB 3.37Å; K186-D190 PolarHBondContact O-N 2.89Å; K186-N340 PolarHBondContact NZ-O 3.02Å; K186-S343 PolarHBondContact NZ-O 3.34Å |
| 187 | H | 81.2 | Confident | 82.6 | Confident | 127 Ų | 127 | 59.6 Ų | 59.6 | 59% | 0.588 | 29% | 0.293 | S | S | * | . | H | α-helix | trans | -59.2 | -44.2 | 177.7 | -176.9 | 55.6 | 0 | 0 | 0 | 111.9 | R183 Q184 I185 D190 T191 | R183-H187 WeakPolarHBondContact O-CB 3.41Å; R183-H187 PolarHBondContact O-N 3.4Å; Q184-H187 WeakPolarHBondContact O-CB 3.44Å; Q184-H187 PolarHBondContact O-N 2.9Å; I185-H187 VanDerWaalsContact C-N 3.34Å; I185-H187 PolarHBondContact O-N 3.33Å; H187-D190 PolarHBondContact O-N 3.46Å; H187-T191 PolarHBondContact O-N 3.33Å; H187-T191 PolarHBondContact O-OG1 3.32Å; H187-T191 VanDerWaalsContact O-OG1 3.1Å |
| 188 | V | 82.3 | Confident | 82.8 | Confident | 65 Ų | 65 | 57.2 Ų | 57.2 | 39% | 0.394 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -62.7 | -44 | 176 | 171 | 0 | 0 | 0 | 0 | 111.5 | Q184 I185 K186 D190 T191 Y192 | Q184-V188 WeakPolarHBondContact O-CG2 3.28Å; Q184-V188 PolarHBondContact O-N 3.03Å; I185-V188 PolarHBondContact O-N 3.18Å; K186-V188 VanDerWaalsContact C-N 3.32Å; K186-V188 PolarHBondContact O-N 2.97Å; V188-D190 VanDerWaalsContact C-N 3.29Å; V188-D190 PolarHBondContact O-N 3.14Å; V188-T191 PolarHBondContact O-N 2.94Å; V188-Y192 HydrophobicContact CG1-CD2 3.83Å; V188-Y192 HydrophobicContact CG1-CE2 3.27Å; V188-Y192 WeakPolarHBondContact O-CD2 3.39Å; V188-Y192 PolarHBondContact O-N 3.09Å |
| 189 | H | 83 | Confident | 83 | Confident | 44 Ų | 44 | 57.1 Ų | 57.1 | 20% | 0.204 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -60.4 | -41.8 | 174.7 | -71.2 | -172.6 | 0 | 0 | 0 | 111.1 | I185 K186 T191 Y192 F193 L254 | I185-H189 PolarHBondContact O-CD2 3.46Å; I185-H189 PolarHBondContact O-N 2.72Å; K186-H189 PolarHBondContact O-N 2.94Å; H189-T191 VanDerWaalsContact C-N 3.35Å; H189-T191 PolarHBondContact O-N 3.41Å; H189-Y192 PolarHBondContact O-N 3.14Å; H189-F193 WeakPolarHBondContact O-CD2 3.39Å; H189-F193 PolarHBondContact O-N 3.31Å; H189-L254 PolarHBondContact CE1-O 3.34Å; H189-L254 PolarHBondContact ND1-O 2.86Å; H189-L254 PolarHBondContact NE2-O 3.11Å |
| 190 | D | 82.9 | Confident | 83.3 | Confident | 20 Ų | 20 | 56.7 Ų | 56.7 | 11% | 0.107 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -62.3 | -43.8 | 179.7 | -66.9 | -14.4 | 0 | 0 | 0 | 111 | K186 H187 V188 Y192 F193 E194 R301 V337 | K186-D190 WeakPolarHBondContact O-CB 3.37Å; K186-D190 PolarHBondContact O-N 2.89Å; H187-D190 PolarHBondContact O-N 3.46Å; V188-D190 VanDerWaalsContact C-N 3.29Å; V188-D190 PolarHBondContact O-N 3.14Å; D190-Y192 PolarHBondContact O-N 3.27Å; D190-F193 PolarHBondContact O-N 2.88Å; D190-E194 WeakPolarHBondContact O-CB 3.3Å; D190-E194 PolarHBondContact O-N 3.23Å; D190-R301 IonicContact OD1-CZ 3.39Å; D190-R301 IonicContact OD1-NE 2.7Å; D190-R301 IonicContact OD1-NH2 3.18Å; D190-R301 PolarHBondContact OD1-NH2 3.32Å; D190-R301 IonicContact OD2-NH2 3.93Å; D190-V337 HydrophobicContact CB-CG1 3.47Å; D190-V337 VanDerWaalsContact CB-CG1 3.47Å; D190-V337 WeakPolarHBondContact O-CG1 3.5Å; D190-V337 WeakPolarHBondContact OD1-CG1 3.42Å |
| 191 | T | 83.9 | Confident | 83.8 | Confident | 64 Ų | 64 | 53.1 Ų | 53.1 | 39% | 0.393 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -60.9 | -42.6 | 172.9 | -52.5 | 0 | 0 | 0 | 0 | 112.3 | H187 V188 H189 F193 E194 E195 | H187-T191 PolarHBondContact O-N 3.33Å; H187-T191 PolarHBondContact O-OG1 3.32Å; H187-T191 VanDerWaalsContact O-OG1 3.1Å; V188-T191 PolarHBondContact O-N 2.94Å; H189-T191 VanDerWaalsContact C-N 3.35Å; H189-T191 PolarHBondContact O-N 3.41Å; T191-F193 VanDerWaalsContact C-N 3.33Å; T191-F193 PolarHBondContact O-N 3.14Å; T191-E194 PolarHBondContact O-N 3.09Å; T191-E195 WeakPolarHBondContact O-CB 3.14Å; T191-E195 PolarHBondContact O-N 3.11Å |
| 192 | Y | 85.9 | Confident | 84.3 | Confident | 75 Ų | 75 | 52.3 Ų | 52.3 | 29% | 0.294 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -65.7 | -35.6 | 176.9 | -69.1 | -34.9 | 0 | 0 | 0 | 112.8 | V188 H189 D190 L196 L254 P470 L471 | V188-Y192 HydrophobicContact CG1-CD2 3.83Å; V188-Y192 HydrophobicContact CG1-CE2 3.27Å; V188-Y192 WeakPolarHBondContact O-CD2 3.39Å; V188-Y192 PolarHBondContact O-N 3.09Å; H189-Y192 PolarHBondContact O-N 3.14Å; D190-Y192 PolarHBondContact O-N 3.27Å; Y192-L196 WeakPolarHBondContact O-CB 3.41Å; Y192-L196 PolarHBondContact O-N 3.05Å; Y192-L254 HydrophobicContact CD2-CD2 3.77Å; Y192-L254 HydrophobicContact CG-CD2 4.19Å; Y192-P470 HydrophobicContact CD1-CB 4.12Å; Y192-P470 HydrophobicContact CD1-CG 3.73Å; Y192-P470 HydrophobicContact CE1-CB 3.5Å; Y192-P470 VanDerWaalsContact CE1-CB 3.5Å; Y192-P470 HydrophobicContact CE1-CG 3.36Å; Y192-L471 VanDerWaalsContact O-CD1 3.26Å; Y192-L471 WeakPolarHBondContact O-CD1 3.24Å |
| 193 | F | 86.9 | Confident | 84.9 | Confident | 0 Ų | 0 | 51.9 Ų | 51.9 | 0% | 0 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -70.9 | -41.1 | 176.1 | -94 | -79.8 | 0 | 0 | 0 | 112.3 | H189 D190 T191 E195 L196 L197 S251 L254 L255 V337 | H189-F193 WeakPolarHBondContact O-CD2 3.39Å; H189-F193 PolarHBondContact O-N 3.31Å; D190-F193 PolarHBondContact O-N 2.88Å; T191-F193 VanDerWaalsContact C-N 3.33Å; T191-F193 PolarHBondContact O-N 3.14Å; F193-E195 VanDerWaalsContact C-N 3.32Å; F193-L196 PolarHBondContact O-N 3.04Å; F193-L197 HydrophobicContact CD1-CD1 3.94Å; F193-L197 HydrophobicContact CE1-CD1 4.43Å; F193-L197 PolarHBondContact O-N 3.05Å; F193-S251 WeakPolarHBondContact CE1-OG 3.47Å; F193-L254 HydrophobicContact CD2-CD1 4.43Å; F193-L254 HydrophobicContact CE2-CB 3.92Å; F193-L254 HydrophobicContact CE2-CD1 4.2Å; F193-L254 HydrophobicContact CZ-CB 4.36Å; F193-L255 HydrophobicContact CD2-CD2 4.38Å; F193-L255 HydrophobicContact CE2-CD1 3.86Å; F193-L255 HydrophobicContact CE2-CD2 3.49Å; F193-L255 VanDerWaalsContact CE2-CD2 3.49Å; F193-L255 HydrophobicContact CE2-CG 3.45Å; F193-L255 VanDerWaalsContact CE2-CG 3.45Å; F193-L255 HydrophobicContact CZ-CD1 3.56Å; F193-L255 HydrophobicContact CZ-CD2 4.09Å; F193-L255 HydrophobicContact CZ-CG 3.54Å; F193-V337 HydrophobicContact CB-CB 4.44Å; F193-V337 HydrophobicContact CB-CG1 3.92Å; F193-V337 HydrophobicContact CB-CG2 4.08Å; F193-V337 HydrophobicContact CG-CG2 4.38Å |
| 194 | E | 84.2 | Confident | 85.4 | Confident | 110 Ų | 110 | 48.6 Ų | 48.6 | 51% | 0.514 | 26% | 0.255 | S | S | . | . | I | π-helix | trans | -60.6 | -43.6 | 173.5 | -172.6 | 176.7 | -177.3 | 0 | 0 | 110.6 | D190 T191 G198 V199 | D190-E194 WeakPolarHBondContact O-CB 3.3Å; D190-E194 PolarHBondContact O-N 3.23Å; T191-E194 PolarHBondContact O-N 3.09Å; E194-G198 WeakPolarHBondContact O-CA 3.36Å; E194-G198 PolarHBondContact O-N 3.44Å; E194-V199 PolarHBondContact O-N 3.23Å |
| 195 | E | 85.5 | Confident | 85.8 | Confident | 22 Ų | 22 | 44.6 Ų | 44.6 | 10% | 0.103 | 24% | 0.237 | C | C | . | . | I | π-helix | trans | -65.7 | -45.9 | 174.2 | -161.9 | -163.6 | 177.7 | 0 | 0 | 111.7 | T191 F193 V199 Y200 G469 P470 L471 | T191-E195 WeakPolarHBondContact O-CB 3.14Å; T191-E195 PolarHBondContact O-N 3.11Å; F193-E195 VanDerWaalsContact C-N 3.32Å; E195-V199 VanDerWaalsContact O-CB 3.29Å; E195-V199 WeakPolarHBondContact O-CB 3.48Å; E195-V199 PolarHBondContact O-N 3.33Å; E195-Y200 HydrophobicContact CG-CD2 4.19Å; E195-Y200 HydrophobicContact CG-CE2 3.63Å; E195-Y200 WeakPolarHBondContact O-CD2 3.29Å; E195-Y200 PolarHBondContact O-N 3.35Å; E195-Y200 WeakPolarHBondContact OE1-CE2 3.37Å; E195-Y200 PolarHBondContact OE1-OH 3.35Å; E195-G469 WeakPolarHBondContact OE1-CA 3.24Å; E195-P470 WeakPolarHBondContact OE2-CD 3.49Å; E195-P470 WeakPolarHBondContact OE2-CG 3.46Å; E195-L471 PolarHBondContact OE1-N 2.82Å; E195-L471 PolarHBondContact OE2-N 3.14Å; E195-L471 VanDerWaalsContact OE2-N 3.16Å |
| 196 | L | 89.8 | Confident | 86.1 | Confident | 1 Ų | 1 | 43.7 Ų | 43.7 | 1% | 0.005 | 24% | 0.236 | C | C | . | . | I | π-helix | trans | -62.5 | -54.3 | -177 | -177.3 | 67.2 | 0 | 0 | 0 | 111.8 | Y192 F193 Y200 F201 V250 L254 L471 | Y192-L196 WeakPolarHBondContact O-CB 3.41Å; Y192-L196 PolarHBondContact O-N 3.05Å; F193-L196 PolarHBondContact O-N 3.04Å; L196-Y200 PolarHBondContact O-N 3.49Å; L196-F201 HydrophobicContact CD1-CD2 3.5Å; L196-F201 HydrophobicContact CD1-CE2 3.72Å; L196-F201 HydrophobicContact CG-CD2 4.18Å; L196-F201 WeakPolarHBondContact O-CA 3.48Å; L196-F201 WeakPolarHBondContact O-CB 3.49Å; L196-F201 PolarHBondContact O-N 3.42Å; L196-V250 HydrophobicContact CD1-CB 4.15Å; L196-V250 HydrophobicContact CD1-CG1 3.89Å; L196-V250 HydrophobicContact CD2-CB 4Å; L196-V250 HydrophobicContact CD2-CG1 3.89Å; L196-L254 HydrophobicContact CD2-CD1 4.31Å; L196-L471 HydrophobicContact CB-CD1 3.67Å; L196-L471 HydrophobicContact CD1-CD1 4.11Å; L196-L471 HydrophobicContact CG-CD1 4.41Å |
| 197 | L | 90.3 | Very high | 86 | Confident | 5 Ų | 5 | 48.6 Ų | 48.6 | 3% | 0.026 | 27% | 0.269 | C | S | . | . | I | π-helix | trans | -98.4 | -22.1 | -170.3 | -63.8 | 177.3 | 0 | 0 | 0 | 113 | F193 F201 V202 A247 L330 L333 | F193-L197 HydrophobicContact CD1-CD1 3.94Å; F193-L197 HydrophobicContact CE1-CD1 4.43Å; F193-L197 PolarHBondContact O-N 3.05Å; L197-F201 HydrophobicContact CD2-CB 4.17Å; L197-F201 CarbonylContact O-C 3.51Å; L197-V202 WeakPolarHBondContact O-CA 3.45Å; L197-A247 HydrophobicContact CD2-CB 4.28Å; L197-L330 HydrophobicContact CD2-CD2 4.3Å; L197-L333 HydrophobicContact CD1-CB 3.55Å |
| 198 | G | 83.9 | Confident | 85.8 | Confident | 39 Ų | 39 | 47.3 Ų | 47.3 | 40% | 0.402 | 27% | 0.266 | S | S | . | . | I | π-helix | trans | -89.9 | -26.6 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | E194 V202 | E194-G198 WeakPolarHBondContact O-CA 3.36Å; E194-G198 PolarHBondContact O-N 3.44Å; G198-V202 WeakPolarHBondContact O-CG2 3.41Å |
| 199 | V | 84.8 | Confident | 85.3 | Confident | 76 Ų | 76 | 49 Ų | 49 | 46% | 0.461 | 28% | 0.281 | S | S | . | . | I | π-helix | trans | -112.4 | -50.8 | -177.8 | -174 | 0 | 0 | 0 | 0 | 112.7 | E194 E195 | E194-V199 PolarHBondContact O-N 3.23Å; E195-V199 VanDerWaalsContact O-CB 3.29Å; E195-V199 WeakPolarHBondContact O-CB 3.48Å; E195-V199 PolarHBondContact O-N 3.33Å |
| 200 | Y | 86.4 | Confident | 85 | Confident | 31 Ų | 31 | 55 Ų | 55 | 12% | 0.122 | 31% | 0.314 | C | S | . | . | I | π-helix | trans | -92.9 | -44.5 | -173 | -61.8 | -58.9 | 0 | 0 | 0 | 113.9 | E195 L196 L471 S472 W475 | E195-Y200 HydrophobicContact CG-CD2 4.19Å; E195-Y200 HydrophobicContact CG-CE2 3.63Å; E195-Y200 WeakPolarHBondContact O-CD2 3.29Å; E195-Y200 PolarHBondContact O-N 3.35Å; E195-Y200 WeakPolarHBondContact OE1-CE2 3.37Å; E195-Y200 PolarHBondContact OE1-OH 3.35Å; L196-Y200 PolarHBondContact O-N 3.49Å; Y200-L471 HydrophobicContact CD2-CB 4.2Å; Y200-L471 HydrophobicContact CE2-CB 3.91Å; Y200-S472 WeakPolarHBondContact OH-CA 3.24Å; Y200-S472 WeakPolarHBondContact OH-CB 3.49Å; Y200-W475 HydrophobicContact CD1-CB 3.62Å; Y200-W475 AromaticContact CD1-CD1 3.54Å; Y200-W475 AromaticContact CD1-CD2 3.79Å; Y200-W475 HydrophobicContact CD1-CD2 3.79Å; Y200-W475 HydrophobicContact CD1-CE3 4.48Å; Y200-W475 AromaticContact CD1-CG 3.37Å; Y200-W475 HydrophobicContact CD1-CG 3.37Å; Y200-W475 AromaticContact CD1-NE1 3.97Å; Y200-W475 HydrophobicContact CD2-CB 4.38Å; Y200-W475 HydrophobicContact CE1-CB 4Å; Y200-W475 AromaticContact CE1-CD1 3.82Å; Y200-W475 AromaticContact CE1-CG 3.95Å; Y200-W475 HydrophobicContact CE1-CG 3.95Å; Y200-W475 HydrophobicContact CG-CB 3.85Å; Y200-W475 HydrophobicContact CG-CD2 4.17Å; Y200-W475 HydrophobicContact CG-CE3 4.45Å; Y200-W475 AromaticContact CG-CG 3.94Å; Y200-W475 HydrophobicContact CG-CG 3.94Å; Y200-W475 WeakPolarHBondContact O-CH2 3.23Å; Y200-W475 WeakPolarHBondContact O-CZ3 3.45Å |
| 201 | F | 90.7 | Very high | 85.2 | Confident | 1 Ų | 1 | 56 Ų | 56 | 0% | 0.004 | 32% | 0.322 | C | S | . | . | S | Bend | trans | -113 | 57.4 | -175.1 | -68.6 | -90.2 | 0 | 0 | 0 | 111.6 | L196 L197 F215 V216 Y243 V246 A247 W475 A478 | L196-F201 HydrophobicContact CD1-CD2 3.5Å; L196-F201 HydrophobicContact CD1-CE2 3.72Å; L196-F201 HydrophobicContact CG-CD2 4.18Å; L196-F201 WeakPolarHBondContact O-CA 3.48Å; L196-F201 WeakPolarHBondContact O-CB 3.49Å; L196-F201 PolarHBondContact O-N 3.42Å; L197-F201 HydrophobicContact CD2-CB 4.17Å; L197-F201 CarbonylContact O-C 3.51Å; F201-F215 HydrophobicContact CB-CE1 4.35Å; F201-F215 HydrophobicContact CB-CE2 4.3Å; F201-F215 HydrophobicContact CB-CZ 3.71Å; F201-F215 AromaticContact CD1-CE1 3.99Å; F201-F215 HydrophobicContact CD1-CE1 3.99Å; F201-F215 HydrophobicContact CD1-CZ 4.14Å; F201-F215 HydrophobicContact CG-CZ 4.38Å; F201-F215 VanDerWaalsContact O-CE2 3.25Å; F201-F215 WeakPolarHBondContact O-CE2 3.3Å; F201-V216 HydrophobicContact CB-CG2 4.32Å; F201-V216 HydrophobicContact CD1-CG2 3.84Å; F201-V216 HydrophobicContact CG-CG2 4.44Å; F201-Y243 HydrophobicContact CD1-CD1 4.42Å; F201-Y243 AromaticContact CE1-CD1 3.89Å; F201-Y243 HydrophobicContact CE1-CD1 3.89Å; F201-V246 HydrophobicContact CE1-CB 4.11Å; F201-V246 HydrophobicContact CE1-CG1 4.17Å; F201-V246 HydrophobicContact CZ-CB 4.12Å; F201-V246 HydrophobicContact CZ-CG1 3.66Å; F201-A247 HydrophobicContact CB-CB 4.19Å; F201-A247 HydrophobicContact CD1-CB 3.94Å; F201-A247 HydrophobicContact CE1-CB 4.42Å; F201-A247 HydrophobicContact CG-CB 3.98Å; F201-W475 HydrophobicContact CD1-CZ3 4.44Å; F201-W475 HydrophobicContact CD2-CE3 4.45Å; F201-W475 HydrophobicContact CE1-CZ3 4.28Å; F201-W475 HydrophobicContact CE2-CE3 4.02Å; F201-W475 HydrophobicContact CE2-CZ3 4.44Å; F201-W475 HydrophobicContact CZ-CE3 4.06Å; F201-W475 HydrophobicContact CZ-CZ3 4.27Å; F201-A478 HydrophobicContact CE1-CB 4.49Å; F201-A478 HydrophobicContact CZ-CB 3.88Å |
| 202 | V | 89.7 | Confident | 85.4 | Confident | 49 Ų | 49 | 54.4 Ų | 54.4 | 30% | 0.297 | 31% | 0.313 | S | S | . | . | trans | -65.4 | 135.1 | -173.3 | -172.1 | 0 | 0 | 0 | 0 | 111.3 | L197 G198 V216 | L197-V202 WeakPolarHBondContact O-CA 3.45Å; G198-V202 WeakPolarHBondContact O-CG2 3.41Å; V202-V216 PolarHBondContact O-N 3.25Å | ||
| 203 | T | 92 | Very high | 85.6 | Confident | 9 Ų | 9 | 51.3 Ų | 51.3 | 6% | 0.055 | 30% | 0.301 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.5 | 118.7 | 172.7 | -50.9 | 0 | 0 | 0 | 0 | 109.4 | L205 F215 L327 Y331 | T203-L205 HydrophobicContact CG2-CD2 3.88Å; T203-L205 HydrophobicContact CG2-CG 4.48Å; T203-F215 HydrophobicContact CG2-CD2 4.38Å; T203-F215 VanDerWaalsContact OG1-CD2 3.27Å; T203-F215 WeakPolarHBondContact OG1-CD2 3.35Å; T203-F215 VanDerWaalsContact OG1-CE2 3.3Å; T203-F215 WeakPolarHBondContact OG1-CE2 3.32Å; T203-L327 HydrophobicContact CG2-CB 3.87Å; T203-L327 HydrophobicContact CG2-CD2 4.4Å; T203-Y331 HydrophobicContact CG2-CD2 4.45Å; T203-Y331 WeakPolarHBondContact O-CD2 3.16Å |
| 204 | D | 89.7 | Confident | 85.9 | Confident | 73 Ų | 73 | 57.3 Ų | 57.3 | 39% | 0.39 | 32% | 0.324 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.9 | 111.6 | 176.7 | -55.7 | -47.8 | 0 | 0 | 0 | 108.9 | R214 | D204-R214 HydrophobicContact CB-CB 4.26Å; D204-R214 PolarHBondContact N-O 2.96Å; D204-R214 PolarHBondContact O-N 3.29Å |
| 205 | L | 88.9 | Confident | 86.4 | Confident | 36 Ų | 36 | 52 Ų | 52 | 19% | 0.188 | 30% | 0.299 | C | S | . | . | trans | -88.1 | 130.7 | 177.6 | -58 | -178.3 | 0 | 0 | 0 | 109.6 | T203 D213 L309 I314 L327 F328 Y331 | T203-L205 HydrophobicContact CG2-CD2 3.88Å; T203-L205 HydrophobicContact CG2-CG 4.48Å; L205-D213 HydrophobicContact CD2-CB 4.26Å; L205-L309 HydrophobicContact CD1-CD2 4.44Å; L205-I314 HydrophobicContact CD1-CD1 3.62Å; L205-L327 HydrophobicContact CD2-CB 4.14Å; L205-F328 HydrophobicContact CD1-CD1 3.75Å; L205-F328 HydrophobicContact CD1-CE1 4.05Å; L205-F328 HydrophobicContact CD2-CD1 3.72Å; L205-F328 HydrophobicContact CD2-CE1 3.93Å; L205-F328 HydrophobicContact CG-CD1 4.37Å; L205-Y331 HydrophobicContact CD1-CD1 3.57Å; L205-Y331 HydrophobicContact CD1-CD2 3.96Å; L205-Y331 HydrophobicContact CD1-CE1 4.04Å; L205-Y331 HydrophobicContact CD1-CE2 4.4Å; L205-Y331 HydrophobicContact CD1-CG 3.52Å; L205-Y331 HydrophobicContact CG-CD1 4.46Å; L205-Y331 HydrophobicContact CG-CD2 3.97Å; L205-Y331 HydrophobicContact CG-CE2 4.43Å; L205-Y331 HydrophobicContact CG-CG 3.99Å | ||
| 206 | S | 85.8 | Confident | 86.6 | Confident | 36 Ų | 36 | 52 Ų | 52 | 25% | 0.252 | 30% | 0.301 | S | S | . | . | trans | -78 | 135.7 | 178.8 | -178.8 | 0 | 0 | 0 | 0 | 111.4 | D208 S211 D213 | S206-D208 VanDerWaalsContact C-N 3.32Å; S206-D208 PolarHBondContact OG-N 3.42Å; S206-D208 VanDerWaalsContact OG-N 3.08Å; S206-D208 PolarHBondContact OG-O 3.33Å; S206-S211 PolarHBondContact OG-OG 3.34Å; S206-D213 PolarHBondContact N-OD1 2.95Å | ||
| 207 | T | 77.7 | Confident | 86.6 | Confident | 137 Ų | 137 | 56.6 Ų | 56.6 | 84% | 0.84 | 33% | 0.332 | S | S | * | . | S | Bend | trans | -75.5 | -23.1 | 170.3 | 54.1 | 0 | 0 | 0 | 0 | 112.6 | ||
| 208 | D | 77.9 | Confident | 86.7 | Confident | 101 Ų | 101 | 57.3 Ų | 57.3 | 54% | 0.54 | 34% | 0.337 | S | S | . | . | S | Bend | trans | -97.4 | 138.6 | -173.5 | -58.2 | -20.3 | 0 | 0 | 0 | 110.8 | S206 L210 S211 K224 | S206-D208 VanDerWaalsContact C-N 3.32Å; S206-D208 PolarHBondContact OG-N 3.42Å; S206-D208 VanDerWaalsContact OG-N 3.08Å; S206-D208 PolarHBondContact OG-O 3.33Å; D208-L210 PolarHBondContact O-N 3.34Å; D208-S211 PolarHBondContact O-N 2.86Å; D208-K224 PolarHBondContact O-NZ 2.85Å; D208-K224 VanDerWaalsContact O-NZ 3.11Å |
| 209 | S | 71.8 | Confident | 87.1 | Confident | 101 Ų | 101 | 56.9 Ų | 56.9 | 71% | 0.706 | 33% | 0.327 | S | S | * | . | S | Bend | trans | -62.8 | -29.2 | -179.4 | 56.9 | 0 | 0 | 0 | 0 | 112.9 | K224 | S209-K224 PolarHBondContact O-NZ 3.24Š|
| 210 | L | 77.1 | Confident | 87.5 | Confident | 169 Ų | 169 | 53.3 Ų | 53.3 | 89% | 0.885 | 31% | 0.305 | S | S | * | . | S | Bend | trans | -82.9 | -27.7 | -175 | -69.7 | 166.1 | 0 | 0 | 0 | 114.3 | D208 | D208-L210 PolarHBondContact O-N 3.34Š|
| 211 | S | 85.4 | Confident | 87.7 | Confident | 41 Ų | 41 | 54.3 Ų | 54.3 | 29% | 0.287 | 31% | 0.311 | S | S | . | . | S | Bend | trans | -92.4 | 141.3 | -178.6 | 46.4 | 0 | 0 | 0 | 0 | 111.2 | S206 D208 K224 | S206-S211 PolarHBondContact OG-OG 3.34Å; D208-S211 PolarHBondContact O-N 2.86Å; S211-K224 PolarHBondContact O-NZ 2.99Å |
| 212 | P | 89.1 | Confident | 87.6 | Confident | 31 Ų | 31 | 55.3 Ų | 55.3 | 20% | 0.201 | 32% | 0.316 | C | S | . | . | P | Polyproline II helix | trans | -73.6 | 147.7 | 177.5 | 30.6 | -36.1 | 0 | 0 | 0 | 110.9 | P219 | P212-P219 HydrophobicContact CB-CB 4.24Å; P212-P219 HydrophobicContact CG-CB 3.67Å; P212-P219 HydrophobicContact CG-CG 4.48Å |
| 213 | D | 90.9 | Very high | 87.3 | Confident | 9 Ų | 9 | 56.3 Ų | 56.3 | 5% | 0.048 | 32% | 0.32 | C | S | . | . | P | Polyproline II helix | trans | -63.5 | 150.5 | 166.1 | -62.7 | -33 | 0 | 0 | 0 | 109.5 | L205 S206 L220 N325 L327 | L205-D213 HydrophobicContact CD2-CB 4.26Å; S206-D213 PolarHBondContact N-OD1 2.95Å; D213-L220 PolarHBondContact O-N 3.23Å; D213-N325 PolarHBondContact OD2-ND2 3.49Å; D213-L327 HydrophobicContact CB-CD1 3.56Å |
| 214 | R | 93.2 | Very high | 86.6 | Confident | 126 Ų | 126 | 59.4 Ų | 59.4 | 48% | 0.475 | 33% | 0.333 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.7 | 145.6 | -177.2 | -55.4 | -179 | 177.4 | -173.6 | -2.4 | 111.2 | D204 S218 P219 | D204-R214 HydrophobicContact CB-CB 4.26Å; D204-R214 PolarHBondContact N-O 2.96Å; D204-R214 PolarHBondContact O-N 3.29Å; R214-S218 WeakPolarHBondContact CA-O 3.36Å; R214-P219 HydrophobicContact CG-CG 4.4Å |
| 215 | F | 92.9 | Very high | 86 | Confident | 0 Ų | 0 | 61.9 Ų | 61.9 | 0% | 0 | 34% | 0.342 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.2 | 121.4 | 169.4 | -168.1 | -110.8 | 0 | 0 | 0 | 108.7 | F201 T203 C217 S218 A240 C244 A247 L327 L330 | F201-F215 HydrophobicContact CB-CE1 4.35Å; F201-F215 HydrophobicContact CB-CE2 4.3Å; F201-F215 HydrophobicContact CB-CZ 3.71Å; F201-F215 AromaticContact CD1-CE1 3.99Å; F201-F215 HydrophobicContact CD1-CE1 3.99Å; F201-F215 HydrophobicContact CD1-CZ 4.14Å; F201-F215 HydrophobicContact CG-CZ 4.38Å; F201-F215 VanDerWaalsContact O-CE2 3.25Å; F201-F215 WeakPolarHBondContact O-CE2 3.3Å; T203-F215 HydrophobicContact CG2-CD2 4.38Å; T203-F215 VanDerWaalsContact OG1-CD2 3.27Å; T203-F215 WeakPolarHBondContact OG1-CD2 3.35Å; T203-F215 VanDerWaalsContact OG1-CE2 3.3Å; T203-F215 WeakPolarHBondContact OG1-CE2 3.32Å; F215-C217 VanDerWaalsContact C-N 3.32Å; F215-C217 PolarHBondContact O-N 3.24Å; F215-S218 PolarHBondContact N-O 2.95Å; F215-S218 VanDerWaalsContact O-CB 3.32Å; F215-S218 WeakPolarHBondContact O-CB 3.31Å; F215-S218 PolarHBondContact O-N 2.98Å; F215-A240 HydrophobicContact CB-CB 4.37Å; F215-C244 HydrophobicContact CD1-CB 4.49Å; F215-C244 WeakPolarHBondContact CD1-SG 3.41Å; F215-C244 HydrophobicContact CE1-CB 4.3Å; F215-A247 HydrophobicContact CE1-CB 4.31Å; F215-A247 HydrophobicContact CZ-CB 3.86Å; F215-L327 HydrophobicContact CB-CD2 3.81Å; F215-L327 HydrophobicContact CD2-CD2 4.01Å; F215-L327 HydrophobicContact CG-CD2 4.06Å; F215-L330 HydrophobicContact CD2-CD1 4.2Å; F215-L330 HydrophobicContact CE2-CB 4.45Å; F215-L330 HydrophobicContact CE2-CD1 3.71Å; F215-L330 HydrophobicContact CZ-CD1 3.96Å |
| 216 | V | 90.7 | Very high | 85.6 | Confident | 22 Ų | 22 | 63.9 Ų | 63.9 | 13% | 0.133 | 35% | 0.353 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 52.6 | 52.9 | -173.3 | -164.7 | 0 | 0 | 0 | 0 | 110.9 | F201 V202 S218 Y243 W475 | F201-V216 HydrophobicContact CB-CG2 4.32Å; F201-V216 HydrophobicContact CD1-CG2 3.84Å; F201-V216 HydrophobicContact CG-CG2 4.44Å; V202-V216 PolarHBondContact O-N 3.25Å; V216-S218 PolarHBondContact O-N 3.38Å; V216-S218 PolarHBondContact O-OG 2.99Å; V216-Y243 HydrophobicContact CB-CD2 3.87Å; V216-Y243 HydrophobicContact CB-CE2 4.23Å; V216-Y243 HydrophobicContact CB-CG 4.07Å; V216-Y243 HydrophobicContact CG1-CD1 4.44Å; V216-Y243 HydrophobicContact CG1-CD2 4.22Å; V216-Y243 HydrophobicContact CG1-CE1 4.34Å; V216-Y243 HydrophobicContact CG1-CE2 4.13Å; V216-Y243 HydrophobicContact CG1-CG 4.4Å; V216-Y243 HydrophobicContact CG2-CD1 4.32Å; V216-Y243 HydrophobicContact CG2-CD2 4.24Å; V216-Y243 HydrophobicContact CG2-CG 3.93Å; V216-W475 HydrophobicContact CG1-CH2 3.62Å; V216-W475 HydrophobicContact CG1-CZ3 4.11Å |
| 217 | C | 89.5 | Confident | 85.5 | Confident | 97 Ų | 97 | 62.4 Ų | 62.4 | 66% | 0.655 | 34% | 0.342 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 57 | 2.7 | -175.6 | -52.5 | 0 | 0 | 0 | 0 | 115.7 | F215 P219 | F215-C217 VanDerWaalsContact C-N 3.32Å; F215-C217 PolarHBondContact O-N 3.24Å; C217-P219 WeakPolarHBondContact O-CD 3.41Å |
| 218 | S | 92.1 | Very high | 85.8 | Confident | 20 Ų | 20 | 58.8 Ų | 58.8 | 14% | 0.14 | 32% | 0.315 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.7 | 119.4 | -178 | -58.6 | 0 | 0 | 0 | 0 | 110 | R214 F215 V216 L220 T239 | R214-S218 WeakPolarHBondContact CA-O 3.36Å; F215-S218 PolarHBondContact N-O 2.95Å; F215-S218 VanDerWaalsContact O-CB 3.32Å; F215-S218 WeakPolarHBondContact O-CB 3.31Å; F215-S218 PolarHBondContact O-N 2.98Å; V216-S218 PolarHBondContact O-N 3.38Å; V216-S218 PolarHBondContact O-OG 2.99Å; S218-L220 PolarHBondContact O-N 3.26Å; S218-T239 WeakPolarHBondContact OG-CG2 3.49Å |
| 219 | P | 93.4 | Very high | 86.1 | Confident | 30 Ų | 30 | 57 Ų | 57 | 20% | 0.195 | 31% | 0.314 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -59.5 | 128.6 | 176.1 | -28.9 | 37.9 | 0 | 0 | 0 | 113.4 | P212 R214 C217 H221 S236 S237 | P212-P219 HydrophobicContact CB-CB 4.24Å; P212-P219 HydrophobicContact CG-CB 3.67Å; P212-P219 HydrophobicContact CG-CG 4.48Å; R214-P219 HydrophobicContact CG-CG 4.4Å; C217-P219 WeakPolarHBondContact O-CD 3.41Å; P219-H221 WeakPolarHBondContact CB-NE2 3.28Å; P219-S236 CarbonylContact O-C 3.27Å; P219-S236 WeakPolarHBondContact O-CB 3.47Å; P219-S237 PolarHBondContact O-N 3.19Å |
| 220 | L | 92.5 | Very high | 86.7 | Confident | 0 Ų | 0 | 52.7 Ų | 52.7 | 0% | 0 | 29% | 0.286 | C | S | . | . | trans | -102.1 | 104.6 | 168.6 | -176.5 | 62.7 | 0 | 0 | 0 | 109.1 | D213 S218 I222 P231 A240 L241 L327 | D213-L220 PolarHBondContact O-N 3.23Å; S218-L220 PolarHBondContact O-N 3.26Å; L220-I222 HydrophobicContact CD2-CG2 4.46Å; L220-I222 HydrophobicContact CG-CG2 4.12Å; L220-I222 PolarHBondContact O-N 3.15Å; L220-P231 HydrophobicContact CD1-CB 4.06Å; L220-A240 HydrophobicContact CB-CB 4.15Å; L220-A240 HydrophobicContact CD1-CB 4.32Å; L220-L241 HydrophobicContact CD1-CD2 3.95Å; L220-L241 HydrophobicContact CD1-CG 4.11Å; L220-L241 HydrophobicContact CD2-CD2 4.31Å; L220-L327 HydrophobicContact CB-CD1 3.95Å; L220-L327 HydrophobicContact CD2-CD1 3.87Å; L220-L327 HydrophobicContact CD2-CD2 4.28Å; L220-L327 HydrophobicContact CD2-CG 3.94Å | ||
| 221 | H | 90.6 | Very high | 87.3 | Confident | 52 Ų | 52 | 45.4 Ų | 45.4 | 24% | 0.241 | 25% | 0.249 | C | C | . | . | trans | -83.7 | 105.9 | -178.1 | -62.5 | -96 | 0 | 0 | 0 | 109.7 | P219 P231 E232 S236 S237 | P219-H221 WeakPolarHBondContact CB-NE2 3.28Å; H221-P231 CarbonylContact O-C 3.17Å; H221-P231 VanDerWaalsContact O-CA 3.23Å; H221-P231 WeakPolarHBondContact O-CA 3.45Å; H221-E232 HydrophobicContact CB-CB 3.91Å; H221-E232 HydrophobicContact CB-CG 4.02Å; H221-E232 IonicContact CG-OE2 3.82Å; H221-E232 PolarHBondContact O-N 3.46Å; H221-S236 PolarHBondContact CD2-OG 3.43Å; H221-S236 PolarHBondContact NE2-OG 2.98Å; H221-S237 PolarHBondContact N-OG 3.02Å | ||
| 222 | I | 88.4 | Confident | 87.5 | Confident | 22 Ų | 22 | 48.6 Ų | 48.6 | 11% | 0.113 | 26% | 0.259 | C | S | . | . | B | Isolated β-bridge | trans | -127.7 | 147.3 | 177.7 | 50.7 | 169.7 | 0 | 0 | 0 | 110.5 | L220 K224 P231 Y287 N325 | L220-I222 HydrophobicContact CD2-CG2 4.46Å; L220-I222 HydrophobicContact CG-CG2 4.12Å; L220-I222 PolarHBondContact O-N 3.15Å; I222-K224 PolarHBondContact O-N 3.24Å; I222-P231 HydrophobicContact CG2-CB 4.05Å; I222-Y287 HydrophobicContact CG2-CE2 3.89Å; I222-N325 HydrophobicContact CD1-CB 4.47Å |
| 223 | D | 83.9 | Confident | 87.3 | Confident | 71 Ų | 71 | 50.7 Ų | 50.7 | 38% | 0.38 | 27% | 0.273 | S | S | . | . | trans | -67.9 | 110.3 | 168.9 | -177.5 | -10.4 | 0 | 0 | 0 | 109.5 | E225 N226 I227 | D223-E225 PolarHBondContact O-N 3.08Å; D223-E225 WeakPolarHBondContact OD1-CA 3.39Å; D223-E225 WeakPolarHBondContact OD1-CB 3.41Å; D223-E225 PolarHBondContact OD1-N 3.5Å; D223-N226 CarbonylContact O-C 3.46Å; D223-N226 VanDerWaalsContact O-C 3.27Å; D223-N226 PolarHBondContact O-N 2.96Å; D223-N226 PolarHBondContact OD1-N 3.4Å; D223-N226 VanDerWaalsContact OD1-N 3.14Å; D223-I227 WeakPolarHBondContact O-CA 3.24Å; D223-I227 WeakPolarHBondContact O-CG1 3.3Å; D223-I227 PolarHBondContact O-N 3.02Å | ||
| 224 | K | 78 | Confident | 87.2 | Confident | 74 Ų | 74 | 52 Ų | 52 | 32% | 0.322 | 28% | 0.281 | S | S | . | . | S | Bend | trans | -67.6 | -19.4 | 179.7 | -67.3 | -177.1 | 179.4 | 173.9 | 0 | 112.4 | D208 S209 S211 I222 | D208-K224 PolarHBondContact O-NZ 2.85Å; D208-K224 VanDerWaalsContact O-NZ 3.11Å; S209-K224 PolarHBondContact O-NZ 3.24Å; S211-K224 PolarHBondContact O-NZ 2.99Å; I222-K224 PolarHBondContact O-N 3.24Å |
| 225 | E | 75.8 | Confident | 87 | Confident | 124 Ų | 124 | 50.8 Ų | 50.8 | 58% | 0.579 | 29% | 0.29 | S | S | * | . | S | Bend | trans | -87.2 | -42.8 | 175.7 | -51.4 | -151.4 | 131.8 | 0 | 0 | 111.7 | D223 R320 | D223-E225 PolarHBondContact O-N 3.08Å; D223-E225 WeakPolarHBondContact OD1-CA 3.39Å; D223-E225 WeakPolarHBondContact OD1-CB 3.41Å; D223-E225 PolarHBondContact OD1-N 3.5Å; E225-R320 VanDerWaalsContact CD-NH1 3.27Å; E225-R320 VanDerWaalsContact CG-NH1 3.35Å; E225-R320 IonicContact OE1-CZ 3.5Å; E225-R320 IonicContact OE1-NH1 3.87Å; E225-R320 PolarHBondContact OE1-NH1 2.99Å; E225-R320 IonicContact OE1-NH2 2.63Å; E225-R320 PolarHBondContact OE1-NH2 3.35Å |
| 226 | N | 81.3 | Confident | 86.9 | Confident | 78 Ų | 78 | 52.3 Ų | 52.3 | 42% | 0.417 | 30% | 0.3 | S | S | . | . | trans | -122.3 | 78.4 | 178.5 | -172.5 | 13.9 | 0 | 0 | 0 | 112.3 | D223 F228 A229 | D223-N226 CarbonylContact O-C 3.46Å; D223-N226 VanDerWaalsContact O-C 3.27Å; D223-N226 PolarHBondContact O-N 2.96Å; D223-N226 PolarHBondContact OD1-N 3.4Å; D223-N226 VanDerWaalsContact OD1-N 3.14Å; N226-F228 PolarHBondContact O-N 3.14Å; N226-A229 HydrophobicContact CB-CB 4.34Å; N226-A229 WeakPolarHBondContact O-CB 3.41Å; N226-A229 PolarHBondContact O-N 2.88Å | ||
| 227 | I | 82.5 | Confident | 86.9 | Confident | 5 Ų | 5 | 51.3 Ų | 51.3 | 3% | 0.026 | 29% | 0.294 | C | S | . | . | G | 310 helix | trans | -57.8 | -24.2 | 179.9 | -78 | 170.3 | 0 | 0 | 0 | 113.5 | D223 A229 Y287 I291 H321 T322 N325 | D223-I227 WeakPolarHBondContact O-CA 3.24Å; D223-I227 WeakPolarHBondContact O-CG1 3.3Å; D223-I227 PolarHBondContact O-N 3.02Å; I227-A229 VanDerWaalsContact C-N 3.32Å; I227-Y287 WeakPolarHBondContact CG2-OH 3.39Å; I227-Y287 WeakPolarHBondContact O-CE1 3.34Å; I227-Y287 PolarHBondContact O-OH 3.44Å; I227-I291 HydrophobicContact CG2-CD1 4.45Å; I227-H321 VanDerWaalsContact CD1-O 3.29Å; I227-H321 WeakPolarHBondContact CD1-O 3.48Å; I227-T322 HydrophobicContact CD1-CG2 4.39Å; I227-N325 HydrophobicContact CD1-CB 4.1Å |
| 228 | F | 84.7 | Confident | 86.9 | Confident | 61 Ų | 61 | 49 Ų | 49 | 27% | 0.268 | 27% | 0.273 | S | S | . | . | G | 310 helix | trans | -85 | -1.8 | 177.1 | -56.4 | -55.8 | 0 | 0 | 0 | 113.6 | N226 G230 F288 H321 Y324 | N226-F228 PolarHBondContact O-N 3.14Å; F228-G230 PolarHBondContact O-N 3.22Å; F228-F288 HydrophobicContact CB-CE1 4.24Å; F228-F288 HydrophobicContact CB-CZ 4.49Å; F228-F288 AromaticContact CD1-CE1 3.97Å; F228-F288 HydrophobicContact CD1-CE1 3.97Å; F228-F288 VanDerWaalsContact O-CZ 3.25Å; F228-F288 WeakPolarHBondContact O-CZ 3.45Å; F228-H321 HydrophobicContact CD2-CB 4.3Å; F228-H321 HydrophobicContact CE2-CB 3.65Å; F228-H321 AromaticContact CE2-CD2 3.77Å; F228-H321 AromaticContact CE2-CG 3.4Å; F228-H321 AromaticContact CE2-ND1 3.58Å; F228-H321 HydrophobicContact CZ-CB 4.14Å; F228-Y324 HydrophobicContact CE1-CG 4.27Å; F228-Y324 HydrophobicContact CZ-CD1 4.49Å; F228-Y324 AromaticContact CZ-CD2 3.87Å; F228-Y324 HydrophobicContact CZ-CD2 3.87Å; F228-Y324 HydrophobicContact CZ-CE2 4.41Å; F228-Y324 AromaticContact CZ-CG 3.91Å; F228-Y324 HydrophobicContact CZ-CG 3.91Å |
| 229 | A | 84.1 | Confident | 86.7 | Confident | 64 Ų | 64 | 49.9 Ų | 49.9 | 53% | 0.529 | 28% | 0.278 | S | S | . | . | G | 310 helix | trans | -64.9 | -21.7 | 167.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | N226 I227 | N226-A229 HydrophobicContact CB-CB 4.34Å; N226-A229 WeakPolarHBondContact O-CB 3.41Å; N226-A229 PolarHBondContact O-N 2.88Å; I227-A229 VanDerWaalsContact C-N 3.32Å |
| 230 | G | 84.8 | Confident | 86.6 | Confident | 10 Ų | 10 | 48.4 Ų | 48.4 | 10% | 0.103 | 27% | 0.269 | C | S | . | . | trans | 87 | 177.4 | -174.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | F228 | F228-G230 PolarHBondContact O-N 3.22Š| ||
| 231 | P | 90.5 | Very high | 86.5 | Confident | 17 Ų | 17 | 48.4 Ų | 48.4 | 11% | 0.11 | 27% | 0.269 | C | S | . | . | B | Isolated β-bridge | trans | -82.2 | 152.8 | -177.5 | 34.2 | -35.3 | 0 | 0 | 0 | 111.7 | L220 H221 I222 L241 M283 Y287 | L220-P231 HydrophobicContact CD1-CB 4.06Å; H221-P231 CarbonylContact O-C 3.17Å; H221-P231 VanDerWaalsContact O-CA 3.23Å; H221-P231 WeakPolarHBondContact O-CA 3.45Å; I222-P231 HydrophobicContact CG2-CB 4.05Å; P231-L241 HydrophobicContact CG-CD1 4.14Å; P231-M283 HydrophobicContact CB-CE 4.5Å; P231-M283 HydrophobicContact CG-CE 3.95Å; P231-Y287 HydrophobicContact CG-CD2 4.38Å; P231-Y287 HydrophobicContact CG-CG 4.21Å |
| 232 | E | 88.4 | Confident | 86.3 | Confident | 107 Ų | 107 | 46.1 Ų | 46.1 | 50% | 0.5 | 26% | 0.258 | S | S | . | . | trans | -62.7 | 138.4 | 168.8 | -61.2 | -175.7 | 165.5 | 0 | 0 | 109.9 | H221 T234 S237 | H221-E232 HydrophobicContact CB-CB 3.91Å; H221-E232 HydrophobicContact CB-CG 4.02Å; H221-E232 IonicContact CG-OE2 3.82Å; H221-E232 PolarHBondContact O-N 3.46Å; E232-T234 HydrophobicContact CB-CG2 4.11Å; E232-T234 PolarHBondContact O-N 3.01Å; E232-S237 WeakPolarHBondContact O-CB 3.37Å; E232-S237 PolarHBondContact O-OG 2.86Å | ||
| 233 | P | 85.9 | Confident | 86.4 | Confident | 76 Ų | 76 | 45.4 Ų | 45.4 | 49% | 0.494 | 25% | 0.254 | S | S | . | . | trans | -78.9 | 54.1 | -175.1 | 34 | -37.3 | 0 | 0 | 0 | 112.1 | R280 | P233-R280 PolarHBondContact O-NE 3.48Å; P233-R280 PolarHBondContact O-NH2 3.16Å | ||
| 234 | T | 88.9 | Confident | 86.7 | Confident | 36 Ų | 36 | 42 Ų | 42 | 22% | 0.221 | 24% | 0.236 | C | C | . | . | trans | -92.5 | 154.6 | 176.5 | 62 | 0 | 0 | 0 | 0 | 111.2 | E232 S236 S237 H238 | E232-T234 HydrophobicContact CB-CG2 4.11Å; E232-T234 PolarHBondContact O-N 3.01Å; T234-S236 PolarHBondContact O-N 3.05Å; T234-S236 PolarHBondContact OG1-OG 3.05Å; T234-S237 PolarHBondContact O-N 3.34Å; T234-S237 WeakPolarHBondContact OG1-CB 3.33Å; T234-S237 PolarHBondContact OG1-N 3.14Å; T234-S237 PolarHBondContact OG1-OG 3.39Å; T234-S237 VanDerWaalsContact OG1-OG 3.05Å; T234-H238 PolarHBondContact O-N 3.42Å | ||
| 235 | P | 87.9 | Confident | 87.2 | Confident | 101 Ų | 101 | 38.9 Ų | 38.9 | 66% | 0.656 | 22% | 0.223 | S | C | * | . | H | α-helix | trans | -58.8 | -34.1 | 174.3 | -24.6 | 34.6 | 0 | 0 | 0 | 113.3 | H238 T239 | P235-H238 PolarHBondContact O-N 2.93Å; P235-T239 WeakPolarHBondContact O-CB 3.39Å; P235-T239 PolarHBondContact O-N 3.28Å; P235-T239 PolarHBondContact O-OG1 3.26Å |
| 236 | S | 90.8 | Very high | 87.7 | Confident | 32 Ų | 32 | 33.7 Ų | 33.7 | 22% | 0.224 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -64.8 | -48.8 | 177.1 | 49.8 | 0 | 0 | 0 | 0 | 111.9 | P219 H221 T234 H238 T239 A240 | P219-S236 CarbonylContact O-C 3.27Å; P219-S236 WeakPolarHBondContact O-CB 3.47Å; H221-S236 PolarHBondContact CD2-OG 3.43Å; H221-S236 PolarHBondContact NE2-OG 2.98Å; T234-S236 PolarHBondContact O-N 3.05Å; T234-S236 PolarHBondContact OG1-OG 3.05Å; S236-H238 VanDerWaalsContact C-N 3.3Å; S236-H238 PolarHBondContact O-N 3.35Å; S236-T239 PolarHBondContact O-N 3.11Å; S236-A240 WeakPolarHBondContact O-CB 3.5Å; S236-A240 PolarHBondContact O-N 3Å |
| 237 | S | 91 | Very high | 88.2 | Confident | 0 Ų | 0 | 30 Ų | 30 | 0% | 0 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -60.4 | -41.4 | 176 | -67.6 | 0 | 0 | 0 | 0 | 111.5 | P219 H221 E232 T234 A240 L241 M283 | P219-S237 PolarHBondContact O-N 3.19Å; H221-S237 PolarHBondContact N-OG 3.02Å; E232-S237 WeakPolarHBondContact O-CB 3.37Å; E232-S237 PolarHBondContact O-OG 2.86Å; T234-S237 PolarHBondContact O-N 3.34Å; T234-S237 WeakPolarHBondContact OG1-CB 3.33Å; T234-S237 PolarHBondContact OG1-N 3.14Å; T234-S237 PolarHBondContact OG1-OG 3.39Å; T234-S237 VanDerWaalsContact OG1-OG 3.05Å; S237-A240 PolarHBondContact O-N 3.41Å; S237-L241 WeakPolarHBondContact O-CG 3.43Å; S237-L241 PolarHBondContact O-N 2.98Å; S237-M283 VanDerWaalsContact C-CE 3.47Å |
| 238 | H | 88.6 | Confident | 88.6 | Confident | 48 Ų | 48 | 29.8 Ų | 29.8 | 22% | 0.222 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -62.3 | -44.6 | 177.2 | 175.3 | -89.3 | 0 | 0 | 0 | 112.5 | T234 P235 S236 L241 T242 P278 M283 | T234-H238 PolarHBondContact O-N 3.42Å; P235-H238 PolarHBondContact O-N 2.93Å; S236-H238 VanDerWaalsContact C-N 3.3Å; S236-H238 PolarHBondContact O-N 3.35Å; H238-L241 PolarHBondContact O-N 3.4Å; H238-T242 WeakPolarHBondContact O-CB 3.33Å; H238-T242 PolarHBondContact O-N 2.96Å; H238-T242 PolarHBondContact O-OG1 3.23Å; H238-P278 PolarHBondContact NE2-O 3.12Å; H238-M283 VanDerWaalsContact CA-CE 3.47Å; H238-M283 VanDerWaalsContact CA-SD 3.54Å; H238-M283 HydrophobicContact CB-CE 4.09Å; H238-M283 HydrophobicContact CB-SD 3.81Å |
| 239 | T | 88.1 | Confident | 88.7 | Confident | 39 Ų | 39 | 28.5 Ų | 28.5 | 24% | 0.239 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -61.6 | -47.4 | 175.5 | -57.4 | 0 | 0 | 0 | 0 | 110.9 | S218 P235 S236 L241 T242 Y243 I482 | S218-T239 WeakPolarHBondContact OG-CG2 3.49Å; P235-T239 WeakPolarHBondContact O-CB 3.39Å; P235-T239 PolarHBondContact O-N 3.28Å; P235-T239 PolarHBondContact O-OG1 3.26Å; S236-T239 PolarHBondContact O-N 3.11Å; T239-L241 PolarHBondContact O-N 3.07Å; T239-T242 WeakPolarHBondContact O-CB 2.97Å; T239-T242 PolarHBondContact O-N 3.17Å; T239-Y243 HydrophobicContact CG2-CD2 3.85Å; T239-Y243 HydrophobicContact CG2-CE2 3.48Å; T239-Y243 VanDerWaalsContact CG2-CE2 3.48Å; T239-Y243 VanDerWaalsContact O-CD2 3.25Å; T239-Y243 WeakPolarHBondContact O-CD2 3.43Å; T239-Y243 PolarHBondContact O-N 3.25Å; T239-I482 HydrophobicContact CG2-CG2 4.33Å |
| 240 | A | 91 | Very high | 88.8 | Confident | 0 Ų | 0 | 25.9 Ų | 25.9 | 0% | 0 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -58.6 | -47.8 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | F215 L220 S236 S237 T242 Y243 C244 | F215-A240 HydrophobicContact CB-CB 4.37Å; L220-A240 HydrophobicContact CB-CB 4.15Å; L220-A240 HydrophobicContact CD1-CB 4.32Å; S236-A240 WeakPolarHBondContact O-CB 3.5Å; S236-A240 PolarHBondContact O-N 3Å; S237-A240 PolarHBondContact O-N 3.41Å; A240-T242 VanDerWaalsContact C-N 3.3Å; A240-T242 PolarHBondContact O-N 3.41Å; A240-Y243 PolarHBondContact O-N 3.48Å; A240-C244 PolarHBondContact O-N 3.43Å; A240-C244 PolarHBondContact O-SG 3.46Å |
| 241 | L | 90.7 | Very high | 89 | Confident | 0 Ų | 0 | 25.4 Ų | 25.4 | 0% | 0 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -66.2 | -31.7 | 177.9 | -69.2 | -167.6 | 0 | 0 | 0 | 113.7 | L220 P231 S237 H238 T239 C244 S245 M283 V286 Y287 | L220-L241 HydrophobicContact CD1-CD2 3.95Å; L220-L241 HydrophobicContact CD1-CG 4.11Å; L220-L241 HydrophobicContact CD2-CD2 4.31Å; P231-L241 HydrophobicContact CG-CD1 4.14Å; S237-L241 WeakPolarHBondContact O-CG 3.43Å; S237-L241 PolarHBondContact O-N 2.98Å; H238-L241 PolarHBondContact O-N 3.4Å; T239-L241 PolarHBondContact O-N 3.07Å; L241-C244 PolarHBondContact O-N 2.89Å; L241-S245 PolarHBondContact O-N 3.08Å; L241-S245 PolarHBondContact O-OG 3.45Å; L241-M283 HydrophobicContact CB-CE 4.46Å; L241-M283 HydrophobicContact CD1-CE 3.4Å; L241-M283 HydrophobicContact CD1-SD 3.77Å; L241-M283 HydrophobicContact CG-CE 3.95Å; L241-V286 HydrophobicContact CB-CG1 4.24Å; L241-V286 HydrophobicContact CD1-CB 4.47Å; L241-V286 HydrophobicContact CD1-CG1 4.24Å; L241-Y287 HydrophobicContact CD2-CD2 4.11Å |
| 242 | T | 87.5 | Confident | 88.8 | Confident | 3 Ų | 3 | 25.4 Ų | 25.4 | 2% | 0.018 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -64.9 | -46.6 | 175.3 | -58.3 | 0 | 0 | 0 | 0 | 110.1 | H238 T239 A240 C244 S245 V246 L277 I482 | H238-T242 WeakPolarHBondContact O-CB 3.33Å; H238-T242 PolarHBondContact O-N 2.96Å; H238-T242 PolarHBondContact O-OG1 3.23Å; T239-T242 WeakPolarHBondContact O-CB 2.97Å; T239-T242 PolarHBondContact O-N 3.17Å; A240-T242 VanDerWaalsContact C-N 3.3Å; A240-T242 PolarHBondContact O-N 3.41Å; T242-C244 PolarHBondContact O-N 3.04Å; T242-S245 PolarHBondContact O-N 2.96Å; T242-V246 PolarHBondContact O-N 3.38Å; T242-L277 HydrophobicContact CG2-CB 4.38Å; T242-L277 HydrophobicContact CG2-CD1 4.45Å; T242-L277 HydrophobicContact CG2-CD2 3.35Å; T242-L277 HydrophobicContact CG2-CG 4.25Å; T242-I482 HydrophobicContact CG2-CD1 3.75Å; T242-I482 HydrophobicContact CG2-CG1 3.69Å |
| 243 | Y | 89.2 | Confident | 88.6 | Confident | 8 Ų | 8 | 25.7 Ų | 25.7 | 3% | 0.031 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -61.2 | -42.1 | 171.8 | -74.1 | -61 | 0 | 0 | 0 | 112.1 | F201 V216 T239 A240 S245 V246 A247 I482 T484 | F201-Y243 HydrophobicContact CD1-CD1 4.42Å; F201-Y243 AromaticContact CE1-CD1 3.89Å; F201-Y243 HydrophobicContact CE1-CD1 3.89Å; V216-Y243 HydrophobicContact CB-CD2 3.87Å; V216-Y243 HydrophobicContact CB-CE2 4.23Å; V216-Y243 HydrophobicContact CB-CG 4.07Å; V216-Y243 HydrophobicContact CG1-CD1 4.44Å; V216-Y243 HydrophobicContact CG1-CD2 4.22Å; V216-Y243 HydrophobicContact CG1-CE1 4.34Å; V216-Y243 HydrophobicContact CG1-CE2 4.13Å; V216-Y243 HydrophobicContact CG1-CG 4.4Å; V216-Y243 HydrophobicContact CG2-CD1 4.32Å; V216-Y243 HydrophobicContact CG2-CD2 4.24Å; V216-Y243 HydrophobicContact CG2-CG 3.93Å; T239-Y243 HydrophobicContact CG2-CD2 3.85Å; T239-Y243 HydrophobicContact CG2-CE2 3.48Å; T239-Y243 VanDerWaalsContact CG2-CE2 3.48Å; T239-Y243 VanDerWaalsContact O-CD2 3.25Å; T239-Y243 WeakPolarHBondContact O-CD2 3.43Å; T239-Y243 PolarHBondContact O-N 3.25Å; A240-Y243 PolarHBondContact O-N 3.48Å; Y243-S245 VanDerWaalsContact C-N 3.27Å; Y243-S245 PolarHBondContact O-N 2.98Å; Y243-V246 PolarHBondContact O-N 3.23Å; Y243-V246 VanDerWaalsContact O-N 3.15Å; Y243-A247 PolarHBondContact O-N 3.44Å; Y243-I482 HydrophobicContact CD1-CD1 3.32Å; Y243-I482 HydrophobicContact CD2-CD1 4.28Å; Y243-I482 HydrophobicContact CE1-CD1 3.19Å; Y243-I482 HydrophobicContact CE1-CG1 4.44Å; Y243-I482 HydrophobicContact CE2-CD1 4.16Å; Y243-I482 HydrophobicContact CE2-CG2 4.36Å; Y243-I482 HydrophobicContact CG-CD1 3.88Å; Y243-T484 WeakPolarHBondContact OH-CG2 3.33Å |
| 244 | C | 91.5 | Very high | 88.5 | Confident | 0 Ų | 0 | 23.3 Ų | 23.3 | 0% | 0 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -57.2 | -41.9 | 176.8 | -72 | 0 | 0 | 0 | 0 | 111.6 | F215 A240 L241 T242 V246 A247 I248 V290 | F215-C244 HydrophobicContact CD1-CB 4.49Å; F215-C244 WeakPolarHBondContact CD1-SG 3.41Å; F215-C244 HydrophobicContact CE1-CB 4.3Å; A240-C244 PolarHBondContact O-N 3.43Å; A240-C244 PolarHBondContact O-SG 3.46Å; L241-C244 PolarHBondContact O-N 2.89Å; T242-C244 PolarHBondContact O-N 3.04Å; C244-V246 VanDerWaalsContact C-N 3.31Å; C244-V246 PolarHBondContact O-N 2.87Å; C244-A247 PolarHBondContact O-N 3.21Å; C244-I248 WeakPolarHBondContact O-CB 3.45Å; C244-I248 WeakPolarHBondContact O-CD1 3.31Å; C244-I248 VanDerWaalsContact O-CG1 3.25Å; C244-I248 WeakPolarHBondContact O-CG1 3.09Å; C244-I248 PolarHBondContact O-N 3.21Å; C244-V290 HydrophobicContact CB-CG1 4.11Å; C244-V290 HydrophobicContact CB-CG2 4.08Å |
| 245 | S | 88.7 | Confident | 88 | Confident | 8 Ų | 8 | 22.5 Ų | 22.5 | 6% | 0.056 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -62.1 | -40.1 | 179.3 | -58.3 | 0 | 0 | 0 | 0 | 111.5 | L241 T242 Y243 R249 | L241-S245 PolarHBondContact O-N 3.08Å; L241-S245 PolarHBondContact O-OG 3.45Å; T242-S245 PolarHBondContact O-N 2.96Å; Y243-S245 VanDerWaalsContact C-N 3.27Å; Y243-S245 PolarHBondContact O-N 2.98Å; S245-R249 WeakPolarHBondContact O-CB 3.47Å; S245-R249 PolarHBondContact O-N 3.33Å |
| 246 | V | 86.5 | Confident | 87.6 | Confident | 15 Ų | 15 | 23.2 Ų | 23.2 | 9% | 0.091 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -67 | -47.2 | 174.7 | -178.3 | 0 | 0 | 0 | 0 | 111 | F201 T242 Y243 C244 I248 R249 V250 F273 A478 | F201-V246 HydrophobicContact CE1-CB 4.11Å; F201-V246 HydrophobicContact CE1-CG1 4.17Å; F201-V246 HydrophobicContact CZ-CB 4.12Å; F201-V246 HydrophobicContact CZ-CG1 3.66Å; T242-V246 PolarHBondContact O-N 3.38Å; Y243-V246 PolarHBondContact O-N 3.23Å; Y243-V246 VanDerWaalsContact O-N 3.15Å; C244-V246 VanDerWaalsContact C-N 3.31Å; C244-V246 PolarHBondContact O-N 2.87Å; V246-I248 VanDerWaalsContact C-N 3.32Å; V246-I248 PolarHBondContact O-N 2.96Å; V246-R249 WeakPolarHBondContact O-CB 2.97Å; V246-R249 PolarHBondContact O-N 3.06Å; V246-R249 VanDerWaalsContact O-N 3.16Å; V246-V250 HydrophobicContact CG1-CG2 4.48Å; V246-V250 VanDerWaalsContact O-CG2 3.31Å; V246-V250 WeakPolarHBondContact O-CG2 3.08Å; V246-V250 PolarHBondContact O-N 3.38Å; V246-F273 HydrophobicContact CG1-CE1 4.41Å; V246-A478 HydrophobicContact CG1-CB 3.91Å |
| 247 | A | 90.3 | Very high | 87.2 | Confident | 0 Ų | 0 | 22.3 Ų | 22.3 | 0% | 0 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -59 | -43.6 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | L197 F201 F215 Y243 C244 V250 S251 | L197-A247 HydrophobicContact CD2-CB 4.28Å; F201-A247 HydrophobicContact CB-CB 4.19Å; F201-A247 HydrophobicContact CD1-CB 3.94Å; F201-A247 HydrophobicContact CE1-CB 4.42Å; F201-A247 HydrophobicContact CG-CB 3.98Å; F215-A247 HydrophobicContact CE1-CB 4.31Å; F215-A247 HydrophobicContact CZ-CB 3.86Å; Y243-A247 PolarHBondContact O-N 3.44Å; C244-A247 PolarHBondContact O-N 3.21Å; A247-V250 PolarHBondContact O-N 3.16Å; A247-S251 VanDerWaalsContact O-CB 3.3Å; A247-S251 WeakPolarHBondContact O-CB 3.16Å; A247-S251 PolarHBondContact O-N 2.82Å; A247-S251 PolarHBondContact O-OG 3.09Å |
| 248 | I | 90.9 | Very high | 86.7 | Confident | 0 Ų | 0 | 30.3 Ų | 30.3 | 0% | 0 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -62.8 | -44.6 | 175.7 | -71.2 | 161.6 | 0 | 0 | 0 | 110.8 | C244 V246 V250 S251 T252 L259 L267 V290 A293 V294 L297 | C244-I248 WeakPolarHBondContact O-CB 3.45Å; C244-I248 WeakPolarHBondContact O-CD1 3.31Å; C244-I248 VanDerWaalsContact O-CG1 3.25Å; C244-I248 WeakPolarHBondContact O-CG1 3.09Å; C244-I248 PolarHBondContact O-N 3.21Å; V246-I248 VanDerWaalsContact C-N 3.32Å; V246-I248 PolarHBondContact O-N 2.96Å; I248-V250 VanDerWaalsContact C-N 3.28Å; I248-V250 PolarHBondContact O-N 2.99Å; I248-S251 PolarHBondContact O-N 3.39Å; I248-T252 HydrophobicContact CG2-CG2 4.1Å; I248-T252 VanDerWaalsContact O-CG2 3.28Å; I248-T252 WeakPolarHBondContact O-CG2 3.18Å; I248-T252 PolarHBondContact O-N 2.89Å; I248-T252 PolarHBondContact O-OG1 3.21Å; I248-L259 HydrophobicContact CG2-CD1 4.16Å; I248-L267 HydrophobicContact CD1-CD1 4.32Å; I248-L267 HydrophobicContact CG2-CD1 3.83Å; I248-V290 HydrophobicContact CD1-CB 4.06Å; I248-V290 HydrophobicContact CD1-CG1 3.93Å; I248-V290 HydrophobicContact CD1-CG2 3.86Å; I248-A293 HydrophobicContact CD1-CB 4.07Å; I248-A293 HydrophobicContact CG1-CB 4.42Å; I248-A293 HydrophobicContact CG2-CB 3.64Å; I248-V294 HydrophobicContact CD1-CG2 4.08Å; I248-V294 HydrophobicContact CG1-CG2 4.25Å; I248-L297 HydrophobicContact CG1-CD1 4.43Å; I248-L297 HydrophobicContact CG2-CD1 4.36Å |
| 249 | R | 86.8 | Confident | 86.4 | Confident | 35 Ų | 35 | 28.2 Ų | 28.2 | 13% | 0.132 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -55.3 | -46.1 | 178.2 | -173.3 | 169.4 | 176.7 | 156.4 | 3.2 | 111.9 | S245 V246 T252 I253 L269 G271 S272 F273 | S245-R249 WeakPolarHBondContact O-CB 3.47Å; S245-R249 PolarHBondContact O-N 3.33Å; V246-R249 WeakPolarHBondContact O-CB 2.97Å; V246-R249 PolarHBondContact O-N 3.06Å; V246-R249 VanDerWaalsContact O-N 3.16Å; R249-T252 PolarHBondContact O-OG1 2.8Å; R249-I253 HydrophobicContact CG-CD1 4.32Å; R249-I253 WeakPolarHBondContact O-CD1 3.26Å; R249-I253 VanDerWaalsContact O-CG1 3.28Å; R249-I253 WeakPolarHBondContact O-CG1 3.15Å; R249-I253 PolarHBondContact O-N 2.67Å; R249-L269 HydrophobicContact CB-CD2 3.51Å; R249-L269 HydrophobicContact CG-CD2 3.8Å; R249-G271 PolarHBondContact NH2-O 2.8Å; R249-S272 PolarHBondContact NH1-O 2.97Å; R249-F273 HydrophobicContact CG-CE1 4.45Å; R249-F273 HydrophobicContact CG-CZ 4.46Å |
| 250 | V | 86.7 | Confident | 86.3 | Confident | 8 Ų | 8 | 27.9 Ų | 27.9 | 5% | 0.048 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -70.2 | -43.7 | -179.2 | -177.5 | 0 | 0 | 0 | 0 | 109.6 | L196 V246 A247 I248 T252 I253 L254 F273 L471 V474 | L196-V250 HydrophobicContact CD1-CB 4.15Å; L196-V250 HydrophobicContact CD1-CG1 3.89Å; L196-V250 HydrophobicContact CD2-CB 4Å; L196-V250 HydrophobicContact CD2-CG1 3.89Å; V246-V250 HydrophobicContact CG1-CG2 4.48Å; V246-V250 VanDerWaalsContact O-CG2 3.31Å; V246-V250 WeakPolarHBondContact O-CG2 3.08Å; V246-V250 PolarHBondContact O-N 3.38Å; A247-V250 PolarHBondContact O-N 3.16Å; I248-V250 VanDerWaalsContact C-N 3.28Å; I248-V250 PolarHBondContact O-N 2.99Å; V250-T252 VanDerWaalsContact C-N 3.32Å; V250-T252 PolarHBondContact O-N 3.04Å; V250-I253 PolarHBondContact O-N 3.2Å; V250-I253 VanDerWaalsContact O-N 3.15Å; V250-L254 HydrophobicContact CG1-CD1 4.07Å; V250-L254 HydrophobicContact CG1-CG 4.3Å; V250-L254 WeakPolarHBondContact O-CG 3.45Å; V250-L254 PolarHBondContact O-N 3.42Å; V250-F273 HydrophobicContact CG2-CE1 4.5Å; V250-F273 HydrophobicContact CG2-CZ 4.47Å; V250-L471 HydrophobicContact CG1-CD2 4.45Å; V250-V474 HydrophobicContact CG2-CG1 3.43Å; V250-V474 VanDerWaalsContact CG2-CG1 3.43Å |
| 251 | S | 89.3 | Confident | 85.7 | Confident | 0 Ų | 0 | 30.8 Ų | 30.8 | 0% | 0 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -59.4 | -39.7 | 177.3 | -59.4 | 0 | 0 | 0 | 0 | 112.7 | F193 A247 I248 L254 L255 | F193-S251 WeakPolarHBondContact CE1-OG 3.47Å; A247-S251 VanDerWaalsContact O-CB 3.3Å; A247-S251 WeakPolarHBondContact O-CB 3.16Å; A247-S251 PolarHBondContact O-N 2.82Å; A247-S251 PolarHBondContact O-OG 3.09Å; I248-S251 PolarHBondContact O-N 3.39Å; S251-L254 PolarHBondContact O-N 3.28Å; S251-L255 PolarHBondContact O-N 3.35Å |
| 252 | T | 86.9 | Confident | 85.3 | Confident | 18 Ų | 18 | 34.2 Ų | 34.2 | 11% | 0.11 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -70.8 | -33.2 | 178.3 | 58.4 | 0 | 0 | 0 | 0 | 112.2 | I248 R249 V250 D256 V257 L259 L297 | I248-T252 HydrophobicContact CG2-CG2 4.1Å; I248-T252 VanDerWaalsContact O-CG2 3.28Å; I248-T252 WeakPolarHBondContact O-CG2 3.18Å; I248-T252 PolarHBondContact O-N 2.89Å; I248-T252 PolarHBondContact O-OG1 3.21Å; R249-T252 PolarHBondContact O-OG1 2.8Å; V250-T252 VanDerWaalsContact C-N 3.32Å; V250-T252 PolarHBondContact O-N 3.04Å; T252-D256 WeakPolarHBondContact O-CA 3.45Å; T252-D256 PolarHBondContact O-N 3.32Å; T252-D256 VanDerWaalsContact O-N 3.08Å; T252-V257 PolarHBondContact O-N 2.96Å; T252-L259 HydrophobicContact CG2-CD1 3.56Å; T252-L259 HydrophobicContact CG2-CD2 4.29Å; T252-L259 HydrophobicContact CG2-CG 3.75Å; T252-L297 HydrophobicContact CG2-CD2 3.98Å |
| 253 | I | 83.6 | Confident | 85.2 | Confident | 112 Ų | 112 | 34.8 Ų | 34.8 | 57% | 0.574 | 18% | 0.181 | S | C | * | . | H | α-helix | trans | -68.9 | -44.8 | 173.5 | -67.4 | 165.8 | 0 | 0 | 0 | 110.2 | R249 V250 L255 D256 | R249-I253 HydrophobicContact CG-CD1 4.32Å; R249-I253 WeakPolarHBondContact O-CD1 3.26Å; R249-I253 VanDerWaalsContact O-CG1 3.28Å; R249-I253 WeakPolarHBondContact O-CG1 3.15Å; R249-I253 PolarHBondContact O-N 2.67Å; V250-I253 PolarHBondContact O-N 3.2Å; V250-I253 VanDerWaalsContact O-N 3.15Å; I253-L255 VanDerWaalsContact C-N 3.32Å; I253-L255 PolarHBondContact O-N 2.9Å; I253-D256 PolarHBondContact O-N 3.04Å |
| 254 | L | 83.3 | Confident | 84.9 | Confident | 27 Ų | 27 | 38 Ų | 38 | 14% | 0.141 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -63.1 | -37.3 | -179.9 | -71.4 | 175.2 | 0 | 0 | 0 | 112.7 | H189 Y192 F193 L196 V250 S251 L471 | H189-L254 PolarHBondContact CE1-O 3.34Å; H189-L254 PolarHBondContact ND1-O 2.86Å; H189-L254 PolarHBondContact NE2-O 3.11Å; Y192-L254 HydrophobicContact CD2-CD2 3.77Å; Y192-L254 HydrophobicContact CG-CD2 4.19Å; F193-L254 HydrophobicContact CD2-CD1 4.43Å; F193-L254 HydrophobicContact CE2-CB 3.92Å; F193-L254 HydrophobicContact CE2-CD1 4.2Å; F193-L254 HydrophobicContact CZ-CB 4.36Å; L196-L254 HydrophobicContact CD2-CD1 4.31Å; V250-L254 HydrophobicContact CG1-CD1 4.07Å; V250-L254 HydrophobicContact CG1-CG 4.3Å; V250-L254 WeakPolarHBondContact O-CG 3.45Å; V250-L254 PolarHBondContact O-N 3.42Å; S251-L254 PolarHBondContact O-N 3.28Å; L254-L471 HydrophobicContact CD1-CD1 4.42Å |
| 255 | L | 79.1 | Confident | 84.5 | Confident | 19 Ų | 19 | 46.3 Ų | 46.3 | 10% | 0.099 | 22% | 0.224 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -94.8 | 1 | -179.5 | -63.1 | -179.6 | 0 | 0 | 0 | 114.3 | F193 S251 I253 V257 L297 R301 Y351 | F193-L255 HydrophobicContact CD2-CD2 4.38Å; F193-L255 HydrophobicContact CE2-CD1 3.86Å; F193-L255 HydrophobicContact CE2-CD2 3.49Å; F193-L255 VanDerWaalsContact CE2-CD2 3.49Å; F193-L255 HydrophobicContact CE2-CG 3.45Å; F193-L255 VanDerWaalsContact CE2-CG 3.45Å; F193-L255 HydrophobicContact CZ-CD1 3.56Å; F193-L255 HydrophobicContact CZ-CD2 4.09Å; F193-L255 HydrophobicContact CZ-CG 3.54Å; S251-L255 PolarHBondContact O-N 3.35Å; I253-L255 VanDerWaalsContact C-N 3.32Å; I253-L255 PolarHBondContact O-N 2.9Å; L255-V257 HydrophobicContact CB-CG2 3.6Å; L255-V257 PolarHBondContact O-N 3.32Å; L255-L297 HydrophobicContact CD1-CD2 3.93Å; L255-R301 HydrophobicContact CD1-CG 3.83Å; L255-Y351 PolarHBondContact O-OH 3.09Å |
| 256 | D | 80.2 | Confident | 84.3 | Confident | 115 Ų | 115 | 48.7 Ų | 48.7 | 62% | 0.615 | 24% | 0.236 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 47.5 | 42.3 | -171.4 | -160.9 | 27.9 | 0 | 0 | 0 | 113.4 | T252 I253 | T252-D256 WeakPolarHBondContact O-CA 3.45Å; T252-D256 PolarHBondContact O-N 3.32Å; T252-D256 VanDerWaalsContact O-N 3.08Å; I253-D256 PolarHBondContact O-N 3.04Å |
| 257 | V | 81.6 | Confident | 84.1 | Confident | 13 Ų | 13 | 48.2 Ų | 48.2 | 8% | 0.079 | 23% | 0.233 | C | C | . | . | trans | -90 | 120.3 | -177.4 | 174.4 | 0 | 0 | 0 | 0 | 110.1 | T252 L255 L259 L297 C300 Y351 | T252-V257 PolarHBondContact O-N 2.96Å; L255-V257 HydrophobicContact CB-CG2 3.6Å; L255-V257 PolarHBondContact O-N 3.32Å; V257-L259 HydrophobicContact CG1-CD2 4.41Å; V257-L259 PolarHBondContact O-N 3.45Å; V257-L297 HydrophobicContact CB-CD2 4.44Å; V257-L297 HydrophobicContact CG2-CD2 4.37Å; V257-C300 HydrophobicContact CG2-CB 4Å; V257-Y351 HydrophobicContact CG2-CE1 4.05Å | ||
| 258 | W | 81 | Confident | 83.6 | Confident | 169 Ų | 169 | 50.8 Ų | 50.8 | 64% | 0.64 | 25% | 0.245 | S | C | * | . | trans | -76.7 | 114.2 | 172.7 | -167.1 | 89.7 | 0 | 0 | 0 | 111.6 | V261 | W258-V261 HydrophobicContact CH2-CG2 4.33Å; W258-V261 HydrophobicContact CZ2-CG2 4.25Å | ||
| 259 | L | 82.1 | Confident | 82.8 | Confident | 3 Ų | 3 | 52 Ų | 52 | 2% | 0.016 | 25% | 0.251 | C | S | . | . | trans | -87.9 | 139.5 | 172.9 | -69 | -177 | 0 | 0 | 0 | 111.9 | I248 T252 V257 I263 R264 L267 L269 A293 L296 | I248-L259 HydrophobicContact CG2-CD1 4.16Å; T252-L259 HydrophobicContact CG2-CD1 3.56Å; T252-L259 HydrophobicContact CG2-CD2 4.29Å; T252-L259 HydrophobicContact CG2-CG 3.75Å; V257-L259 HydrophobicContact CG1-CD2 4.41Å; V257-L259 PolarHBondContact O-N 3.45Å; L259-I263 HydrophobicContact CB-CG2 4.49Å; L259-I263 HydrophobicContact CD1-CG2 4.03Å; L259-R264 HydrophobicContact CB-CG 3.6Å; L259-R264 WeakPolarHBondContact O-CD 3.48Å; L259-R264 PolarHBondContact O-NE 3.42Å; L259-L267 HydrophobicContact CD1-CD1 4.42Å; L259-L269 HydrophobicContact CD1-CD1 3.7Å; L259-A293 HydrophobicContact CD1-CB 4.05Å; L259-A293 HydrophobicContact CD2-CB 4.24Å; L259-L296 HydrophobicContact CD2-CB 4.43Å; L259-L296 HydrophobicContact CD2-CD1 3.89Å | ||
| 260 | P | 85 | Confident | 81.9 | Confident | 33 Ų | 33 | 54.8 Ų | 54.8 | 21% | 0.214 | 27% | 0.272 | C | S | . | . | trans | -47.7 | 142.9 | 170.1 | -29.8 | 34.4 | 0 | 0 | 0 | 113.2 | S262 I263 R264 | P260-S262 PolarHBondContact O-N 3.45Å; P260-I263 HydrophobicContact CB-CD1 4.23Å; P260-I263 HydrophobicContact CB-CG1 4.41Å; P260-I263 HydrophobicContact CG-CD1 4.01Å; P260-I263 PolarHBondContact O-N 3.33Å; P260-R264 PolarHBondContact O-N 2.97Å | ||
| 261 | V | 79.6 | Confident | 80.8 | Confident | 60 Ų | 60 | 56.6 Ų | 56.6 | 36% | 0.364 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -55.7 | -38.8 | -175.2 | 177.2 | 0 | 0 | 0 | 0 | 112.2 | W258 R264 R265 | W258-V261 HydrophobicContact CH2-CG2 4.33Å; W258-V261 HydrophobicContact CZ2-CG2 4.25Å; V261-R264 PolarHBondContact O-N 2.91Å; V261-R265 HydrophobicContact CG1-CG 4.36Å; V261-R265 WeakPolarHBondContact O-CB 3.47Å; V261-R265 VanDerWaalsContact O-CG 3.32Å; V261-R265 WeakPolarHBondContact O-CG 3.33Å; V261-R265 PolarHBondContact O-N 3.16Å |
| 262 | S | 81.6 | Confident | 79.4 | Confident | 73 Ų | 73 | 60.5 Ų | 60.5 | 51% | 0.51 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -61.1 | -45.6 | 177.1 | 48.8 | 0 | 0 | 0 | 0 | 112.4 | P260 R265 N266 | P260-S262 PolarHBondContact O-N 3.45Å; S262-R265 PolarHBondContact O-N 3.43Å; S262-N266 VanDerWaalsContact O-CG 3.29Å; S262-N266 PolarHBondContact O-N 3.46Å |
| 263 | I | 86.1 | Confident | 77.9 | Confident | 14 Ų | 14 | 62.7 Ų | 62.7 | 7% | 0.072 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -65.3 | -46.3 | 177.2 | -64.3 | 173 | 0 | 0 | 0 | 110 | L259 P260 R265 N266 L267 A289 Y292 A293 L296 | L259-I263 HydrophobicContact CB-CG2 4.49Å; L259-I263 HydrophobicContact CD1-CG2 4.03Å; P260-I263 HydrophobicContact CB-CD1 4.23Å; P260-I263 HydrophobicContact CB-CG1 4.41Å; P260-I263 HydrophobicContact CG-CD1 4.01Å; P260-I263 PolarHBondContact O-N 3.33Å; I263-R265 VanDerWaalsContact C-N 3.3Å; I263-R265 PolarHBondContact O-N 3.3Å; I263-N266 PolarHBondContact O-N 3.5Å; I263-L267 HydrophobicContact CG2-CD1 3.73Å; I263-L267 HydrophobicContact CG2-CG 4.3Å; I263-L267 WeakPolarHBondContact O-CB 3.38Å; I263-L267 WeakPolarHBondContact O-CG 3.16Å; I263-L267 PolarHBondContact O-N 2.96Å; I263-A289 HydrophobicContact CG2-CB 4.24Å; I263-Y292 VanDerWaalsContact CD1-CB 3.49Å; I263-Y292 HydrophobicContact CD1-CG 4.19Å; I263-A293 HydrophobicContact CG2-CB 4.12Å; I263-L296 HydrophobicContact CD1-CD1 4.21Å |
| 264 | R | 83 | Confident | 76.4 | Confident | 75 Ų | 75 | 63.7 Ų | 63.7 | 28% | 0.283 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -60.3 | -38 | 178.2 | -70.9 | -168 | -72.3 | 152.5 | -0.4 | 113 | L259 P260 V261 H268 L269 V270 | L259-R264 HydrophobicContact CB-CG 3.6Å; L259-R264 WeakPolarHBondContact O-CD 3.48Å; L259-R264 PolarHBondContact O-NE 3.42Å; P260-R264 PolarHBondContact O-N 2.97Å; V261-R264 PolarHBondContact O-N 2.91Å; R264-H268 PolarHBondContact O-N 3.15Å; R264-L269 HydrophobicContact CB-CB 4.31Å; R264-L269 HydrophobicContact CG-CB 4.48Å; R264-L269 HydrophobicContact CG-CD1 4.3Å; R264-L269 PolarHBondContact O-N 3.22Å; R264-V270 HydrophobicContact CB-CG2 4.06Å |
| 265 | R | 83.1 | Confident | 75.1 | Confident | 175 Ų | 175 | 63.9 Ų | 63.9 | 66% | 0.66 | 34% | 0.338 | S | S | * | . | H | α-helix | trans | -66.8 | -49.1 | 175.8 | -76.5 | 177.4 | -178 | 172.1 | 1.5 | 111.3 | V261 S262 I263 L267 H268 | V261-R265 HydrophobicContact CG1-CG 4.36Å; V261-R265 WeakPolarHBondContact O-CB 3.47Å; V261-R265 VanDerWaalsContact O-CG 3.32Å; V261-R265 WeakPolarHBondContact O-CG 3.33Å; V261-R265 PolarHBondContact O-N 3.16Å; S262-R265 PolarHBondContact O-N 3.43Å; I263-R265 VanDerWaalsContact C-N 3.3Å; I263-R265 PolarHBondContact O-N 3.3Å; R265-L267 VanDerWaalsContact C-N 3.3Å; R265-L267 PolarHBondContact O-N 2.99Å; R265-H268 PolarHBondContact O-N 3.01Å |
| 266 | N | 83.8 | Confident | 74 | Confident | 58 Ų | 58 | 65.8 Ų | 65.8 | 31% | 0.31 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -64.9 | -34.8 | -178.9 | -69.1 | -7.7 | 0 | 0 | 0 | 112.6 | S262 I263 H268 V286 A289 | S262-N266 VanDerWaalsContact O-CG 3.29Å; S262-N266 PolarHBondContact O-N 3.46Å; I263-N266 PolarHBondContact O-N 3.5Å; N266-H268 PolarHBondContact O-N 3.42Å; N266-H268 PolarHBondContact O-ND1 3.05Å; N266-H268 VanDerWaalsContact O-ND1 3.14Å; N266-V286 WeakPolarHBondContact O-CG2 3.25Å; N266-A289 HydrophobicContact CB-CB 3.65Å |
| 267 | L | 82.7 | Confident | 73.3 | Confident | 5 Ų | 5 | 63.2 Ų | 63.2 | 3% | 0.026 | 34% | 0.342 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -83.1 | 3 | 174.8 | -67.1 | -179.7 | 0 | 0 | 0 | 113.4 | I248 L259 I263 R265 L269 V286 A289 V290 A293 | I248-L267 HydrophobicContact CD1-CD1 4.32Å; I248-L267 HydrophobicContact CG2-CD1 3.83Å; L259-L267 HydrophobicContact CD1-CD1 4.42Å; I263-L267 HydrophobicContact CG2-CD1 3.73Å; I263-L267 HydrophobicContact CG2-CG 4.3Å; I263-L267 WeakPolarHBondContact O-CB 3.38Å; I263-L267 WeakPolarHBondContact O-CG 3.16Å; I263-L267 PolarHBondContact O-N 2.96Å; R265-L267 VanDerWaalsContact C-N 3.3Å; R265-L267 PolarHBondContact O-N 2.99Å; L267-L269 HydrophobicContact CB-CD1 3.88Å; L267-L269 HydrophobicContact CB-CD2 4.01Å; L267-L269 HydrophobicContact CB-CG 3.55Å; L267-L269 HydrophobicContact CD1-CD1 3.93Å; L267-L269 PolarHBondContact O-N 3.02Å; L267-L269 VanDerWaalsContact O-N 3.14Å; L267-V286 HydrophobicContact CD2-CG1 4.34Å; L267-A289 HydrophobicContact CD1-CB 4.49Å; L267-A289 HydrophobicContact CD2-CB 3.9Å; L267-A289 HydrophobicContact CG-CB 3.79Å; L267-V290 HydrophobicContact CD2-CB 4.49Å; L267-V290 HydrophobicContact CD2-CG2 3.54Å; L267-A293 HydrophobicContact CD1-CB 3.91Å |
| 268 | H | 78.4 | Confident | 72.5 | Confident | 55 Ų | 55 | 62.9 Ų | 62.9 | 26% | 0.255 | 34% | 0.34 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 52.2 | 36.3 | -178.4 | -59.1 | 84.2 | 0 | 0 | 0 | 113.3 | R264 R265 N266 V270 S275 A276 | R264-H268 PolarHBondContact O-N 3.15Å; R265-H268 PolarHBondContact O-N 3.01Å; N266-H268 PolarHBondContact O-N 3.42Å; N266-H268 PolarHBondContact O-ND1 3.05Å; N266-H268 VanDerWaalsContact O-ND1 3.14Å; H268-V270 VanDerWaalsContact C-N 3.27Å; H268-V270 PolarHBondContact O-N 2.99Å; H268-S275 PolarHBondContact O-OG 3.31Å; H268-A276 WeakPolarHBondContact CB-O 3.45Å; H268-A276 PolarHBondContact CD2-O 2.98Å; H268-A276 VanDerWaalsContact CD2-O 3.24Å |
| 269 | L | 75.4 | Confident | 72 | Confident | 24 Ų | 24 | 60.4 Ų | 60.4 | 13% | 0.126 | 34% | 0.336 | C | S | . | . | trans | -79.8 | -11.8 | -178.7 | -56.9 | -178.3 | 0 | 0 | 0 | 112.8 | R249 L259 R264 L267 | R249-L269 HydrophobicContact CB-CD2 3.51Å; R249-L269 HydrophobicContact CG-CD2 3.8Å; L259-L269 HydrophobicContact CD1-CD1 3.7Å; R264-L269 HydrophobicContact CB-CB 4.31Å; R264-L269 HydrophobicContact CG-CB 4.48Å; R264-L269 HydrophobicContact CG-CD1 4.3Å; R264-L269 PolarHBondContact O-N 3.22Å; L267-L269 HydrophobicContact CB-CD1 3.88Å; L267-L269 HydrophobicContact CB-CD2 4.01Å; L267-L269 HydrophobicContact CB-CG 3.55Å; L267-L269 HydrophobicContact CD1-CD1 3.93Å; L267-L269 PolarHBondContact O-N 3.02Å; L267-L269 VanDerWaalsContact O-N 3.14Å | ||
| 270 | V | 66.7 | Low | 71.3 | Confident | 94 Ų | 94 | 68 Ų | 68 | 57% | 0.57 | 36% | 0.364 | S | S | * | . | S | Bend | trans | -90.3 | 102.4 | 179.2 | -174.7 | 0 | 0 | 0 | 0 | 108.7 | R264 H268 | R264-V270 HydrophobicContact CB-CG2 4.06Å; H268-V270 VanDerWaalsContact C-N 3.27Å; H268-V270 PolarHBondContact O-N 2.99Å |
| 271 | G | 64.4 | Low | 70.5 | Confident | 47 Ų | 47 | 73.4 Ų | 73.4 | 49% | 0.485 | 39% | 0.391 | S | S | . | . | S | Bend | trans | 137.5 | -173 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | R249 | R249-G271 PolarHBondContact NH2-O 2.8Š|
| 272 | S | 59 | Low | 70.6 | Confident | 81 Ų | 81 | 72.6 Ų | 72.6 | 57% | 0.566 | 39% | 0.385 | S | S | * | . | trans | -61.9 | 158.5 | 170 | 49.5 | 0 | 0 | 0 | 0 | 111.3 | R249 L274 S275 | R249-S272 PolarHBondContact NH1-O 2.97Å; S272-L274 PolarHBondContact O-N 3.03Å; S272-S275 PolarHBondContact O-N 3Å; S272-S275 PolarHBondContact O-OG 2.98Å | ||
| 273 | F | 57.2 | Low | 70.7 | Confident | 65 Ų | 65 | 69.4 Ų | 69.4 | 29% | 0.285 | 36% | 0.362 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -52.8 | -23 | 175 | -93 | -88.5 | 0 | 0 | 0 | 113.7 | V246 R249 V250 I481 | V246-F273 HydrophobicContact CG1-CE1 4.41Å; R249-F273 HydrophobicContact CG-CE1 4.45Å; R249-F273 HydrophobicContact CG-CZ 4.46Å; V250-F273 HydrophobicContact CG2-CE1 4.5Å; V250-F273 HydrophobicContact CG2-CZ 4.47Å; F273-I481 HydrophobicContact CB-CD1 4.13Å; F273-I481 WeakPolarHBondContact O-CD1 3.43Å |
| 274 | L | 51.7 | Low | 70.7 | Confident | 132 Ų | 132 | 70.2 Ų | 70.2 | 69% | 0.691 | 37% | 0.373 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.9 | 2.5 | 179.8 | -53.7 | 179.2 | 0 | 0 | 0 | 114.8 | S272 I481 | S272-L274 PolarHBondContact O-N 3.03Å; L274-I481 HydrophobicContact CD2-CD1 3.94Å; L274-I481 HydrophobicContact CD2-CG1 3.54Å |
| 275 | S | 54.7 | Low | 71 | Confident | 32 Ų | 32 | 74 Ų | 74 | 22% | 0.224 | 39% | 0.388 | C | S | . | . | S | Bend | trans | -64.3 | 149.3 | 177.3 | 51.4 | 0 | 0 | 0 | 0 | 111.2 | H268 S272 L277 | H268-S275 PolarHBondContact O-OG 3.31Å; S272-S275 PolarHBondContact O-N 3Å; S272-S275 PolarHBondContact O-OG 2.98Å; S275-L277 PolarHBondContact O-N 3.4Å |
| 276 | A | 57.3 | Low | 71.3 | Confident | 59 Ų | 59 | 65.8 Ų | 65.8 | 49% | 0.488 | 36% | 0.357 | S | S | . | . | trans | -36.7 | 118.9 | -169.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | H268 | H268-A276 WeakPolarHBondContact CB-O 3.45Å; H268-A276 PolarHBondContact CD2-O 2.98Å; H268-A276 VanDerWaalsContact CD2-O 3.24Å | ||
| 277 | L | 64.6 | Low | 71.7 | Confident | 60 Ų | 60 | 63 Ų | 63 | 31% | 0.314 | 34% | 0.342 | S | S | . | . | trans | -58.1 | 157 | 172.5 | -66.1 | 169.3 | 0 | 0 | 0 | 109.8 | T242 S275 Q279 I481 | T242-L277 HydrophobicContact CG2-CB 4.38Å; T242-L277 HydrophobicContact CG2-CD1 4.45Å; T242-L277 HydrophobicContact CG2-CD2 3.35Å; T242-L277 HydrophobicContact CG2-CG 4.25Å; S275-L277 PolarHBondContact O-N 3.4Å; L277-Q279 PolarHBondContact O-N 3.2Å; L277-I481 HydrophobicContact CD1-CG2 3.89Å; L277-I481 HydrophobicContact CD2-CG2 3.4Å; L277-I481 VanDerWaalsContact CD2-CG2 3.4Å; L277-I481 HydrophobicContact CG-CG2 3.93Å | ||
| 278 | P | 64.9 | Low | 72 | Confident | 7 Ų | 7 | 66.2 Ų | 66.2 | 5% | 0.045 | 36% | 0.356 | C | S | . | . | trans | -40.7 | 128.8 | 167.7 | -31.8 | 38.5 | 0 | 0 | 0 | 110.3 | H238 V286 | H238-P278 PolarHBondContact NE2-O 3.12Å; P278-V286 HydrophobicContact CB-CG1 4.24Å; P278-V286 HydrophobicContact CB-CG2 3.95Å; P278-V286 HydrophobicContact CG-CG1 3.96Å; P278-V286 HydrophobicContact CG-CG2 4.28Å | ||
| 279 | Q | 71.1 | Confident | 72.6 | Confident | 116 Ų | 116 | 63.7 Ų | 63.7 | 54% | 0.542 | 35% | 0.345 | S | S | . | . | trans | -87.7 | 155.3 | 170.9 | -66.5 | -173 | -3.6 | 0 | 0 | 109.2 | L277 D281 D282 M283 | L277-Q279 PolarHBondContact O-N 3.2Å; Q279-D281 PolarHBondContact O-N 3.48Å; Q279-D281 VanDerWaalsContact O-N 3.14Å; Q279-D282 PolarHBondContact O-N 3.16Å; Q279-M283 PolarHBondContact O-N 3.12Å | ||
| 280 | R | 66.4 | Low | 73.5 | Confident | 162 Ų | 162 | 62.6 Ų | 62.6 | 61% | 0.611 | 34% | 0.339 | S | S | * | . | G | 310 helix | trans | -55.1 | -34.2 | -179.9 | -168.1 | 179.4 | -176.8 | -176.5 | -0.6 | 112.2 | P233 D282 M283 | P233-R280 PolarHBondContact O-NE 3.48Å; P233-R280 PolarHBondContact O-NH2 3.16Å; R280-D282 VanDerWaalsContact C-N 3.34Å; R280-M283 WeakPolarHBondContact O-CB 3.42Å; R280-M283 WeakPolarHBondContact O-CG 3.43Å |
| 281 | D | 69.1 | Low | 74.7 | Confident | 147 Ų | 147 | 58.3 Ų | 58.3 | 79% | 0.786 | 31% | 0.313 | S | S | * | . | G | 310 helix | trans | -77.3 | -19.2 | -177 | -57.6 | -23.3 | 0 | 0 | 0 | 113.3 | Q279 | Q279-D281 PolarHBondContact O-N 3.48Å; Q279-D281 VanDerWaalsContact O-N 3.14Å |
| 282 | D | 81 | Confident | 75.9 | Confident | 43 Ų | 43 | 60 Ų | 60 | 23% | 0.23 | 31% | 0.305 | C | S | . | . | G | 310 helix | trans | -100.3 | 4.8 | 179.9 | -76.9 | -47.6 | 0 | 0 | 0 | 113.3 | Q279 R280 G284 R285 V286 | Q279-D282 PolarHBondContact O-N 3.16Å; R280-D282 VanDerWaalsContact C-N 3.34Å; D282-G284 VanDerWaalsContact C-N 3.28Å; D282-G284 PolarHBondContact O-N 2.94Å; D282-G284 VanDerWaalsContact O-N 3.15Å; D282-R285 PolarHBondContact O-N 3.48Å; D282-R285 IonicContact OD1-NH1 3.26Å; D282-R285 PolarHBondContact OD1-NH1 3.19Å; D282-V286 HydrophobicContact CB-CG2 4.4Å; D282-V286 WeakPolarHBondContact O-CG2 3.34Å; D282-V286 PolarHBondContact O-N 3.1Å |
| 283 | M | 83.5 | Confident | 77.5 | Confident | 7 Ų | 7 | 56.1 Ų | 56.1 | 3% | 0.034 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -49 | -44.8 | -175.8 | -82 | -67.8 | -69.1 | 0 | 0 | 113.8 | P231 S237 H238 L241 Q279 R280 V286 Y287 | P231-M283 HydrophobicContact CB-CE 4.5Å; P231-M283 HydrophobicContact CG-CE 3.95Å; S237-M283 VanDerWaalsContact C-CE 3.47Å; H238-M283 VanDerWaalsContact CA-CE 3.47Å; H238-M283 VanDerWaalsContact CA-SD 3.54Å; H238-M283 HydrophobicContact CB-CE 4.09Å; H238-M283 HydrophobicContact CB-SD 3.81Å; L241-M283 HydrophobicContact CB-CE 4.46Å; L241-M283 HydrophobicContact CD1-CE 3.4Å; L241-M283 HydrophobicContact CD1-SD 3.77Å; L241-M283 HydrophobicContact CG-CE 3.95Å; Q279-M283 PolarHBondContact O-N 3.12Å; R280-M283 WeakPolarHBondContact O-CB 3.42Å; R280-M283 WeakPolarHBondContact O-CG 3.43Å; M283-V286 PolarHBondContact O-N 3.44Å; M283-Y287 VanDerWaalsContact O-CB 3.26Å; M283-Y287 WeakPolarHBondContact O-CB 3.47Å; M283-Y287 PolarHBondContact O-N 2.98Å |
| 284 | G | 87.2 | Confident | 79.2 | Confident | 30 Ų | 30 | 53 Ų | 53 | 31% | 0.309 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -61.8 | -45.4 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | D282 V286 Y287 F288 | D282-G284 VanDerWaalsContact C-N 3.28Å; D282-G284 PolarHBondContact O-N 2.94Å; D282-G284 VanDerWaalsContact O-N 3.15Å; G284-V286 PolarHBondContact O-N 2.92Å; G284-Y287 PolarHBondContact O-N 3Å; G284-F288 WeakPolarHBondContact O-CD2 3.43Å; G284-F288 PolarHBondContact O-N 3.42Å |
| 285 | R | 88 | Confident | 81 | Confident | 156 Ų | 156 | 49 Ų | 49 | 59% | 0.589 | 24% | 0.242 | S | C | * | . | H | α-helix | trans | -65.7 | -40.9 | 179.8 | -67.1 | 177.1 | 177.3 | 168.4 | -3.4 | 112 | D282 A289 | D282-R285 PolarHBondContact O-N 3.48Å; D282-R285 IonicContact OD1-NH1 3.26Å; D282-R285 PolarHBondContact OD1-NH1 3.19Å; R285-A289 WeakPolarHBondContact O-CB 3.48Å; R285-A289 PolarHBondContact O-N 3.22Å |
| 286 | V | 89.5 | Confident | 82.6 | Confident | 1 Ų | 1 | 48 Ų | 48 | 1% | 0.006 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -63.3 | -48.1 | 176.3 | 175.4 | 0 | 0 | 0 | 0 | 109.4 | L241 N266 L267 P278 D282 M283 G284 F288 A289 V290 | L241-V286 HydrophobicContact CB-CG1 4.24Å; L241-V286 HydrophobicContact CD1-CB 4.47Å; L241-V286 HydrophobicContact CD1-CG1 4.24Å; N266-V286 WeakPolarHBondContact O-CG2 3.25Å; L267-V286 HydrophobicContact CD2-CG1 4.34Å; P278-V286 HydrophobicContact CB-CG1 4.24Å; P278-V286 HydrophobicContact CB-CG2 3.95Å; P278-V286 HydrophobicContact CG-CG1 3.96Å; P278-V286 HydrophobicContact CG-CG2 4.28Å; D282-V286 HydrophobicContact CB-CG2 4.4Å; D282-V286 WeakPolarHBondContact O-CG2 3.34Å; D282-V286 PolarHBondContact O-N 3.1Å; M283-V286 PolarHBondContact O-N 3.44Å; G284-V286 PolarHBondContact O-N 2.92Å; V286-F288 PolarHBondContact O-N 3.47Å; V286-A289 CarbonylContact O-C 3.56Å; V286-A289 WeakPolarHBondContact O-CB 3.26Å; V286-A289 PolarHBondContact O-N 3.34Å; V286-A289 VanDerWaalsContact O-N 3.12Å; V286-V290 HydrophobicContact CG1-CG2 4.35Å; V286-V290 WeakPolarHBondContact O-CG2 3.25Å; V286-V290 PolarHBondContact O-N 3.47Å |
| 287 | Y | 92.1 | Very high | 84.1 | Confident | 0 Ų | 0 | 45.1 Ų | 45.1 | 0% | 0 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -56.8 | -48.3 | 177.3 | 172.6 | -104.6 | 0 | 0 | 0 | 112.8 | I222 I227 P231 L241 M283 G284 A289 V290 I291 P326 | I222-Y287 HydrophobicContact CG2-CE2 3.89Å; I227-Y287 WeakPolarHBondContact CG2-OH 3.39Å; I227-Y287 WeakPolarHBondContact O-CE1 3.34Å; I227-Y287 PolarHBondContact O-OH 3.44Å; P231-Y287 HydrophobicContact CG-CD2 4.38Å; P231-Y287 HydrophobicContact CG-CG 4.21Å; L241-Y287 HydrophobicContact CD2-CD2 4.11Å; M283-Y287 VanDerWaalsContact O-CB 3.26Å; M283-Y287 WeakPolarHBondContact O-CB 3.47Å; M283-Y287 PolarHBondContact O-N 2.98Å; G284-Y287 PolarHBondContact O-N 3Å; Y287-A289 VanDerWaalsContact C-N 3.33Å; Y287-A289 PolarHBondContact O-N 3.42Å; Y287-V290 WeakPolarHBondContact O-CB 3.48Å; Y287-V290 PolarHBondContact O-N 3.4Å; Y287-I291 HydrophobicContact CD1-CD1 3.96Å; Y287-I291 HydrophobicContact CE1-CD1 3.39Å; Y287-I291 HydrophobicContact CE1-CG1 4.36Å; Y287-I291 HydrophobicContact CE2-CD1 4.25Å; Y287-I291 HydrophobicContact CE2-CG1 4.48Å; Y287-I291 WeakPolarHBondContact O-CG1 3.17Å; Y287-I291 PolarHBondContact O-N 3.49Å; Y287-P326 HydrophobicContact CD2-CG 4.32Å; Y287-P326 HydrophobicContact CE2-CG 3.8Å |
| 288 | F | 90.9 | Very high | 85.2 | Confident | 72 Ų | 72 | 42.4 Ų | 42.4 | 32% | 0.316 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -61.3 | -42.8 | 175.4 | -75.8 | -67.4 | 0 | 0 | 0 | 111.8 | F228 G284 V286 V290 I291 Y292 | F228-F288 HydrophobicContact CB-CE1 4.24Å; F228-F288 HydrophobicContact CB-CZ 4.49Å; F228-F288 AromaticContact CD1-CE1 3.97Å; F228-F288 HydrophobicContact CD1-CE1 3.97Å; F228-F288 VanDerWaalsContact O-CZ 3.25Å; F228-F288 WeakPolarHBondContact O-CZ 3.45Å; G284-F288 WeakPolarHBondContact O-CD2 3.43Å; G284-F288 PolarHBondContact O-N 3.42Å; V286-F288 PolarHBondContact O-N 3.47Å; F288-V290 VanDerWaalsContact C-N 3.29Å; F288-V290 PolarHBondContact O-N 3.27Å; F288-I291 HydrophobicContact CD1-CD1 4.46Å; F288-I291 WeakPolarHBondContact O-CB 3.27Å; F288-I291 PolarHBondContact O-N 2.94Å; F288-Y292 HydrophobicContact CB-CE2 4.36Å; F288-Y292 WeakPolarHBondContact O-CD2 3.45Å; F288-Y292 PolarHBondContact O-N 3.24Å |
| 289 | A | 90.7 | Very high | 86.1 | Confident | 3 Ų | 3 | 45.1 Ų | 45.1 | 3% | 0.025 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -62.6 | -36.7 | 177 | 0 | 0 | 0 | 0 | 0 | 112.4 | I263 N266 L267 R285 V286 Y287 Y292 A293 | I263-A289 HydrophobicContact CG2-CB 4.24Å; N266-A289 HydrophobicContact CB-CB 3.65Å; L267-A289 HydrophobicContact CD1-CB 4.49Å; L267-A289 HydrophobicContact CD2-CB 3.9Å; L267-A289 HydrophobicContact CG-CB 3.79Å; R285-A289 WeakPolarHBondContact O-CB 3.48Å; R285-A289 PolarHBondContact O-N 3.22Å; V286-A289 CarbonylContact O-C 3.56Å; V286-A289 WeakPolarHBondContact O-CB 3.26Å; V286-A289 PolarHBondContact O-N 3.34Å; V286-A289 VanDerWaalsContact O-N 3.12Å; Y287-A289 VanDerWaalsContact C-N 3.33Å; Y287-A289 PolarHBondContact O-N 3.42Å; A289-Y292 PolarHBondContact O-N 3.5Å; A289-A293 WeakPolarHBondContact O-CB 3.03Å; A289-A293 PolarHBondContact O-N 2.82Å |
| 290 | V | 93.2 | Very high | 86.4 | Confident | 0 Ų | 0 | 40.4 Ų | 40.4 | 0% | 0 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -61.2 | -48.5 | 172.3 | 165.1 | 0 | 0 | 0 | 0 | 110.2 | C244 I248 L267 V286 Y287 F288 Y292 A293 V294 P326 | C244-V290 HydrophobicContact CB-CG1 4.11Å; C244-V290 HydrophobicContact CB-CG2 4.08Å; I248-V290 HydrophobicContact CD1-CB 4.06Å; I248-V290 HydrophobicContact CD1-CG1 3.93Å; I248-V290 HydrophobicContact CD1-CG2 3.86Å; L267-V290 HydrophobicContact CD2-CB 4.49Å; L267-V290 HydrophobicContact CD2-CG2 3.54Å; V286-V290 HydrophobicContact CG1-CG2 4.35Å; V286-V290 WeakPolarHBondContact O-CG2 3.25Å; V286-V290 PolarHBondContact O-N 3.47Å; Y287-V290 WeakPolarHBondContact O-CB 3.48Å; Y287-V290 PolarHBondContact O-N 3.4Å; F288-V290 VanDerWaalsContact C-N 3.29Å; F288-V290 PolarHBondContact O-N 3.27Å; V290-Y292 PolarHBondContact O-N 3.4Å; V290-A293 PolarHBondContact O-N 2.93Å; V290-V294 HydrophobicContact CG1-CG2 4.3Å; V290-V294 WeakPolarHBondContact O-CB 3.01Å; V290-V294 VanDerWaalsContact O-CG2 3.27Å; V290-V294 WeakPolarHBondContact O-CG2 3.15Å; V290-V294 PolarHBondContact O-N 3.34Å; V290-P326 HydrophobicContact CG1-CB 3.55Å; V290-P326 HydrophobicContact CG1-CG 4.03Å |
| 291 | I | 92.6 | Very high | 87 | Confident | 5 Ų | 5 | 33.4 Ų | 33.4 | 3% | 0.026 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -52.8 | -54.1 | 175.6 | -69.1 | 173.3 | 0 | 0 | 0 | 110.5 | I227 Y287 F288 A293 V294 H295 P326 | I227-I291 HydrophobicContact CG2-CD1 4.45Å; Y287-I291 HydrophobicContact CD1-CD1 3.96Å; Y287-I291 HydrophobicContact CE1-CD1 3.39Å; Y287-I291 HydrophobicContact CE1-CG1 4.36Å; Y287-I291 HydrophobicContact CE2-CD1 4.25Å; Y287-I291 HydrophobicContact CE2-CG1 4.48Å; Y287-I291 WeakPolarHBondContact O-CG1 3.17Å; Y287-I291 PolarHBondContact O-N 3.49Å; F288-I291 HydrophobicContact CD1-CD1 4.46Å; F288-I291 WeakPolarHBondContact O-CB 3.27Å; F288-I291 PolarHBondContact O-N 2.94Å; I291-A293 PolarHBondContact O-N 2.83Å; I291-V294 PolarHBondContact O-N 2.63Å; I291-H295 PolarHBondContact O-N 3.28Å; I291-H295 PolarHBondContact O-ND1 3.25Å; I291-P326 HydrophobicContact CG1-CB 4.15Å; I291-P326 HydrophobicContact CG1-CG 4.03Å |
| 292 | Y | 90.2 | Very high | 87.4 | Confident | 82 Ų | 82 | 28.6 Ų | 28.6 | 32% | 0.322 | 15% | 0.147 | S | C | . | . | H | α-helix | trans | -61.2 | -45.4 | -177.6 | -72.7 | -68.2 | 0 | 0 | 0 | 112.6 | I263 F288 A289 V290 H295 L296 F359 | I263-Y292 VanDerWaalsContact CD1-CB 3.49Å; I263-Y292 HydrophobicContact CD1-CG 4.19Å; F288-Y292 HydrophobicContact CB-CE2 4.36Å; F288-Y292 WeakPolarHBondContact O-CD2 3.45Å; F288-Y292 PolarHBondContact O-N 3.24Å; A289-Y292 PolarHBondContact O-N 3.5Å; V290-Y292 PolarHBondContact O-N 3.4Å; Y292-H295 PolarHBondContact O-N 2.9Å; Y292-L296 WeakPolarHBondContact O-CB 3.35Å; Y292-L296 WeakPolarHBondContact O-CG 3.09Å; Y292-L296 PolarHBondContact O-N 2.92Å; Y292-F359 AromaticContact CE1-CD1 3.44Å; Y292-F359 HydrophobicContact CE1-CD1 3.44Å; Y292-F359 VanDerWaalsContact CE1-CD1 3.44Å; Y292-F359 HydrophobicContact CE1-CD2 4.06Å; Y292-F359 AromaticContact CE1-CE1 3.42Å; Y292-F359 HydrophobicContact CE1-CE1 3.42Å; Y292-F359 VanDerWaalsContact CE1-CE1 3.42Å; Y292-F359 HydrophobicContact CE1-CE2 4.03Å; Y292-F359 AromaticContact CE1-CG 3.76Å; Y292-F359 HydrophobicContact CE1-CG 3.76Å; Y292-F359 AromaticContact CE1-CZ 3.71Å; Y292-F359 HydrophobicContact CE1-CZ 3.71Å; Y292-F359 AromaticContact CZ-CD1 3.84Å; Y292-F359 AromaticContact CZ-CE1 3.65Å; Y292-F359 VanDerWaalsContact OH-CD1 3.31Å; Y292-F359 WeakPolarHBondContact OH-CD1 3.29Å; Y292-F359 WeakPolarHBondContact OH-CE1 3.37Å |
| 293 | A | 92 | Very high | 87.5 | Confident | 0 Ų | 0 | 27.1 Ų | 27.1 | 0% | 0 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -64.7 | -43 | -178.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | I248 L259 I263 L267 A289 V290 I291 L296 L297 | I248-A293 HydrophobicContact CD1-CB 4.07Å; I248-A293 HydrophobicContact CG1-CB 4.42Å; I248-A293 HydrophobicContact CG2-CB 3.64Å; L259-A293 HydrophobicContact CD1-CB 4.05Å; L259-A293 HydrophobicContact CD2-CB 4.24Å; I263-A293 HydrophobicContact CG2-CB 4.12Å; L267-A293 HydrophobicContact CD1-CB 3.91Å; A289-A293 WeakPolarHBondContact O-CB 3.03Å; A289-A293 PolarHBondContact O-N 2.82Å; V290-A293 PolarHBondContact O-N 2.93Å; I291-A293 PolarHBondContact O-N 2.83Å; A293-L296 WeakPolarHBondContact O-CB 3.5Å; A293-L296 PolarHBondContact O-N 3.28Å; A293-L297 VanDerWaalsContact O-CG 3.24Å; A293-L297 WeakPolarHBondContact O-CG 3.25Å; A293-L297 PolarHBondContact O-N 3.27Å |
| 294 | V | 92.8 | Very high | 87.6 | Confident | 0 Ų | 0 | 30.9 Ų | 30.9 | 0% | 0 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -62.5 | -45.6 | 177.5 | 172.2 | 0 | 0 | 0 | 0 | 110.9 | I248 V290 I291 L296 L297 C298 P326 G329 L330 L333 | I248-V294 HydrophobicContact CD1-CG2 4.08Å; I248-V294 HydrophobicContact CG1-CG2 4.25Å; V290-V294 HydrophobicContact CG1-CG2 4.3Å; V290-V294 WeakPolarHBondContact O-CB 3.01Å; V290-V294 VanDerWaalsContact O-CG2 3.27Å; V290-V294 WeakPolarHBondContact O-CG2 3.15Å; V290-V294 PolarHBondContact O-N 3.34Å; I291-V294 PolarHBondContact O-N 2.63Å; V294-L296 VanDerWaalsContact C-N 3.33Å; V294-L296 PolarHBondContact O-N 3.15Å; V294-L297 PolarHBondContact O-N 3.32Å; V294-L297 VanDerWaalsContact O-N 3.16Å; V294-C298 PolarHBondContact O-N 2.72Å; V294-C298 PolarHBondContact O-SG 3.04Å; V294-P326 HydrophobicContact CG2-CB 4.37Å; V294-G329 VanDerWaalsContact CG1-CA 3.5Å; V294-L330 HydrophobicContact CG1-CG 4.35Å; V294-L330 HydrophobicContact CG2-CD1 4.33Å; V294-L330 HydrophobicContact CG2-CD2 3.85Å; V294-L330 HydrophobicContact CG2-CG 3.8Å; V294-L333 HydrophobicContact CG1-CD1 4.41Å |
| 295 | H | 89.6 | Confident | 87.6 | Confident | 47 Ų | 47 | 30.1 Ų | 30.1 | 22% | 0.218 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -64 | -39 | 178.4 | -74.8 | 73.1 | 0 | 0 | 0 | 112.1 | I291 Y292 C298 Q299 L323 Y324 | I291-H295 PolarHBondContact O-N 3.28Å; I291-H295 PolarHBondContact O-ND1 3.25Å; Y292-H295 PolarHBondContact O-N 2.9Å; H295-C298 PolarHBondContact O-N 3.08Å; H295-Q299 WeakPolarHBondContact O-CB 3.45Å; H295-Q299 PolarHBondContact O-N 2.77Å; H295-L323 PolarHBondContact NE2-O 3.07Å; H295-Y324 AromaticContact CE1-CD1 3.93Å; H295-Y324 AromaticContact NE2-CD1 3.51Å |
| 296 | L | 88.2 | Confident | 87.5 | Confident | 10 Ų | 10 | 27.2 Ų | 27.2 | 5% | 0.052 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -60 | -47.2 | 172.2 | -84.9 | 159.2 | 0 | 0 | 0 | 111.1 | L259 I263 Y292 A293 V294 Q299 C300 I353 | L259-L296 HydrophobicContact CD2-CB 4.43Å; L259-L296 HydrophobicContact CD2-CD1 3.89Å; I263-L296 HydrophobicContact CD1-CD1 4.21Å; Y292-L296 WeakPolarHBondContact O-CB 3.35Å; Y292-L296 WeakPolarHBondContact O-CG 3.09Å; Y292-L296 PolarHBondContact O-N 2.92Å; A293-L296 WeakPolarHBondContact O-CB 3.5Å; A293-L296 PolarHBondContact O-N 3.28Å; V294-L296 VanDerWaalsContact C-N 3.33Å; V294-L296 PolarHBondContact O-N 3.15Å; L296-Q299 PolarHBondContact O-N 3.42Å; L296-C300 WeakPolarHBondContact O-CB 3.25Å; L296-C300 PolarHBondContact O-N 3.27Å; L296-C300 PolarHBondContact O-SG 3.01Å; L296-I353 HydrophobicContact CD2-CD1 3.81Å; L296-I353 HydrophobicContact CD2-CG1 4.25Å; L296-I353 HydrophobicContact CD2-CG2 4.22Å |
| 297 | L | 88.6 | Confident | 87.2 | Confident | 0 Ų | 0 | 30.4 Ų | 30.4 | 0% | 0 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -62 | -45.5 | 178.4 | -69.7 | 167.5 | 0 | 0 | 0 | 111.8 | I248 T252 L255 V257 A293 V294 Q299 C300 R301 L333 | I248-L297 HydrophobicContact CG1-CD1 4.43Å; I248-L297 HydrophobicContact CG2-CD1 4.36Å; T252-L297 HydrophobicContact CG2-CD2 3.98Å; L255-L297 HydrophobicContact CD1-CD2 3.93Å; V257-L297 HydrophobicContact CB-CD2 4.44Å; V257-L297 HydrophobicContact CG2-CD2 4.37Å; A293-L297 VanDerWaalsContact O-CG 3.24Å; A293-L297 WeakPolarHBondContact O-CG 3.25Å; A293-L297 PolarHBondContact O-N 3.27Å; V294-L297 PolarHBondContact O-N 3.32Å; V294-L297 VanDerWaalsContact O-N 3.16Å; L297-Q299 PolarHBondContact O-N 2.86Å; L297-C300 WeakPolarHBondContact O-CB 3.3Å; L297-C300 PolarHBondContact O-N 3.48Å; L297-R301 PolarHBondContact O-N 3.39Å; L297-R301 VanDerWaalsContact O-N 3.09Å; L297-L333 HydrophobicContact CB-CD1 3.86Å |
| 298 | C | 87.8 | Confident | 86.8 | Confident | 2 Ų | 2 | 30.5 Ų | 30.5 | 1% | 0.014 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -57.9 | -47.7 | 174.2 | -66.6 | 0 | 0 | 0 | 0 | 111.3 | V294 H295 C300 R301 G302 I303 I305 | V294-C298 PolarHBondContact O-N 2.72Å; V294-C298 PolarHBondContact O-SG 3.04Å; H295-C298 PolarHBondContact O-N 3.08Å; C298-C300 VanDerWaalsContact C-N 3.33Å; C298-C300 PolarHBondContact O-N 3.22Å; C298-R301 CarbonylContact O-C 3.59Å; C298-R301 PolarHBondContact O-N 2.96Å; C298-R301 VanDerWaalsContact O-N 3.11Å; C298-G302 PolarHBondContact O-N 3.14Å; C298-I303 HydrophobicContact CB-CB 4.26Å; C298-I303 PolarHBondContact O-N 2.71Å; C298-I305 HydrophobicContact CB-CD1 4.4Å; C298-I305 HydrophobicContact CB-CG1 4.16Å |
| 299 | Q | 83.2 | Confident | 86.6 | Confident | 65 Ų | 65 | 27.1 Ų | 27.1 | 30% | 0.304 | 14% | 0.142 | S | C | . | . | H | α-helix | trans | -63.5 | -39.1 | 178.9 | -171.8 | 174.5 | 18.5 | 0 | 0 | 112 | H295 L296 L297 R301 G302 K354 | H295-Q299 WeakPolarHBondContact O-CB 3.45Å; H295-Q299 PolarHBondContact O-N 2.77Å; L296-Q299 PolarHBondContact O-N 3.42Å; L297-Q299 PolarHBondContact O-N 2.86Å; Q299-R301 PolarHBondContact O-N 3.34Å; Q299-G302 PolarHBondContact O-N 3.06Å; Q299-K354 PolarHBondContact NE2-O 2.88Å |
| 300 | C | 78.7 | Confident | 86.4 | Confident | 17 Ų | 17 | 31.6 Ų | 31.6 | 12% | 0.115 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -61 | -34.1 | 175.2 | -69.6 | 0 | 0 | 0 | 0 | 112 | V257 L296 L297 C298 G302 Y351 | V257-C300 HydrophobicContact CG2-CB 4Å; L296-C300 WeakPolarHBondContact O-CB 3.25Å; L296-C300 PolarHBondContact O-N 3.27Å; L296-C300 PolarHBondContact O-SG 3.01Å; L297-C300 WeakPolarHBondContact O-CB 3.3Å; L297-C300 PolarHBondContact O-N 3.48Å; C298-C300 VanDerWaalsContact C-N 3.33Å; C298-C300 PolarHBondContact O-N 3.22Å; C300-G302 VanDerWaalsContact C-N 3.35Å; C300-Y351 HydrophobicContact CB-CD1 4.42Å; C300-Y351 HydrophobicContact CB-CE1 3.84Å; C300-Y351 WeakPolarHBondContact SG-CD1 3.35Å; C300-Y351 WeakPolarHBondContact SG-CE1 3.34Å |
| 301 | R | 79.1 | Confident | 85.9 | Confident | 15 Ų | 15 | 38.3 Ų | 38.3 | 6% | 0.057 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -85.2 | -4.5 | 175.2 | -70.1 | -66.9 | -75.1 | 95.4 | -3.2 | 113.9 | D190 L255 L297 C298 Q299 I303 L333 V337 N340 | D190-R301 IonicContact OD1-CZ 3.39Å; D190-R301 IonicContact OD1-NE 2.7Å; D190-R301 IonicContact OD1-NH2 3.18Å; D190-R301 PolarHBondContact OD1-NH2 3.32Å; D190-R301 IonicContact OD2-NH2 3.93Å; L255-R301 HydrophobicContact CD1-CG 3.83Å; L297-R301 PolarHBondContact O-N 3.39Å; L297-R301 VanDerWaalsContact O-N 3.09Å; C298-R301 CarbonylContact O-C 3.59Å; C298-R301 PolarHBondContact O-N 2.96Å; C298-R301 VanDerWaalsContact O-N 3.11Å; Q299-R301 PolarHBondContact O-N 3.34Å; R301-I303 VanDerWaalsContact C-N 3.33Å; R301-I303 HydrophobicContact CB-CD1 3.88Å; R301-I303 HydrophobicContact CB-CG1 3.98Å; R301-L333 HydrophobicContact CB-CD2 4.45Å; R301-L333 HydrophobicContact CG-CD2 4.1Å; R301-V337 PolarHBondContact NH2-O 2.86Å; R301-V337 VanDerWaalsContact NH2-O 3.08Å; R301-N340 PolarHBondContact O-ND2 2.89Å |
| 302 | G | 77.5 | Confident | 85.5 | Confident | 45 Ų | 45 | 40.6 Ų | 40.6 | 46% | 0.464 | 21% | 0.206 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 69.2 | 31.4 | -174.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | C298 Q299 C300 N340 | C298-G302 PolarHBondContact O-N 3.14Å; Q299-G302 PolarHBondContact O-N 3.06Å; C300-G302 VanDerWaalsContact C-N 3.35Å; G302-N340 PolarHBondContact O-ND2 3.47Å |
| 303 | I | 83.5 | Confident | 85.1 | Confident | 12 Ų | 12 | 39.6 Ų | 39.6 | 6% | 0.062 | 22% | 0.221 | C | C | . | . | trans | -98 | 116.1 | 176.7 | -60.8 | 172 | 0 | 0 | 0 | 108 | C298 R301 C332 L333 L336 | C298-I303 HydrophobicContact CB-CB 4.26Å; C298-I303 PolarHBondContact O-N 2.71Å; R301-I303 VanDerWaalsContact C-N 3.33Å; R301-I303 HydrophobicContact CB-CD1 3.88Å; R301-I303 HydrophobicContact CB-CG1 3.98Å; I303-C332 HydrophobicContact CG2-CB 4.03Å; I303-L333 HydrophobicContact CD1-CD2 3.99Å; I303-L336 HydrophobicContact CD1-CB 4.43Å; I303-L336 HydrophobicContact CG2-CD1 4.19Å | ||
| 304 | D | 84.9 | Confident | 84.6 | Confident | 87 Ų | 87 | 41.7 Ų | 41.7 | 47% | 0.465 | 23% | 0.232 | S | C | . | . | trans | -84 | 115.2 | 162.9 | -177.6 | -30 | 0 | 0 | 0 | 107.5 | K306 N307 G308 | D304-K306 PolarHBondContact O-N 2.86Å; D304-K306 WeakPolarHBondContact OD1-CB 3.39Å; D304-K306 PolarHBondContact OD1-N 3.03Å; D304-N307 HydrophobicContact CB-CB 4.16Å; D304-N307 PolarHBondContact O-N 3.47Å; D304-N307 PolarHBondContact OD2-ND2 3.43Å; D304-G308 PolarHBondContact O-N 3.25Å | ||
| 305 | I | 86.3 | Confident | 83.7 | Confident | 13 Ų | 13 | 48.8 Ų | 48.8 | 7% | 0.067 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -58.6 | -37.9 | -175.7 | -62.1 | 173.2 | 0 | 0 | 0 | 110.7 | C298 G308 L309 F328 | C298-I305 HydrophobicContact CB-CD1 4.4Å; C298-I305 HydrophobicContact CB-CG1 4.16Å; I305-G308 PolarHBondContact O-N 3.35Å; I305-L309 HydrophobicContact CG2-CD1 3.85Å; I305-L309 HydrophobicContact CG2-CG 4.26Å; I305-L309 WeakPolarHBondContact O-CB 3.39Å; I305-L309 VanDerWaalsContact O-CG 3.24Å; I305-L309 WeakPolarHBondContact O-CG 3.47Å; I305-L309 PolarHBondContact O-N 2.95Å; I305-F328 HydrophobicContact CG2-CB 4.08Å |
| 306 | K | 85.6 | Confident | 82.6 | Confident | 95 Ų | 95 | 47.8 Ų | 47.8 | 41% | 0.413 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -62.9 | -55.5 | 179.7 | -176.2 | -173.5 | 174 | -164.7 | 0 | 110.6 | D304 G308 L309 E310 L323 | D304-K306 PolarHBondContact O-N 2.86Å; D304-K306 WeakPolarHBondContact OD1-CB 3.39Å; D304-K306 PolarHBondContact OD1-N 3.03Å; K306-G308 PolarHBondContact O-N 3.12Å; K306-L309 PolarHBondContact O-N 3.39Å; K306-E310 VanDerWaalsContact CE-OE1 3.23Å; K306-E310 WeakPolarHBondContact CE-OE1 3.45Å; K306-E310 WeakPolarHBondContact O-CG 2.86Å; K306-E310 PolarHBondContact O-N 3.14Å; K306-E310 VanDerWaalsContact O-N 3.1Å; K306-L323 HydrophobicContact CB-CD1 4.14Å; K306-L323 HydrophobicContact CB-CD2 3.58Å; K306-L323 HydrophobicContact CD-CD1 4.3Å; K306-L323 HydrophobicContact CG-CD1 4.24Å; K306-L323 HydrophobicContact CG-CD2 3.91Å |
| 307 | N | 83.5 | Confident | 81.5 | Confident | 69 Ų | 69 | 53.2 Ų | 53.2 | 37% | 0.369 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -64.8 | -32.6 | -179.4 | -58.7 | -26 | 0 | 0 | 0 | 111 | D304 E310 Q311 | D304-N307 HydrophobicContact CB-CB 4.16Å; D304-N307 PolarHBondContact O-N 3.47Å; D304-N307 PolarHBondContact OD2-ND2 3.43Å; N307-E310 PolarHBondContact O-N 3.06Å; N307-Q311 WeakPolarHBondContact O-CB 3.42Å; N307-Q311 VanDerWaalsContact O-CG 3.24Å; N307-Q311 WeakPolarHBondContact O-CG 3.49Å; N307-Q311 PolarHBondContact O-N 3.48Å |
| 308 | G | 84.9 | Confident | 79.7 | Confident | 2 Ų | 2 | 59 Ų | 59 | 2% | 0.021 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -65.8 | -45.7 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | D304 I305 K306 Q311 L312 | D304-G308 PolarHBondContact O-N 3.25Å; I305-G308 PolarHBondContact O-N 3.35Å; K306-G308 PolarHBondContact O-N 3.12Å; G308-Q311 PolarHBondContact O-N 2.81Å; G308-L312 VanDerWaalsContact O-CG 3.32Å; G308-L312 WeakPolarHBondContact O-CG 3.27Å; G308-L312 PolarHBondContact O-N 3.2Å |
| 309 | L | 86.2 | Confident | 78.1 | Confident | 0 Ų | 0 | 62.9 Ų | 62.9 | 0% | 0 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -63.5 | -42.6 | 174.8 | -69.1 | 167.7 | 0 | 0 | 0 | 111.3 | L205 I305 K306 Q311 L312 G313 I314 V316 L323 F328 Y331 | L205-L309 HydrophobicContact CD1-CD2 4.44Å; I305-L309 HydrophobicContact CG2-CD1 3.85Å; I305-L309 HydrophobicContact CG2-CG 4.26Å; I305-L309 WeakPolarHBondContact O-CB 3.39Å; I305-L309 VanDerWaalsContact O-CG 3.24Å; I305-L309 WeakPolarHBondContact O-CG 3.47Å; I305-L309 PolarHBondContact O-N 2.95Å; K306-L309 PolarHBondContact O-N 3.39Å; L309-Q311 VanDerWaalsContact C-N 3.32Å; L309-Q311 PolarHBondContact O-N 2.93Å; L309-L312 CarbonylContact O-C 3.45Å; L309-L312 PolarHBondContact O-N 3.4Å; L309-L312 VanDerWaalsContact O-N 3.09Å; L309-G313 PolarHBondContact O-N 3.28Å; L309-I314 CarbonylContact C-O 3.52Å; L309-I314 HydrophobicContact CB-CB 4.21Å; L309-I314 HydrophobicContact CD2-CB 4.29Å; L309-I314 HydrophobicContact CD2-CD1 4.04Å; L309-I314 HydrophobicContact CD2-CG2 4.32Å; L309-I314 PolarHBondContact O-N 2.92Å; L309-V316 HydrophobicContact CB-CG2 3.89Å; L309-V316 HydrophobicContact CD1-CG2 3.35Å; L309-V316 HydrophobicContact CG-CG2 4.27Å; L309-L323 HydrophobicContact CD1-CD2 4.36Å; L309-F328 HydrophobicContact CD1-CB 3.9Å; L309-F328 HydrophobicContact CD1-CD2 3.68Å; L309-F328 HydrophobicContact CD1-CE2 4.4Å; L309-F328 HydrophobicContact CD1-CG 3.87Å; L309-F328 HydrophobicContact CD2-CB 4.17Å; L309-F328 HydrophobicContact CD2-CD1 4.47Å; L309-F328 HydrophobicContact CD2-CG 4.25Å; L309-Y331 HydrophobicContact CD2-CD1 4.47Å |
| 310 | E | 85.3 | Confident | 76.9 | Confident | 97 Ų | 97 | 65.6 Ų | 65.6 | 45% | 0.453 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -59.5 | -41.5 | 175.2 | -71.7 | 174.1 | -172.8 | 0 | 0 | 111.7 | K306 N307 L312 G313 | K306-E310 VanDerWaalsContact CE-OE1 3.23Å; K306-E310 WeakPolarHBondContact CE-OE1 3.45Å; K306-E310 WeakPolarHBondContact O-CG 2.86Å; K306-E310 PolarHBondContact O-N 3.14Å; K306-E310 VanDerWaalsContact O-N 3.1Å; N307-E310 PolarHBondContact O-N 3.06Å; E310-L312 VanDerWaalsContact C-N 3.29Å; E310-L312 PolarHBondContact O-N 3.2Å; E310-G313 PolarHBondContact O-N 3.41Å; E310-G313 VanDerWaalsContact O-N 3.09Å |
| 311 | Q | 83.9 | Confident | 76.5 | Confident | 141 Ų | 141 | 69.4 Ų | 69.4 | 66% | 0.659 | 40% | 0.396 | S | S | * | . | H | α-helix | trans | -63.8 | -33.3 | 174.8 | -76.8 | 172.5 | 16.5 | 0 | 0 | 113 | N307 G308 L309 G313 L336 | N307-Q311 WeakPolarHBondContact O-CB 3.42Å; N307-Q311 VanDerWaalsContact O-CG 3.24Å; N307-Q311 WeakPolarHBondContact O-CG 3.49Å; N307-Q311 PolarHBondContact O-N 3.48Å; G308-Q311 PolarHBondContact O-N 2.81Å; L309-Q311 VanDerWaalsContact C-N 3.32Å; L309-Q311 PolarHBondContact O-N 2.93Å; Q311-G313 PolarHBondContact O-N 2.78Å; Q311-L336 HydrophobicContact CB-CD2 4.38Å |
| 312 | L | 83.5 | Confident | 76.2 | Confident | 54 Ų | 54 | 69.7 Ų | 69.7 | 28% | 0.283 | 40% | 0.4 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -83.4 | 6.3 | 176 | -63.1 | 172 | 0 | 0 | 0 | 112.7 | G308 L309 E310 I314 Y331 N335 L336 | G308-L312 VanDerWaalsContact O-CG 3.32Å; G308-L312 WeakPolarHBondContact O-CG 3.27Å; G308-L312 PolarHBondContact O-N 3.2Å; L309-L312 CarbonylContact O-C 3.45Å; L309-L312 PolarHBondContact O-N 3.4Å; L309-L312 VanDerWaalsContact O-N 3.09Å; E310-L312 VanDerWaalsContact C-N 3.29Å; E310-L312 PolarHBondContact O-N 3.2Å; L312-I314 VanDerWaalsContact C-N 3.3Å; L312-I314 PolarHBondContact O-N 3.06Å; L312-Y331 HydrophobicContact CB-CE1 4.35Å; L312-Y331 HydrophobicContact CD1-CD1 3.73Å; L312-Y331 HydrophobicContact CD1-CE1 3.51Å; L312-Y331 HydrophobicContact CG-CE1 4.47Å; L312-N335 HydrophobicContact CD1-CB 3.92Å; L312-N335 HydrophobicContact CD2-CB 4.01Å; L312-L336 HydrophobicContact CD1-CD1 4.16Å; L312-L336 HydrophobicContact CD1-CD2 4.26Å; L312-L336 HydrophobicContact CD1-CG 3.98Å; L312-L336 HydrophobicContact CD2-CD2 3.84Å; L312-L336 HydrophobicContact CD2-CG 4.34Å; L312-L336 HydrophobicContact CG-CD1 4.49Å; L312-L336 HydrophobicContact CG-CD2 3.9Å; L312-L336 HydrophobicContact CG-CG 4.19Å |
| 313 | G | 82.6 | Confident | 76.3 | Confident | 61 Ų | 61 | 70 Ų | 70 | 63% | 0.629 | 39% | 0.391 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 76 | 13.8 | 178.8 | 0 | 0 | 0 | 0 | 0 | 114.6 | L309 E310 Q311 | L309-G313 PolarHBondContact O-N 3.28Å; E310-G313 PolarHBondContact O-N 3.41Å; E310-G313 VanDerWaalsContact O-N 3.09Å; Q311-G313 PolarHBondContact O-N 2.78Å |
| 314 | I | 81.2 | Confident | 76.4 | Confident | 44 Ų | 44 | 72.1 Ų | 72.1 | 23% | 0.226 | 40% | 0.398 | C | S | . | . | trans | -95.3 | 106.5 | 179.6 | -57.2 | 178.7 | 0 | 0 | 0 | 108.8 | L205 L309 L312 V316 Y331 | L205-I314 HydrophobicContact CD1-CD1 3.62Å; L309-I314 CarbonylContact C-O 3.52Å; L309-I314 HydrophobicContact CB-CB 4.21Å; L309-I314 HydrophobicContact CD2-CB 4.29Å; L309-I314 HydrophobicContact CD2-CD1 4.04Å; L309-I314 HydrophobicContact CD2-CG2 4.32Å; L309-I314 PolarHBondContact O-N 2.92Å; L312-I314 VanDerWaalsContact C-N 3.3Å; L312-I314 PolarHBondContact O-N 3.06Å; I314-V316 PolarHBondContact O-N 2.89Å; I314-Y331 HydrophobicContact CD1-CD1 4.03Å; I314-Y331 HydrophobicContact CD1-CE1 3.5Å; I314-Y331 VanDerWaalsContact CD1-CE1 3.5Å | ||
| 315 | N | 72.8 | Confident | 76.5 | Confident | 148 Ų | 148 | 68.2 Ų | 68.2 | 79% | 0.791 | 38% | 0.377 | S | S | * | . | trans | -76.6 | 108.2 | 178 | -74.2 | -29.3 | 0 | 0 | 0 | 110.7 | ||||
| 316 | V | 68.2 | Low | 76.7 | Confident | 27 Ų | 27 | 67.6 Ų | 67.6 | 16% | 0.164 | 37% | 0.374 | C | S | . | . | P | Polyproline II helix | trans | -83 | 126.3 | 172.3 | -169.9 | 0 | 0 | 0 | 0 | 109.2 | L309 I314 P318 T322 L323 | L309-V316 HydrophobicContact CB-CG2 3.89Å; L309-V316 HydrophobicContact CD1-CG2 3.35Å; L309-V316 HydrophobicContact CG-CG2 4.27Å; I314-V316 PolarHBondContact O-N 2.89Å; V316-P318 WeakPolarHBondContact O-CD 3.45Å; V316-T322 WeakPolarHBondContact CG1-OG1 3.27Å; V316-L323 HydrophobicContact CB-CD2 4.34Å; V316-L323 HydrophobicContact CG1-CD2 3.97Å; V316-L323 HydrophobicContact CG1-CG 4.15Å; V316-L323 HydrophobicContact CG2-CD2 4.14Å |
| 317 | I | 64.4 | Low | 77.1 | Confident | 123 Ų | 123 | 63 Ų | 63 | 63% | 0.631 | 35% | 0.354 | S | S | * | . | P | Polyproline II helix | trans | -60.6 | 119.1 | 176.1 | -58.4 | 171.8 | 0 | 0 | 0 | 108.8 | ||
| 318 | P | 51.4 | Low | 77.4 | Confident | 121 Ų | 121 | 61.1 Ų | 61.1 | 79% | 0.786 | 34% | 0.343 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.9 | 138.4 | 179.6 | -2.6 | 11.2 | 0 | 0 | 0 | 110.9 | V316 | V316-P318 WeakPolarHBondContact O-CD 3.45Š|
| 319 | G | 52.5 | Low | 77.7 | Confident | 85 Ų | 85 | 61 Ų | 61 | 88% | 0.876 | 34% | 0.342 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 100.4 | 6.5 | 169.6 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||
| 320 | R | 59.3 | Low | 78 | Confident | 121 Ų | 121 | 61 Ų | 61 | 46% | 0.457 | 34% | 0.342 | S | S | . | . | S | Bend | trans | -123.1 | 154.2 | 170.2 | -69.1 | -175.8 | 173.5 | -169.6 | -8 | 110.1 | E225 T322 | E225-R320 VanDerWaalsContact CD-NH1 3.27Å; E225-R320 VanDerWaalsContact CG-NH1 3.35Å; E225-R320 IonicContact OE1-CZ 3.5Å; E225-R320 IonicContact OE1-NH1 3.87Å; E225-R320 PolarHBondContact OE1-NH1 2.99Å; E225-R320 IonicContact OE1-NH2 2.63Å; E225-R320 PolarHBondContact OE1-NH2 3.35Å; R320-T322 HydrophobicContact CB-CG2 3.95Å; R320-T322 PolarHBondContact O-N 3.28Å; R320-T322 PolarHBondContact O-OG1 3.23Å; R320-T322 VanDerWaalsContact O-OG1 3.12Å |
| 321 | H | 69.5 | Low | 78.2 | Confident | 97 Ų | 97 | 59.3 Ų | 59.3 | 45% | 0.449 | 33% | 0.331 | S | S | . | . | G | 310 helix | trans | -66.3 | 19.4 | 179.8 | -63 | -71.3 | 0 | 0 | 0 | 113.7 | I227 F228 L323 Y324 | I227-H321 VanDerWaalsContact CD1-O 3.29Å; I227-H321 WeakPolarHBondContact CD1-O 3.48Å; F228-H321 HydrophobicContact CD2-CB 4.3Å; F228-H321 HydrophobicContact CE2-CB 3.65Å; F228-H321 AromaticContact CE2-CD2 3.77Å; F228-H321 AromaticContact CE2-CG 3.4Å; F228-H321 AromaticContact CE2-ND1 3.58Å; F228-H321 HydrophobicContact CZ-CB 4.14Å; H321-L323 PolarHBondContact O-N 2.97Å; H321-Y324 HydrophobicContact CB-CD2 3.95Å; H321-Y324 AromaticContact ND1-CE2 3.88Å; H321-Y324 WeakPolarHBondContact O-CB 3.43Å; H321-Y324 PolarHBondContact O-N 2.76Å |
| 322 | T | 73.7 | Confident | 78.5 | Confident | 22 Ų | 22 | 52.6 Ų | 52.6 | 14% | 0.135 | 30% | 0.3 | C | S | . | . | G | 310 helix | trans | -52.1 | -36 | 178.2 | 47.5 | 0 | 0 | 0 | 0 | 113.2 | I227 V316 R320 Y324 N325 F328 | I227-T322 HydrophobicContact CD1-CG2 4.39Å; V316-T322 WeakPolarHBondContact CG1-OG1 3.27Å; R320-T322 HydrophobicContact CB-CG2 3.95Å; R320-T322 PolarHBondContact O-N 3.28Å; R320-T322 PolarHBondContact O-OG1 3.23Å; R320-T322 VanDerWaalsContact O-OG1 3.12Å; T322-Y324 PolarHBondContact O-N 3.46Å; T322-Y324 VanDerWaalsContact O-N 3.16Å; T322-N325 VanDerWaalsContact O-CB 3.3Å; T322-N325 WeakPolarHBondContact O-CB 3.44Å; T322-N325 PolarHBondContact O-N 3.19Å; T322-F328 VanDerWaalsContact O-CD2 3.24Å; T322-F328 WeakPolarHBondContact O-CD2 3.45Å; T322-F328 WeakPolarHBondContact O-CE2 3.23Å |
| 323 | L | 78.9 | Confident | 78.7 | Confident | 51 Ų | 51 | 50 Ų | 50 | 27% | 0.267 | 29% | 0.287 | S | S | . | . | G | 310 helix | trans | -60.8 | -21.8 | 175.3 | -66.2 | 165.6 | 0 | 0 | 0 | 113.8 | H295 K306 L309 V316 H321 N325 | H295-L323 PolarHBondContact NE2-O 3.07Å; K306-L323 HydrophobicContact CB-CD1 4.14Å; K306-L323 HydrophobicContact CB-CD2 3.58Å; K306-L323 HydrophobicContact CD-CD1 4.3Å; K306-L323 HydrophobicContact CG-CD1 4.24Å; K306-L323 HydrophobicContact CG-CD2 3.91Å; L309-L323 HydrophobicContact CD1-CD2 4.36Å; V316-L323 HydrophobicContact CB-CD2 4.34Å; V316-L323 HydrophobicContact CG1-CD2 3.97Å; V316-L323 HydrophobicContact CG1-CG 4.15Å; V316-L323 HydrophobicContact CG2-CD2 4.14Å; H321-L323 PolarHBondContact O-N 2.97Å; L323-N325 VanDerWaalsContact C-N 3.3Å |
| 324 | Y | 85.3 | Confident | 78.8 | Confident | 56 Ų | 56 | 47.5 Ų | 47.5 | 22% | 0.22 | 26% | 0.261 | C | S | . | . | G | 310 helix | trans | -85.7 | 1 | 177.9 | -65.2 | -81.3 | 0 | 0 | 0 | 113.6 | F228 H295 H321 T322 P326 F359 | F228-Y324 HydrophobicContact CE1-CG 4.27Å; F228-Y324 HydrophobicContact CZ-CD1 4.49Å; F228-Y324 AromaticContact CZ-CD2 3.87Å; F228-Y324 HydrophobicContact CZ-CD2 3.87Å; F228-Y324 HydrophobicContact CZ-CE2 4.41Å; F228-Y324 AromaticContact CZ-CG 3.91Å; F228-Y324 HydrophobicContact CZ-CG 3.91Å; H295-Y324 AromaticContact CE1-CD1 3.93Å; H295-Y324 AromaticContact NE2-CD1 3.51Å; H321-Y324 HydrophobicContact CB-CD2 3.95Å; H321-Y324 AromaticContact ND1-CE2 3.88Å; H321-Y324 WeakPolarHBondContact O-CB 3.43Å; H321-Y324 PolarHBondContact O-N 2.76Å; T322-Y324 PolarHBondContact O-N 3.46Å; T322-Y324 VanDerWaalsContact O-N 3.16Å; Y324-P326 WeakPolarHBondContact O-CD 3.21Å; Y324-F359 HydrophobicContact CE1-CE2 4.38Å; Y324-F359 HydrophobicContact CE1-CZ 4.48Å |
| 325 | N | 88 | Confident | 78.9 | Confident | 5 Ų | 5 | 48.4 Ų | 48.4 | 3% | 0.027 | 27% | 0.266 | C | S | . | . | trans | -59.6 | 119.4 | 171.2 | -179.2 | -8.8 | 0 | 0 | 0 | 109 | D213 I222 I227 T322 L323 L327 F328 | D213-N325 PolarHBondContact OD2-ND2 3.49Å; I222-N325 HydrophobicContact CD1-CB 4.47Å; I227-N325 HydrophobicContact CD1-CB 4.1Å; T322-N325 VanDerWaalsContact O-CB 3.3Å; T322-N325 WeakPolarHBondContact O-CB 3.44Å; T322-N325 PolarHBondContact O-N 3.19Å; L323-N325 VanDerWaalsContact C-N 3.3Å; N325-L327 PolarHBondContact O-N 3.31Å; N325-L327 WeakPolarHBondContact OD1-CB 3.44Å; N325-L327 PolarHBondContact OD1-N 3.32Å; N325-F328 HydrophobicContact CB-CB 4.44Å; N325-F328 HydrophobicContact CB-CD1 4.46Å; N325-F328 HydrophobicContact CB-CD2 3.8Å; N325-F328 HydrophobicContact CB-CE2 4.11Å; N325-F328 HydrophobicContact CB-CG 3.99Å; N325-F328 WeakPolarHBondContact O-CB 3.41Å; N325-F328 PolarHBondContact O-N 3.18Å; N325-F328 VanDerWaalsContact O-N 3.14Å | ||
| 326 | P | 90.8 | Very high | 79.1 | Confident | 0 Ų | 0 | 41.7 Ų | 41.7 | 0% | 0 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -64.4 | -26.7 | -176.4 | 25.4 | -32.7 | 0 | 0 | 0 | 112.9 | Y287 V290 I291 V294 Y324 F328 G329 L330 | Y287-P326 HydrophobicContact CD2-CG 4.32Å; Y287-P326 HydrophobicContact CE2-CG 3.8Å; V290-P326 HydrophobicContact CG1-CB 3.55Å; V290-P326 HydrophobicContact CG1-CG 4.03Å; I291-P326 HydrophobicContact CG1-CB 4.15Å; I291-P326 HydrophobicContact CG1-CG 4.03Å; V294-P326 HydrophobicContact CG2-CB 4.37Å; Y324-P326 WeakPolarHBondContact O-CD 3.21Å; P326-F328 VanDerWaalsContact C-N 3.31Å; P326-F328 PolarHBondContact O-N 2.82Å; P326-G329 PolarHBondContact O-N 2.87Å; P326-L330 WeakPolarHBondContact O-CG 3.21Å; P326-L330 PolarHBondContact O-N 2.76Å |
| 327 | L | 92.5 | Very high | 79 | Confident | 0 Ų | 0 | 40.5 Ų | 40.5 | 0% | 0 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -69.2 | -32.1 | 178 | -61.4 | -171.5 | 0 | 0 | 0 | 111.8 | T203 L205 D213 F215 L220 N325 G329 L330 Y331 | T203-L327 HydrophobicContact CG2-CB 3.87Å; T203-L327 HydrophobicContact CG2-CD2 4.4Å; L205-L327 HydrophobicContact CD2-CB 4.14Å; D213-L327 HydrophobicContact CB-CD1 3.56Å; F215-L327 HydrophobicContact CB-CD2 3.81Å; F215-L327 HydrophobicContact CD2-CD2 4.01Å; F215-L327 HydrophobicContact CG-CD2 4.06Å; L220-L327 HydrophobicContact CB-CD1 3.95Å; L220-L327 HydrophobicContact CD2-CD1 3.87Å; L220-L327 HydrophobicContact CD2-CD2 4.28Å; L220-L327 HydrophobicContact CD2-CG 3.94Å; N325-L327 PolarHBondContact O-N 3.31Å; N325-L327 WeakPolarHBondContact OD1-CB 3.44Å; N325-L327 PolarHBondContact OD1-N 3.32Å; L327-G329 VanDerWaalsContact C-N 3.34Å; L327-G329 PolarHBondContact O-N 3.29Å; L327-L330 HydrophobicContact CD2-CD1 4.18Å; L327-L330 PolarHBondContact O-N 3.45Å; L327-Y331 WeakPolarHBondContact O-CB 3.2Å; L327-Y331 PolarHBondContact O-N 3.46Å |
| 328 | F | 90.9 | Very high | 78.6 | Confident | 29 Ų | 29 | 37.8 Ų | 37.8 | 13% | 0.127 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -63.4 | -42.4 | 173 | -70.4 | -7.9 | 0 | 0 | 0 | 111.9 | L205 I305 L309 T322 N325 P326 Y331 C332 | L205-F328 HydrophobicContact CD1-CD1 3.75Å; L205-F328 HydrophobicContact CD1-CE1 4.05Å; L205-F328 HydrophobicContact CD2-CD1 3.72Å; L205-F328 HydrophobicContact CD2-CE1 3.93Å; L205-F328 HydrophobicContact CG-CD1 4.37Å; I305-F328 HydrophobicContact CG2-CB 4.08Å; L309-F328 HydrophobicContact CD1-CB 3.9Å; L309-F328 HydrophobicContact CD1-CD2 3.68Å; L309-F328 HydrophobicContact CD1-CE2 4.4Å; L309-F328 HydrophobicContact CD1-CG 3.87Å; L309-F328 HydrophobicContact CD2-CB 4.17Å; L309-F328 HydrophobicContact CD2-CD1 4.47Å; L309-F328 HydrophobicContact CD2-CG 4.25Å; T322-F328 VanDerWaalsContact O-CD2 3.24Å; T322-F328 WeakPolarHBondContact O-CD2 3.45Å; T322-F328 WeakPolarHBondContact O-CE2 3.23Å; N325-F328 HydrophobicContact CB-CB 4.44Å; N325-F328 HydrophobicContact CB-CD1 4.46Å; N325-F328 HydrophobicContact CB-CD2 3.8Å; N325-F328 HydrophobicContact CB-CE2 4.11Å; N325-F328 HydrophobicContact CB-CG 3.99Å; N325-F328 WeakPolarHBondContact O-CB 3.41Å; N325-F328 PolarHBondContact O-N 3.18Å; N325-F328 VanDerWaalsContact O-N 3.14Å; P326-F328 VanDerWaalsContact C-N 3.31Å; P326-F328 PolarHBondContact O-N 2.82Å; F328-Y331 PolarHBondContact O-N 3.45Å; F328-C332 WeakPolarHBondContact O-CB 3.36Å; F328-C332 PolarHBondContact O-N 2.98Å; F328-C332 PolarHBondContact O-SG 2.89Å |
| 329 | G | 90.3 | Very high | 78.6 | Confident | 0 Ų | 0 | 38.5 Ų | 38.5 | 0% | 0 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -66.1 | -41.2 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | V294 P326 L327 C332 L333 | V294-G329 VanDerWaalsContact CG1-CA 3.5Å; P326-G329 PolarHBondContact O-N 2.87Å; L327-G329 VanDerWaalsContact C-N 3.34Å; L327-G329 PolarHBondContact O-N 3.29Å; G329-C332 PolarHBondContact O-N 3.15Å; G329-L333 WeakPolarHBondContact O-CB 3.19Å; G329-L333 WeakPolarHBondContact O-CG 3.49Å; G329-L333 PolarHBondContact O-N 3.01Å |
| 330 | L | 92.3 | Very high | 78.5 | Confident | 0 Ų | 0 | 36.6 Ų | 36.6 | 0% | 0 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -64.3 | -41.2 | 174.6 | -71.5 | 173.1 | 0 | 0 | 0 | 112.1 | L197 F215 V294 P326 L327 L333 G334 | L197-L330 HydrophobicContact CD2-CD2 4.3Å; F215-L330 HydrophobicContact CD2-CD1 4.2Å; F215-L330 HydrophobicContact CE2-CB 4.45Å; F215-L330 HydrophobicContact CE2-CD1 3.71Å; F215-L330 HydrophobicContact CZ-CD1 3.96Å; V294-L330 HydrophobicContact CG1-CG 4.35Å; V294-L330 HydrophobicContact CG2-CD1 4.33Å; V294-L330 HydrophobicContact CG2-CD2 3.85Å; V294-L330 HydrophobicContact CG2-CG 3.8Å; P326-L330 WeakPolarHBondContact O-CG 3.21Å; P326-L330 PolarHBondContact O-N 2.76Å; L327-L330 HydrophobicContact CD2-CD1 4.18Å; L327-L330 PolarHBondContact O-N 3.45Å; L330-L333 PolarHBondContact O-N 2.93Å; L330-G334 PolarHBondContact O-N 2.91Å |
| 331 | Y | 90.6 | Very high | 77.8 | Confident | 60 Ų | 60 | 37.6 Ų | 37.6 | 24% | 0.235 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -62 | -44.6 | 174.7 | -174 | -99.6 | 0 | 0 | 0 | 111.7 | T203 L205 L309 L312 I314 L327 F328 G334 N335 | T203-Y331 HydrophobicContact CG2-CD2 4.45Å; T203-Y331 WeakPolarHBondContact O-CD2 3.16Å; L205-Y331 HydrophobicContact CD1-CD1 3.57Å; L205-Y331 HydrophobicContact CD1-CD2 3.96Å; L205-Y331 HydrophobicContact CD1-CE1 4.04Å; L205-Y331 HydrophobicContact CD1-CE2 4.4Å; L205-Y331 HydrophobicContact CD1-CG 3.52Å; L205-Y331 HydrophobicContact CG-CD1 4.46Å; L205-Y331 HydrophobicContact CG-CD2 3.97Å; L205-Y331 HydrophobicContact CG-CE2 4.43Å; L205-Y331 HydrophobicContact CG-CG 3.99Å; L309-Y331 HydrophobicContact CD2-CD1 4.47Å; L312-Y331 HydrophobicContact CB-CE1 4.35Å; L312-Y331 HydrophobicContact CD1-CD1 3.73Å; L312-Y331 HydrophobicContact CD1-CE1 3.51Å; L312-Y331 HydrophobicContact CG-CE1 4.47Å; I314-Y331 HydrophobicContact CD1-CD1 4.03Å; I314-Y331 HydrophobicContact CD1-CE1 3.5Å; I314-Y331 VanDerWaalsContact CD1-CE1 3.5Å; L327-Y331 WeakPolarHBondContact O-CB 3.2Å; L327-Y331 PolarHBondContact O-N 3.46Å; F328-Y331 PolarHBondContact O-N 3.45Å; Y331-G334 PolarHBondContact O-N 3.39Å; Y331-N335 VanDerWaalsContact CD2-ND2 3.27Å; Y331-N335 WeakPolarHBondContact CD2-ND2 3.32Å; Y331-N335 WeakPolarHBondContact CE2-ND2 3.38Å; Y331-N335 WeakPolarHBondContact O-CB 3.44Å; Y331-N335 PolarHBondContact O-N 3.26Å; Y331-N335 PolarHBondContact O-ND2 3.42Å |
| 332 | C | 89.2 | Confident | 76.5 | Confident | 0 Ų | 0 | 42.6 Ų | 42.6 | 0% | 0 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -63.3 | -40 | 174 | -74 | 0 | 0 | 0 | 0 | 112.3 | I303 F328 G329 G334 N335 L336 | I303-C332 HydrophobicContact CG2-CB 4.03Å; F328-C332 WeakPolarHBondContact O-CB 3.36Å; F328-C332 PolarHBondContact O-N 2.98Å; F328-C332 PolarHBondContact O-SG 2.89Å; G329-C332 PolarHBondContact O-N 3.15Å; C332-G334 VanDerWaalsContact C-N 3.34Å; C332-N335 PolarHBondContact O-N 3.3Å; C332-L336 HydrophobicContact CB-CD1 3.9Å; C332-L336 VanDerWaalsContact O-CB 3.27Å; C332-L336 WeakPolarHBondContact O-CB 3.37Å; C332-L336 PolarHBondContact O-N 2.82Å |
| 333 | L | 88.3 | Confident | 75.1 | Confident | 0 Ų | 0 | 43 Ų | 43 | 0% | 0 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -64.7 | -36.2 | 175.2 | -77.3 | 164.4 | 0 | 0 | 0 | 112.1 | L197 V294 L297 R301 I303 G329 L330 V337 | L197-L333 HydrophobicContact CD1-CB 3.55Å; V294-L333 HydrophobicContact CG1-CD1 4.41Å; L297-L333 HydrophobicContact CB-CD1 3.86Å; R301-L333 HydrophobicContact CB-CD2 4.45Å; R301-L333 HydrophobicContact CG-CD2 4.1Å; I303-L333 HydrophobicContact CD1-CD2 3.99Å; G329-L333 WeakPolarHBondContact O-CB 3.19Å; G329-L333 WeakPolarHBondContact O-CG 3.49Å; G329-L333 PolarHBondContact O-N 3.01Å; L330-L333 PolarHBondContact O-N 2.93Å; L333-V337 WeakPolarHBondContact O-CB 3.11Å; L333-V337 WeakPolarHBondContact O-CG2 3.27Å |
| 334 | G | 85.4 | Confident | 73.4 | Confident | 8 Ų | 8 | 43.9 Ų | 43.9 | 8% | 0.082 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -70.6 | -39.4 | 176 | 0 | 0 | 0 | 0 | 0 | 113 | L330 Y331 C332 | L330-G334 PolarHBondContact O-N 2.91Å; Y331-G334 PolarHBondContact O-N 3.39Å; C332-G334 VanDerWaalsContact C-N 3.34Å |
| 335 | N | 83.2 | Confident | 71.5 | Confident | 63 Ų | 63 | 45.2 Ų | 45.2 | 34% | 0.337 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -104.3 | -19.6 | -165.6 | -65.6 | -53.7 | 0 | 0 | 0 | 115.5 | L312 Y331 C332 | L312-N335 HydrophobicContact CD1-CB 3.92Å; L312-N335 HydrophobicContact CD2-CB 4.01Å; Y331-N335 VanDerWaalsContact CD2-ND2 3.27Å; Y331-N335 WeakPolarHBondContact CD2-ND2 3.32Å; Y331-N335 WeakPolarHBondContact CE2-ND2 3.38Å; Y331-N335 WeakPolarHBondContact O-CB 3.44Å; Y331-N335 PolarHBondContact O-N 3.26Å; Y331-N335 PolarHBondContact O-ND2 3.42Å; C332-N335 PolarHBondContact O-N 3.3Å |
| 336 | L | 77.2 | Confident | 69.5 | Low | 8 Ų | 8 | 48.8 Ų | 48.8 | 4% | 0.042 | 24% | 0.242 | C | C | . | . | S | Bend | trans | -104.9 | -1.8 | -178.1 | -63.2 | 167.5 | 0 | 0 | 0 | 113.7 | I303 Q311 L312 C332 S338 H339 | I303-L336 HydrophobicContact CD1-CB 4.43Å; I303-L336 HydrophobicContact CG2-CD1 4.19Å; Q311-L336 HydrophobicContact CB-CD2 4.38Å; L312-L336 HydrophobicContact CD1-CD1 4.16Å; L312-L336 HydrophobicContact CD1-CD2 4.26Å; L312-L336 HydrophobicContact CD1-CG 3.98Å; L312-L336 HydrophobicContact CD2-CD2 3.84Å; L312-L336 HydrophobicContact CD2-CG 4.34Å; L312-L336 HydrophobicContact CG-CD1 4.49Å; L312-L336 HydrophobicContact CG-CD2 3.9Å; L312-L336 HydrophobicContact CG-CG 4.19Å; C332-L336 HydrophobicContact CB-CD1 3.9Å; C332-L336 VanDerWaalsContact O-CB 3.27Å; C332-L336 WeakPolarHBondContact O-CB 3.37Å; C332-L336 PolarHBondContact O-N 2.82Å; L336-S338 VanDerWaalsContact C-N 3.26Å; L336-S338 PolarHBondContact O-N 3.25Å; L336-H339 PolarHBondContact O-N 3.38Å; L336-H339 VanDerWaalsContact O-N 3.15Å |
| 337 | V | 65.8 | Low | 67.3 | Low | 2 Ų | 2 | 55.1 Ų | 55.1 | 1% | 0.012 | 27% | 0.269 | C | S | . | . | G | 310 helix | trans | -60.5 | -37.1 | -176.8 | 148.7 | 0 | 0 | 0 | 0 | 111.9 | D190 F193 R301 L333 | D190-V337 HydrophobicContact CB-CG1 3.47Å; D190-V337 VanDerWaalsContact CB-CG1 3.47Å; D190-V337 WeakPolarHBondContact O-CG1 3.5Å; D190-V337 WeakPolarHBondContact OD1-CG1 3.42Å; F193-V337 HydrophobicContact CB-CB 4.44Å; F193-V337 HydrophobicContact CB-CG1 3.92Å; F193-V337 HydrophobicContact CB-CG2 4.08Å; F193-V337 HydrophobicContact CG-CG2 4.38Å; R301-V337 PolarHBondContact NH2-O 2.86Å; R301-V337 VanDerWaalsContact NH2-O 3.08Å; L333-V337 WeakPolarHBondContact O-CB 3.11Å; L333-V337 WeakPolarHBondContact O-CG2 3.27Å |
| 338 | S | 55.3 | Low | 64.8 | Low | 66 Ų | 66 | 62 Ų | 62 | 46% | 0.462 | 31% | 0.307 | S | S | . | . | G | 310 helix | trans | -77.7 | -16.4 | 178.2 | 34.1 | 0 | 0 | 0 | 0 | 114.7 | L336 | L336-S338 VanDerWaalsContact C-N 3.26Å; L336-S338 PolarHBondContact O-N 3.25Å |
| 339 | H | 51.7 | Low | 62.2 | Low | 135 Ų | 135 | 65.8 Ų | 65.8 | 63% | 0.625 | 33% | 0.325 | S | S | * | . | G | 310 helix | trans | -92.9 | -12.4 | -176.2 | -73.5 | -61.4 | 0 | 0 | 0 | 114.6 | L336 N341 | L336-H339 PolarHBondContact O-N 3.38Å; L336-H339 VanDerWaalsContact O-N 3.15Å; H339-N341 VanDerWaalsContact C-N 3.35Å; H339-N341 PolarHBondContact O-N 3.37Å |
| 340 | N | 51.3 | Low | 59.6 | Low | 46 Ų | 46 | 68.9 Ų | 68.9 | 25% | 0.246 | 35% | 0.345 | C | S | . | . | trans | -89.6 | 63.9 | -168.6 | -123.2 | -6.6 | 0 | 0 | 0 | 113 | K186 R301 G302 K342 | K186-N340 PolarHBondContact NZ-O 3.02Å; R301-N340 PolarHBondContact O-ND2 2.89Å; G302-N340 PolarHBondContact O-ND2 3.47Å; N340-K342 PolarHBondContact O-N 2.87Å; N340-K342 VanDerWaalsContact O-N 3.14Å | ||
| 341 | N | 43.6 | Very low | 57.2 | Low | 142 Ų | 142 | 73.6 Ų | 73.6 | 76% | 0.759 | 36% | 0.364 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63 | -16 | 179.6 | -82.4 | -20.2 | 0 | 0 | 0 | 114.8 | H339 | H339-N341 VanDerWaalsContact C-N 3.35Å; H339-N341 PolarHBondContact O-N 3.37Å |
| 342 | K | 41.9 | Very low | 54.6 | Low | 201 Ų | 201 | 74.6 Ų | 74.6 | 87% | 0.874 | 38% | 0.38 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -95 | -15.4 | -172.6 | -71 | -177.6 | 179 | 176.6 | 0 | 115.6 | N340 T344 | N340-K342 PolarHBondContact O-N 2.87Å; N340-K342 VanDerWaalsContact O-N 3.14Å; K342-T344 VanDerWaalsContact C-N 3.33Å; K342-T344 PolarHBondContact O-N 3.06Å |
| 343 | S | 45.1 | Very low | 52.1 | Low | 32 Ų | 32 | 77.1 Ų | 77.1 | 22% | 0.224 | 39% | 0.392 | C | S | . | . | trans | -91 | 70.8 | 174.8 | -171.2 | 0 | 0 | 0 | 0 | 109.5 | K186 R345 | K186-S343 PolarHBondContact NZ-O 3.34Å; S343-R345 PolarHBondContact O-N 2.8Å | ||
| 344 | T | 43.4 | Very low | 49.7 | Very low | 68 Ų | 68 | 85 Ų | 85 | 42% | 0.417 | 43% | 0.427 | S | S | . | . | trans | -84.4 | 76.9 | 159.7 | 46.1 | 0 | 0 | 0 | 0 | 106.5 | R183 K342 Y346 | R183-T344 HydrophobicContact CG-CG2 4.31Å; K342-T344 VanDerWaalsContact C-N 3.33Å; K342-T344 PolarHBondContact O-N 3.06Å; T344-Y346 PolarHBondContact O-N 3.02Å | ||
| 345 | R | 45.2 | Very low | 47.5 | Very low | 84 Ų | 84 | 86.6 Ų | 86.6 | 32% | 0.317 | 43% | 0.433 | S | S | . | . | trans | -68 | 129.7 | 161.5 | -96.4 | -167.8 | -179.4 | 167.5 | 4 | 107.4 | S343 | S343-R345 PolarHBondContact O-N 2.8Š| ||
| 346 | Y | 45.8 | Very low | 45.2 | Very low | 80 Ų | 80 | 89 Ų | 89 | 31% | 0.314 | 45% | 0.446 | S | S | . | . | trans | -69.2 | 141.2 | 166 | -65.6 | -98.6 | 0 | 0 | 0 | 107.7 | D179 N182 T344 D348 E349 | D179-Y346 WeakPolarHBondContact OD1-CE1 3.14Å; D179-Y346 PolarHBondContact OD1-OH 3.49Å; D179-Y346 PolarHBondContact OD2-OH 3.47Å; N182-Y346 WeakPolarHBondContact ND2-CD1 3.44Å; T344-Y346 PolarHBondContact O-N 3.02Å; Y346-D348 PolarHBondContact O-N 3.49Å; Y346-E349 PolarHBondContact O-N 3.22Å | ||
| 347 | F | 43.4 | Very low | 43.4 | Very low | 133 Ų | 133 | 92.2 Ų | 92.2 | 58% | 0.583 | 48% | 0.482 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.6 | -21.4 | -179.2 | -143.7 | -90.7 | 0 | 0 | 0 | 113.1 | I185 | I185-F347 HydrophobicContact CG2-CE2 4.22Š|
| 348 | D | 40.6 | Very low | 42.2 | Very low | 146 Ų | 146 | 97.1 Ų | 97.1 | 78% | 0.781 | 51% | 0.507 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.1 | -6.4 | -179.9 | -77.5 | -22.2 | 0 | 0 | 0 | 115.8 | Y346 C350 | Y346-D348 PolarHBondContact O-N 3.49Å; D348-C350 PolarHBondContact O-N 3.14Å |
| 349 | E | 37 | Very low | 41.5 | Very low | 108 Ų | 108 | 97.8 Ų | 97.8 | 51% | 0.505 | 50% | 0.502 | S | S | . | . | trans | -78 | 111.9 | 179.6 | -77.8 | -173 | 174.8 | 0 | 0 | 111.4 | Y346 Y351 | Y346-E349 PolarHBondContact O-N 3.22Å; E349-Y351 PolarHBondContact O-N 3.3Å | ||
| 350 | C | 35.7 | Very low | 40.8 | Very low | 65 Ų | 65 | 93.6 Ų | 93.6 | 44% | 0.439 | 50% | 0.496 | S | S | . | . | trans | -53 | 136.3 | 173.3 | -90 | 0 | 0 | 0 | 0 | 112.3 | D348 S352 L367 | D348-C350 PolarHBondContact O-N 3.14Å; C350-S352 PolarHBondContact O-N 3.32Å; C350-L367 HydrophobicContact CB-CD1 4.35Å; C350-L367 WeakPolarHBondContact SG-CD1 3.41Å | ||
| 351 | Y | 41.3 | Very low | 39.9 | Very low | 99 Ų | 99 | 99.7 Ų | 99.7 | 39% | 0.388 | 52% | 0.52 | S | S | . | . | trans | -58.7 | 99.1 | 173.8 | -66.8 | -88.9 | 0 | 0 | 0 | 110.5 | L255 V257 C300 E349 I353 | L255-Y351 PolarHBondContact O-OH 3.09Å; V257-Y351 HydrophobicContact CG2-CE1 4.05Å; C300-Y351 HydrophobicContact CB-CD1 4.42Å; C300-Y351 HydrophobicContact CB-CE1 3.84Å; C300-Y351 WeakPolarHBondContact SG-CD1 3.35Å; C300-Y351 WeakPolarHBondContact SG-CE1 3.34Å; E349-Y351 PolarHBondContact O-N 3.3Å; Y351-I353 VanDerWaalsContact C-N 3.32Å; Y351-I353 PolarHBondContact O-N 2.79Å; Y351-I353 VanDerWaalsContact O-N 3.11Å | ||
| 352 | S | 35.4 | Very low | 39.5 | Very low | 81 Ų | 81 | 96.4 Ų | 96.4 | 57% | 0.566 | 50% | 0.501 | S | S | * | . | trans | -79.7 | 88.6 | 162 | 55.6 | 0 | 0 | 0 | 0 | 108.1 | C350 K354 | C350-S352 PolarHBondContact O-N 3.32Å; S352-K354 PolarHBondContact O-N 3.29Å | ||
| 353 | I | 37.9 | Very low | 39 | Very low | 52 Ų | 52 | 92.3 Ų | 92.3 | 27% | 0.267 | 50% | 0.496 | S | S | . | . | trans | -72.2 | 96.1 | 172.6 | -60.5 | 168.7 | 0 | 0 | 0 | 107.2 | L296 Y351 L355 I362 | L296-I353 HydrophobicContact CD2-CD1 3.81Å; L296-I353 HydrophobicContact CD2-CG1 4.25Å; L296-I353 HydrophobicContact CD2-CG2 4.22Å; Y351-I353 VanDerWaalsContact C-N 3.32Å; Y351-I353 PolarHBondContact O-N 2.79Å; Y351-I353 VanDerWaalsContact O-N 3.11Å; I353-L355 HydrophobicContact CG2-CB 3.95Å; I353-L355 HydrophobicContact CG2-CD1 3.29Å; I353-L355 HydrophobicContact CG2-CG 3.32Å; I353-L355 PolarHBondContact O-N 3.07Å; I353-I362 HydrophobicContact CB-CD1 4.44Å; I353-I362 HydrophobicContact CD1-CD1 4.04Å; I353-I362 HydrophobicContact CG2-CD1 4.05Å | ||
| 354 | K | 36.4 | Very low | 38.4 | Very low | 165 Ų | 165 | 95.8 Ų | 95.8 | 72% | 0.717 | 52% | 0.52 | S | S | * | . | trans | -76.2 | 79.8 | 165.3 | -70.9 | -175.1 | 179.6 | -179.7 | 0 | 107.8 | Q299 S352 | Q299-K354 PolarHBondContact NE2-O 2.88Å; S352-K354 PolarHBondContact O-N 3.29Å | ||
| 355 | L | 40.1 | Very low | 37.6 | Very low | 43 Ų | 43 | 99.8 Ų | 99.8 | 23% | 0.225 | 54% | 0.538 | C | S | . | . | trans | -92.4 | 19 | 165.5 | -82.8 | 166.5 | 0 | 0 | 0 | 111.5 | I353 G357 F359 I362 | I353-L355 HydrophobicContact CG2-CB 3.95Å; I353-L355 HydrophobicContact CG2-CD1 3.29Å; I353-L355 HydrophobicContact CG2-CG 3.32Å; I353-L355 PolarHBondContact O-N 3.07Å; L355-G357 PolarHBondContact O-N 3.26Å; L355-F359 HydrophobicContact CD2-CD2 3.99Å; L355-I362 HydrophobicContact CD1-CD1 3.54Å; L355-I362 HydrophobicContact CD1-CG1 4.2Å | ||
| 356 | D | 34.9 | Very low | 36.7 | Very low | 112 Ų | 112 | 101.5 Ų | 101.5 | 60% | 0.599 | 56% | 0.558 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.9 | 104.4 | 173.9 | -78.6 | -29.1 | 0 | 0 | 0 | 109.1 | K361 | D356-K361 WeakPolarHBondContact OD1-CG 3.21Š|
| 357 | G | 39.2 | Very low | 35.8 | Very low | 77 Ų | 77 | 104 Ų | 104 | 79% | 0.794 | 58% | 0.576 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 157.8 | -39.1 | 170.9 | 0 | 0 | 0 | 0 | 0 | 114.6 | L355 | L355-G357 PolarHBondContact O-N 3.26Š|
| 358 | L | 41.5 | Very low | 34.9 | Very low | 104 Ų | 104 | 103.7 Ų | 103.7 | 55% | 0.545 | 59% | 0.585 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -135.1 | -23.4 | -174 | -132.2 | 90.1 | 0 | 0 | 0 | 116 | ||
| 359 | F | 40.6 | Very low | 34.4 | Very low | 80 Ų | 80 | 101.3 Ų | 101.3 | 35% | 0.351 | 58% | 0.58 | S | S | . | * | S | Bend | trans | -127.4 | 12.9 | -165.8 | -57.8 | -64.2 | 0 | 0 | 0 | 115.2 | Y292 Y324 L355 | Y292-F359 AromaticContact CE1-CD1 3.44Å; Y292-F359 HydrophobicContact CE1-CD1 3.44Å; Y292-F359 VanDerWaalsContact CE1-CD1 3.44Å; Y292-F359 HydrophobicContact CE1-CD2 4.06Å; Y292-F359 AromaticContact CE1-CE1 3.42Å; Y292-F359 HydrophobicContact CE1-CE1 3.42Å; Y292-F359 VanDerWaalsContact CE1-CE1 3.42Å; Y292-F359 HydrophobicContact CE1-CE2 4.03Å; Y292-F359 AromaticContact CE1-CG 3.76Å; Y292-F359 HydrophobicContact CE1-CG 3.76Å; Y292-F359 AromaticContact CE1-CZ 3.71Å; Y292-F359 HydrophobicContact CE1-CZ 3.71Å; Y292-F359 AromaticContact CZ-CD1 3.84Å; Y292-F359 AromaticContact CZ-CE1 3.65Å; Y292-F359 VanDerWaalsContact OH-CD1 3.31Å; Y292-F359 WeakPolarHBondContact OH-CD1 3.29Å; Y292-F359 WeakPolarHBondContact OH-CE1 3.37Å; Y324-F359 HydrophobicContact CE1-CE2 4.38Å; Y324-F359 HydrophobicContact CE1-CZ 4.48Å; L355-F359 HydrophobicContact CD2-CD2 3.99Å |
| 360 | G | 35.5 | Very low | 33.9 | Very low | 48 Ų | 48 | 104.5 Ų | 104.5 | 50% | 0.495 | 60% | 0.595 | S | S | . | * | trans | 83.3 | 158 | -180 | 0 | 0 | 0 | 0 | 0 | 113.9 | I362 | G360-I362 PolarHBondContact O-N 2.9Š| ||
| 361 | K | 33 | Very low | 33.5 | Very low | 173 Ų | 173 | 106.8 Ų | 106.8 | 75% | 0.752 | 61% | 0.609 | S | S | * | * | trans | -70.1 | 115.3 | 176.9 | -82.5 | 178.3 | 176.7 | -177.8 | 0 | 110.1 | D356 | D356-K361 WeakPolarHBondContact OD1-CG 3.21Š| ||
| 362 | I | 36.1 | Very low | 32.7 | Very low | 73 Ų | 73 | 108.2 Ų | 108.2 | 37% | 0.374 | 63% | 0.628 | S | S | . | * | P | Polyproline II helix | trans | -71.3 | 133.1 | 161.3 | -59.9 | -173.4 | 0 | 0 | 0 | 107 | I353 L355 G360 S364 | I353-I362 HydrophobicContact CB-CD1 4.44Å; I353-I362 HydrophobicContact CD1-CD1 4.04Å; I353-I362 HydrophobicContact CG2-CD1 4.05Å; L355-I362 HydrophobicContact CD1-CD1 3.54Å; L355-I362 HydrophobicContact CD1-CG1 4.2Å; G360-I362 PolarHBondContact O-N 2.9Å; I362-S364 PolarHBondContact O-N 3.06Å; I362-S364 VanDerWaalsContact O-N 3.11Å |
| 363 | P | 31.7 | Very low | 32.2 | Very low | 116 Ų | 116 | 109.2 Ų | 109.2 | 75% | 0.753 | 63% | 0.63 | S | S | * | * | P | Polyproline II helix | trans | -61.3 | 119.3 | 175.9 | -13.7 | 26.4 | 0 | 0 | 0 | 108.8 | L365 | P363-L365 PolarHBondContact O-N 3.16Š|
| 364 | S | 31 | Very low | 31.6 | Very low | 104 Ų | 104 | 111.6 Ų | 111.6 | 73% | 0.727 | 65% | 0.651 | S | S | * | * | P | Polyproline II helix | trans | -55.9 | 125.3 | 171.8 | -46.4 | 0 | 0 | 0 | 0 | 108.6 | I362 T366 | I362-S364 PolarHBondContact O-N 3.06Å; I362-S364 VanDerWaalsContact O-N 3.11Å; S364-T366 PolarHBondContact O-N 3.5Å |
| 365 | L | 27.4 | Very low | 31.1 | Very low | 152 Ų | 152 | 112.7 Ų | 112.7 | 80% | 0.796 | 66% | 0.657 | S | S | * | * | trans | -64.7 | 91.6 | 160.7 | -78.2 | 159.8 | 0 | 0 | 0 | 106.6 | P363 L367 | P363-L365 PolarHBondContact O-N 3.16Å; L365-L367 VanDerWaalsContact C-N 3.29Å; L365-L367 PolarHBondContact O-N 2.92Å | ||
| 366 | T | 25.4 | Very low | 30.5 | Very low | 121 Ų | 121 | 115.8 Ų | 115.8 | 74% | 0.742 | 68% | 0.682 | S | S | * | * | trans | -63.7 | 95.3 | 167.1 | 40.4 | 0 | 0 | 0 | 0 | 107.1 | S364 T368 | S364-T366 PolarHBondContact O-N 3.5Å; T366-T368 VanDerWaalsContact C-N 3.34Å; T366-T368 PolarHBondContact O-N 2.95Å | ||
| 367 | L | 26.9 | Very low | 30.2 | Very low | 133 Ų | 133 | 115.1 Ų | 115.1 | 70% | 0.696 | 69% | 0.686 | S | S | * | * | trans | -59.6 | 111.5 | 150.7 | -100.8 | 94.3 | 0 | 0 | 0 | 105.6 | C350 L365 S369 | C350-L367 HydrophobicContact CB-CD1 4.35Å; C350-L367 WeakPolarHBondContact SG-CD1 3.41Å; L365-L367 VanDerWaalsContact C-N 3.29Å; L365-L367 PolarHBondContact O-N 2.92Å; L367-S369 PolarHBondContact O-N 3.33Å | ||
| 368 | T | 26.3 | Very low | 29.9 | Very low | 125 Ų | 125 | 117.2 Ų | 117.2 | 77% | 0.767 | 69% | 0.685 | S | S | * | * | trans | -47.8 | 107.9 | 170.4 | 30.8 | 0 | 0 | 0 | 0 | 109.7 | T366 | T366-T368 VanDerWaalsContact C-N 3.34Å; T366-T368 PolarHBondContact O-N 2.95Å | ||
| 369 | S | 28.5 | Very low | 29.4 | Very low | 96 Ų | 96 | 117.4 Ų | 117.4 | 67% | 0.671 | 69% | 0.694 | S | S | * | * | trans | 35 | 114.9 | 143.3 | 54.9 | 0 | 0 | 0 | 0 | 117.6 | L367 P371 | L367-S369 PolarHBondContact O-N 3.33Å; S369-P371 WeakPolarHBondContact O-CD 3.32Å | ||
| 370 | Q | 27.7 | Very low | 28.8 | Very low | 176 Ų | 176 | 122.6 Ų | 122.6 | 82% | 0.822 | 72% | 0.717 | S | S | * | * | trans | -49.2 | 124.6 | 150.8 | -72.9 | 178.2 | -17.4 | 0 | 0 | 108.8 | T372 | Q370-T372 PolarHBondContact O-N 3.03Š| ||
| 371 | P | 25.8 | Very low | 28.6 | Very low | 113 Ų | 113 | 127 Ų | 127 | 73% | 0.734 | 73% | 0.734 | S | S | * | * | trans | -71 | 103.5 | 166.9 | 28.4 | -27.8 | 0 | 0 | 0 | 106.5 | S369 V373 | S369-P371 WeakPolarHBondContact O-CD 3.32Å; P371-V373 PolarHBondContact O-N 2.86Å | ||
| 372 | T | 26.2 | Very low | 28.6 | Very low | 128 Ų | 128 | 127 Ų | 127 | 79% | 0.785 | 74% | 0.737 | S | S | * | * | trans | -64.1 | 90.7 | 159.3 | 34.6 | 0 | 0 | 0 | 0 | 107.3 | Q370 S374 | Q370-T372 PolarHBondContact O-N 3.03Å; T372-S374 VanDerWaalsContact C-N 3.32Å; T372-S374 PolarHBondContact O-N 3.19Å | ||
| 373 | V | 24.9 | Very low | 28.3 | Very low | 103 Ų | 103 | 133.5 Ų | 133.5 | 62% | 0.624 | 76% | 0.762 | S | S | * | * | trans | -67.8 | 98.2 | 164 | -179.6 | 0 | 0 | 0 | 0 | 106.2 | P371 F375 | P371-V373 PolarHBondContact O-N 2.86Å; V373-F375 HydrophobicContact CG1-CD2 4.5Å; V373-F375 HydrophobicContact CG1-CE2 4.4Å; V373-F375 PolarHBondContact O-N 3.26Å; V373-F375 VanDerWaalsContact O-N 3.14Å | ||
| 374 | S | 24.5 | Very low | 28.1 | Very low | 101 Ų | 101 | 131.3 Ų | 131.3 | 71% | 0.706 | 76% | 0.76 | S | S | * | * | trans | -65.9 | 106 | 165.5 | 38.9 | 0 | 0 | 0 | 0 | 107.7 | T372 S376 | T372-S374 VanDerWaalsContact C-N 3.32Å; T372-S374 PolarHBondContact O-N 3.19Å; S374-S376 PolarHBondContact O-N 3.03Å | ||
| 375 | F | 25.5 | Very low | 28 | Very low | 189 Ų | 189 | 135.4 Ų | 135.4 | 83% | 0.829 | 77% | 0.768 | S | S | * | * | trans | -68.1 | 86.7 | 162.9 | -81.3 | -85.5 | 0 | 0 | 0 | 108.2 | V373 S377 | V373-F375 HydrophobicContact CG1-CD2 4.5Å; V373-F375 HydrophobicContact CG1-CE2 4.4Å; V373-F375 PolarHBondContact O-N 3.26Å; V373-F375 VanDerWaalsContact O-N 3.14Å; F375-S377 PolarHBondContact O-N 2.91Å; F375-S377 VanDerWaalsContact O-N 3.09Å | ||
| 376 | S | 28.7 | Very low | 28 | Very low | 108 Ų | 108 | 137.1 Ų | 137.1 | 76% | 0.755 | 77% | 0.772 | S | S | * | * | trans | -65.5 | 103.4 | 160.1 | 50.7 | 0 | 0 | 0 | 0 | 107.6 | S374 | S374-S376 PolarHBondContact O-N 3.03Š| ||
| 377 | S | 27.6 | Very low | 28.3 | Very low | 98 Ų | 98 | 137.6 Ų | 137.6 | 69% | 0.685 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -51.8 | 131.2 | 169.2 | -176.6 | 0 | 0 | 0 | 0 | 109.6 | F375 C379 | F375-S377 PolarHBondContact O-N 2.91Å; F375-S377 VanDerWaalsContact O-N 3.09Å; S377-C379 PolarHBondContact O-N 3.19Å |
| 378 | P | 34.1 | Very low | 28.4 | Very low | 120 Ų | 120 | 138.1 Ų | 138.1 | 78% | 0.779 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -66.8 | 124.6 | 167.2 | 22.9 | -21 | 0 | 0 | 0 | 108.3 | ||
| 379 | C | 29.4 | Very low | 28.6 | Very low | 109 Ų | 109 | 140.3 Ų | 140.3 | 74% | 0.736 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 168.8 | 173.2 | -58.6 | 0 | 0 | 0 | 0 | 111.4 | S377 | S377-C379 PolarHBondContact O-N 3.19Š|
| 380 | F | 28 | Very low | 28.7 | Very low | 189 Ų | 189 | 144.1 Ų | 144.1 | 83% | 0.829 | 79% | 0.789 | S | S | * | * | trans | 97.1 | 78.5 | 179.9 | -69 | -88.8 | 0 | 0 | 0 | 115.8 | ||||
| 381 | V | 31 | Very low | 28.9 | Very low | 141 Ų | 141 | 146 Ų | 146 | 86% | 0.855 | 80% | 0.795 | S | S | * | * | trans | -99.2 | 98.8 | 143.2 | 179.8 | 0 | 0 | 0 | 0 | 105.9 | K383 | V381-K383 PolarHBondContact O-N 3.42Š| ||
| 382 | E | 32.9 | Very low | 29.2 | Very low | 172 Ų | 172 | 147.8 Ų | 147.8 | 80% | 0.804 | 80% | 0.798 | S | S | * | * | trans | -63.6 | 128.3 | 159.6 | -90.6 | -176.6 | 152.2 | 0 | 0 | 108 | ||||
| 383 | K | 29.8 | Very low | 29.4 | Very low | 210 Ų | 210 | 148.4 Ų | 148.4 | 91% | 0.913 | 80% | 0.796 | S | S | * | * | trans | -70 | 127.6 | 171 | -79.4 | 179 | 171.8 | 179.1 | 0 | 108.9 | V381 | V381-K383 PolarHBondContact O-N 3.42Š| ||
| 384 | G | 27.6 | Very low | 29.8 | Very low | 69 Ų | 69 | 149.4 Ų | 149.4 | 71% | 0.711 | 81% | 0.807 | S | S | * | * | trans | 123.6 | 95.3 | 155.6 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 385 | E | 29.8 | Very low | 30.1 | Very low | 190 Ų | 190 | 151.1 Ų | 151.1 | 89% | 0.888 | 81% | 0.809 | S | S | * | * | -172.6 | 130.1 | 110.6 | -105 | 178.2 | 163.2 | 0 | 0 | 108.4 | V387 | E385-V387 PolarHBondContact O-N 2.92Š| |||
| 386 | E | 26.6 | Very low | 30.5 | Very low | 188 Ų | 188 | 149.5 Ų | 149.5 | 88% | 0.879 | 81% | 0.809 | S | S | * | * | trans | -59.8 | 124.1 | 173.7 | -68.2 | 166.3 | 156.7 | 0 | 0 | 109.3 | ||||
| 387 | V | 32.3 | Very low | 30.8 | Very low | 132 Ų | 132 | 150.3 Ų | 150.3 | 80% | 0.8 | 81% | 0.805 | S | S | * | * | trans | -119.8 | 82 | 156.6 | -173.9 | 0 | 0 | 0 | 0 | 106 | E385 | E385-V387 PolarHBondContact O-N 2.92Š| ||
| 388 | D | 29.4 | Very low | 30.8 | Very low | 144 Ų | 144 | 152.1 Ų | 152.1 | 77% | 0.77 | 81% | 0.807 | S | S | * | * | trans | -58.6 | 147.4 | 147.8 | -93.8 | -29.6 | 0 | 0 | 0 | 108.4 | ||||
| 389 | E | 30.5 | Very low | 30.6 | Very low | 171 Ų | 171 | 155.1 Ų | 155.1 | 80% | 0.799 | 82% | 0.815 | S | S | * | * | trans | 77 | 84.9 | 171.5 | -54 | -178.2 | 177.9 | 0 | 0 | 117.9 | ||||
| 390 | M | 30.3 | Very low | 30.5 | Very low | 176 Ų | 176 | 155.8 Ų | 155.8 | 87% | 0.867 | 82% | 0.816 | S | S | * | * | -179.5 | 84.1 | 123.6 | -109 | 178.2 | -96.8 | 0 | 0 | 111.4 | |||||
| 391 | F | 32.9 | Very low | 30.7 | Very low | 215 Ų | 215 | 154.6 Ų | 154.6 | 94% | 0.943 | 82% | 0.818 | S | S | * | * | trans | -140.2 | 70 | 151.3 | -83.8 | -73.9 | 0 | 0 | 0 | 108.6 | ||||
| 392 | D | 32.3 | Very low | 30.6 | Very low | 150 Ų | 150 | 152 Ų | 152 | 80% | 0.802 | 81% | 0.806 | S | S | * | * | trans | -99.9 | 105.7 | 157.3 | -90.8 | -30.1 | 0 | 0 | 0 | 109 | ||||
| 393 | L | 30.3 | Very low | 30.4 | Very low | 141 Ų | 141 | 150.1 Ų | 150.1 | 74% | 0.738 | 80% | 0.801 | S | S | * | * | trans | 41.6 | 117.1 | 133.8 | -56.6 | 170 | 0 | 0 | 0 | 119.2 | ||||
| 394 | S | 32.6 | Very low | 30.3 | Very low | 124 Ų | 124 | 148.7 Ų | 148.7 | 87% | 0.867 | 80% | 0.795 | S | S | * | * | -145.9 | 126.6 | 118.2 | 49.4 | 0 | 0 | 0 | 0 | 110.4 | |||||
| 395 | N | 31.5 | Very low | 30.3 | Very low | 137 Ų | 137 | 154.1 Ų | 154.1 | 73% | 0.733 | 80% | 0.802 | S | S | * | * | trans | -69 | 146 | 173.3 | -70.6 | -43 | 0 | 0 | 0 | 110.2 | ||||
| 396 | D | 33.8 | Very low | 30 | Very low | 155 Ų | 155 | 151.3 Ų | 151.3 | 83% | 0.829 | 80% | 0.797 | S | S | * | * | trans | -145.8 | 111.5 | 134.2 | -95.1 | -24.2 | 0 | 0 | 0 | 109.1 | ||||
| 397 | D | 33.5 | Very low | 30.1 | Very low | 126 Ų | 126 | 149.1 Ų | 149.1 | 67% | 0.674 | 79% | 0.791 | S | S | * | * | trans | 61 | 104.9 | 139.1 | -64 | -14.8 | 0 | 0 | 0 | 122.8 | ||||
| 398 | N | 28.6 | Very low | 29.8 | Very low | 135 Ų | 135 | 154 Ų | 154 | 72% | 0.722 | 80% | 0.796 | S | S | * | * | 60.3 | 88.5 | 123.7 | -67 | -32 | 0 | 0 | 0 | 118.9 | |||||
| 399 | L | 29.7 | Very low | 29.6 | Very low | 184 Ų | 184 | 156.9 Ų | 156.9 | 96% | 0.963 | 80% | 0.802 | S | S | * | * | trans | -143.3 | 96.6 | 134.9 | -94.9 | 166.3 | 0 | 0 | 0 | 109.1 | ||||
| 400 | T | 27.1 | Very low | 29.3 | Very low | 123 Ų | 123 | 152.9 Ų | 152.9 | 76% | 0.755 | 80% | 0.798 | S | S | * | * | trans | -92.4 | 117.7 | 166.4 | 39 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 401 | L | 31.7 | Very low | 29 | Very low | 164 Ų | 164 | 152.3 Ų | 152.3 | 86% | 0.859 | 80% | 0.797 | S | S | * | * | trans | -167.1 | 101.4 | 140.8 | -106.9 | 142.8 | 0 | 0 | 0 | 111.3 | ||||
| 402 | S | 29.5 | Very low | 28.6 | Very low | 87 Ų | 87 | 147.8 Ų | 147.8 | 61% | 0.608 | 79% | 0.791 | S | S | * | * | trans | 3.8 | 126.8 | 148.5 | 64.4 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 403 | N | 28.5 | Very low | 28.1 | Very low | 131 Ų | 131 | 152.1 Ų | 152.1 | 70% | 0.701 | 80% | 0.796 | S | S | * | * | 154.5 | 127.7 | 92.9 | -105.9 | -35.9 | 0 | 0 | 0 | 111.7 | |||||
| 404 | K | 27.2 | Very low | 27.9 | Very low | 181 Ų | 181 | 150.1 Ų | 150.1 | 79% | 0.787 | 80% | 0.8 | S | S | * | * | trans | 57 | 102.8 | 145.4 | -63.9 | 175.8 | 179.2 | 177.6 | 0 | 118.4 | ||||
| 405 | Q | 28.2 | Very low | 27.6 | Very low | 182 Ų | 182 | 149.4 Ų | 149.4 | 85% | 0.85 | 80% | 0.795 | S | S | * | * | -167.1 | 118.3 | 96.3 | -106.7 | 178.4 | -6.1 | 0 | 0 | 110.8 | N407 | Q405-N407 PolarHBondContact O-N 3.24Š| |||
| 406 | V | 24 | Very low | 27.2 | Very low | 131 Ų | 131 | 148.8 Ų | 148.8 | 79% | 0.794 | 80% | 0.802 | S | S | * | * | trans | -64.4 | 110.5 | 167.3 | 173.3 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 407 | N | 28.4 | Very low | 26.9 | Very low | 142 Ų | 142 | 145.6 Ų | 145.6 | 76% | 0.759 | 79% | 0.792 | S | S | * | * | trans | -111.1 | 106.5 | 156.9 | -92.1 | -19.3 | 0 | 0 | 0 | 108.9 | Q405 F409 | Q405-N407 PolarHBondContact O-N 3.24Å; N407-F409 PolarHBondContact O-N 2.83Å | ||
| 408 | R | 24.8 | Very low | 26.6 | Very low | 235 Ų | 235 | 147.1 Ų | 147.1 | 89% | 0.887 | 80% | 0.8 | S | S | * | * | trans | -66 | 110.9 | -179.1 | -154 | 175.8 | -176.7 | 157.1 | -1.4 | 108.1 | A410 | R408-A410 PolarHBondContact O-N 3.43Š| ||
| 409 | F | 25.9 | Very low | 26.3 | Very low | 204 Ų | 204 | 151.5 Ų | 151.5 | 90% | 0.895 | 81% | 0.808 | S | S | * | * | trans | -76 | 112.1 | 166 | -80.2 | -83.5 | 0 | 0 | 0 | 108.3 | N407 L411 | N407-F409 PolarHBondContact O-N 2.83Å; F409-L411 PolarHBondContact O-N 3Å | ||
| 410 | A | 25.3 | Very low | 26.3 | Very low | 87 Ų | 87 | 148.9 Ų | 148.9 | 72% | 0.719 | 80% | 0.799 | S | S | * | * | trans | -68.3 | 117.5 | 172.3 | 0 | 0 | 0 | 0 | 0 | 109.1 | R408 C412 | R408-A410 PolarHBondContact O-N 3.43Å; A410-C412 PolarHBondContact O-N 2.88Å; A410-C412 VanDerWaalsContact O-N 3.14Å | ||
| 411 | L | 22.8 | Very low | 26.3 | Very low | 164 Ų | 164 | 151.6 Ų | 151.6 | 86% | 0.859 | 80% | 0.803 | S | S | * | * | trans | -74.3 | 92.8 | 169.7 | -164.6 | 85.6 | 0 | 0 | 0 | 108 | F409 R413 | F409-L411 PolarHBondContact O-N 3Å; L411-R413 PolarHBondContact O-N 2.98Å; L411-R413 VanDerWaalsContact O-N 3.09Å | ||
| 412 | C | 24.9 | Very low | 26.2 | Very low | 121 Ų | 121 | 149.7 Ų | 149.7 | 82% | 0.818 | 80% | 0.804 | S | S | * | * | trans | -73.6 | 99.1 | 169.9 | -73.1 | 0 | 0 | 0 | 0 | 109.2 | A410 A414 | A410-C412 PolarHBondContact O-N 2.88Å; A410-C412 VanDerWaalsContact O-N 3.14Å; C412-A414 PolarHBondContact O-N 2.91Å; C412-A414 VanDerWaalsContact O-N 3.15Å | ||
| 413 | R | 22.9 | Very low | 26 | Very low | 240 Ų | 240 | 150.3 Ų | 150.3 | 91% | 0.906 | 81% | 0.808 | S | S | * | * | trans | -60.2 | 104.7 | 157.8 | -101.9 | 179.6 | 177.6 | 163.3 | -0.2 | 107.9 | L411 | L411-R413 PolarHBondContact O-N 2.98Å; L411-R413 VanDerWaalsContact O-N 3.09Å | ||
| 414 | A | 25.3 | Very low | 25.8 | Very low | 100 Ų | 100 | 151.3 Ų | 151.3 | 83% | 0.826 | 81% | 0.813 | S | S | * | * | trans | -86.8 | 117.1 | 161.7 | 0 | 0 | 0 | 0 | 0 | 108.2 | C412 | C412-A414 PolarHBondContact O-N 2.91Å; C412-A414 VanDerWaalsContact O-N 3.15Å | ||
| 415 | S | 26.1 | Very low | 26 | Very low | 109 Ų | 109 | 152.3 Ų | 152.3 | 76% | 0.762 | 82% | 0.818 | S | S | * | * | trans | -68.3 | 136.1 | 177.8 | 46.1 | 0 | 0 | 0 | 0 | 111.5 | S417 | S415-S417 PolarHBondContact O-N 3.45Š| ||
| 416 | S | 23.4 | Very low | 25.8 | Very low | 123 Ų | 123 | 151.7 Ų | 151.7 | 86% | 0.86 | 82% | 0.819 | S | S | * | * | trans | -76 | 107.4 | 167.4 | 56.9 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 417 | S | 26.6 | Very low | 26 | Very low | 89 Ų | 89 | 153.1 Ų | 153.1 | 62% | 0.622 | 82% | 0.817 | S | S | * | * | trans | -163.8 | 104.4 | 152 | 58.1 | 0 | 0 | 0 | 0 | 108.1 | S415 | S415-S417 PolarHBondContact O-N 3.45Š| ||
| 418 | D | 26.9 | Very low | 25.7 | Very low | 158 Ų | 158 | 155.3 Ų | 155.3 | 85% | 0.845 | 82% | 0.823 | S | S | * | * | 170.4 | 98 | 123.9 | -78.6 | -12.6 | 0 | 0 | 0 | 108.3 | |||||
| 419 | Y | 24.1 | Very low | 25.9 | Very low | 227 Ų | 227 | 151.4 Ų | 151.4 | 89% | 0.89 | 82% | 0.815 | S | S | * | * | trans | -83.9 | 131.8 | 154.1 | -100.7 | -94.7 | 0 | 0 | 0 | 106.7 | ||||
| 420 | V | 29.1 | Very low | 25.7 | Very low | 129 Ų | 129 | 149.6 Ų | 149.6 | 78% | 0.782 | 81% | 0.814 | S | S | * | * | -168.6 | 116.5 | 122.9 | 168.5 | 0 | 0 | 0 | 0 | 109.9 | |||||
| 421 | Q | 26.3 | Very low | 25.8 | Very low | 179 Ų | 179 | 150 Ų | 150 | 84% | 0.836 | 81% | 0.812 | S | S | * | * | trans | 17.5 | 132 | 143.4 | -64.3 | 170.1 | -28.3 | 0 | 0 | 120.9 | ||||
| 422 | S | 29.3 | Very low | 25.8 | Very low | 124 Ų | 124 | 152.2 Ų | 152.2 | 87% | 0.867 | 82% | 0.815 | S | S | * | * | -161.6 | 156 | 101.5 | 65.7 | 0 | 0 | 0 | 0 | 111.9 | |||||
| 423 | S | 26.8 | Very low | 25.7 | Very low | 100 Ų | 100 | 152.5 Ų | 152.5 | 70% | 0.699 | 81% | 0.812 | S | S | * | * | trans | -106.2 | 159.3 | -154.7 | 41.6 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 424 | N | 24.1 | Very low | 25.7 | Very low | 152 Ų | 152 | 143.9 Ų | 143.9 | 81% | 0.813 | 80% | 0.799 | S | S | * | * | trans | 68.6 | 111.7 | 154.1 | -63.6 | -12 | 0 | 0 | 0 | 118.4 | ||||
| 425 | K | 30 | Very low | 25.6 | Very low | 202 Ų | 202 | 146.9 Ų | 146.9 | 88% | 0.878 | 80% | 0.8 | S | S | * | * | -160.1 | 131 | 118.2 | -104.5 | 172.5 | -175.1 | -173.2 | 0 | 110.6 | E427 | K425-E427 PolarHBondContact O-N 3.03Š| |||
| 426 | L | 24 | Very low | 25.4 | Very low | 170 Ų | 170 | 149 Ų | 149 | 89% | 0.89 | 80% | 0.798 | S | S | * | * | trans | -53.8 | 123.1 | 157.8 | -112.6 | 78.8 | 0 | 0 | 0 | 108.2 | ||||
| 427 | E | 28.9 | Very low | 25.3 | Very low | 161 Ų | 161 | 148.6 Ų | 148.6 | 75% | 0.752 | 79% | 0.794 | S | S | * | * | trans | -141.2 | 119.4 | 144.8 | -74.9 | -168.4 | 160.5 | 0 | 0 | 108 | K425 H429 | K425-E427 PolarHBondContact O-N 3.03Å; E427-H429 PolarHBondContact O-N 3.32Å | ||
| 428 | E | 23.1 | Very low | 25.1 | Very low | 188 Ų | 188 | 154.8 Ų | 154.8 | 88% | 0.879 | 80% | 0.804 | S | S | * | * | trans | -61.1 | 116.9 | 165.7 | -70.9 | 169.9 | 146.7 | 0 | 0 | 108.1 | ||||
| 429 | H | 28.5 | Very low | 24.9 | Very low | 153 Ų | 153 | 155.6 Ų | 155.6 | 71% | 0.708 | 80% | 0.802 | S | S | * | * | trans | -122.6 | 96.4 | 161 | -91.5 | -60.3 | 0 | 0 | 0 | 109 | E427 S431 | E427-H429 PolarHBondContact O-N 3.32Å; H429-S431 PolarHBondContact O-N 3.39Å; H429-S431 VanDerWaalsContact O-N 3.08Å | ||
| 430 | D | 21.9 | Very low | 24.8 | Very low | 166 Ų | 166 | 153 Ų | 153 | 89% | 0.888 | 80% | 0.803 | S | S | * | * | trans | -49.8 | 107.7 | 152.6 | -83 | -33 | 0 | 0 | 0 | 108.6 | ||||
| 431 | S | 27.7 | Very low | 24.4 | Very low | 95 Ų | 95 | 152.3 Ų | 152.3 | 66% | 0.664 | 80% | 0.798 | S | S | * | * | trans | -130.4 | 99 | 159.9 | 48.7 | 0 | 0 | 0 | 0 | 108.2 | H429 V433 | H429-S431 PolarHBondContact O-N 3.39Å; H429-S431 VanDerWaalsContact O-N 3.08Å; S431-V433 PolarHBondContact O-N 2.95Å | ||
| 432 | F | 22 | Very low | 24.2 | Very low | 211 Ų | 211 | 148.3 Ų | 148.3 | 93% | 0.925 | 79% | 0.791 | S | S | * | * | trans | -49.5 | 106.4 | 159.4 | -111.3 | -100.8 | 0 | 0 | 0 | 108.5 | G434 | F432-G434 VanDerWaalsContact C-N 3.33Å; F432-G434 PolarHBondContact O-N 3.43Å; F432-G434 VanDerWaalsContact O-N 3.12Å | ||
| 433 | V | 23.7 | Very low | 23.9 | Very low | 126 Ų | 126 | 148.8 Ų | 148.8 | 76% | 0.764 | 79% | 0.788 | S | S | * | * | trans | -78.9 | 91.6 | 165.1 | 179.3 | 0 | 0 | 0 | 0 | 106.4 | S431 L435 | S431-V433 PolarHBondContact O-N 2.95Å; V433-L435 PolarHBondContact O-N 2.9Å; V433-L435 VanDerWaalsContact O-N 3.13Å | ||
| 434 | G | 22.1 | Very low | 23.7 | Very low | 60 Ų | 60 | 149.7 Ų | 149.7 | 62% | 0.619 | 79% | 0.789 | S | S | * | * | trans | -61.1 | 108.9 | 167.6 | 0 | 0 | 0 | 0 | 0 | 109.4 | F432 E436 | F432-G434 VanDerWaalsContact C-N 3.33Å; F432-G434 PolarHBondContact O-N 3.43Å; F432-G434 VanDerWaalsContact O-N 3.12Å; G434-E436 VanDerWaalsContact C-N 3.25Å; G434-E436 PolarHBondContact O-N 2.91Å | ||
| 435 | L | 22.1 | Very low | 23.8 | Very low | 162 Ų | 162 | 147.4 Ų | 147.4 | 85% | 0.848 | 79% | 0.785 | S | S | * | * | trans | -68.9 | 87.1 | 160.8 | -92.1 | 140.9 | 0 | 0 | 0 | 107.7 | V433 C437 | V433-L435 PolarHBondContact O-N 2.9Å; V433-L435 VanDerWaalsContact O-N 3.13Å; L435-C437 VanDerWaalsContact C-N 3.35Å; L435-C437 PolarHBondContact O-N 3.32Å; L435-C437 VanDerWaalsContact O-N 3.09Å | ||
| 436 | E | 22.4 | Very low | 23.7 | Very low | 154 Ų | 154 | 143.4 Ų | 143.4 | 72% | 0.72 | 78% | 0.78 | S | S | * | * | trans | -72.2 | 96.9 | 161.5 | -78.4 | -174.5 | 167.5 | 0 | 0 | 108.2 | G434 W438 | G434-E436 VanDerWaalsContact C-N 3.25Å; G434-E436 PolarHBondContact O-N 2.91Å; E436-W438 PolarHBondContact O-N 3.48Å; E436-W438 VanDerWaalsContact O-N 3.09Å | ||
| 437 | C | 21.5 | Very low | 23.8 | Very low | 115 Ų | 115 | 141.7 Ų | 141.7 | 78% | 0.777 | 78% | 0.776 | S | S | * | * | trans | -60.6 | 103 | 161.2 | -74.6 | 0 | 0 | 0 | 0 | 108.7 | L435 E439 | L435-C437 VanDerWaalsContact C-N 3.35Å; L435-C437 PolarHBondContact O-N 3.32Å; L435-C437 VanDerWaalsContact O-N 3.09Å; C437-E439 PolarHBondContact O-N 3.06Å | ||
| 438 | W | 23.4 | Very low | 23.6 | Very low | 219 Ų | 219 | 141.6 Ų | 141.6 | 83% | 0.83 | 78% | 0.776 | S | S | * | * | trans | -75.9 | 101.8 | 161.1 | -71.4 | 83.4 | 0 | 0 | 0 | 107.9 | E436 L440 | E436-W438 PolarHBondContact O-N 3.48Å; E436-W438 VanDerWaalsContact O-N 3.09Å; W438-L440 PolarHBondContact O-N 3.01Å; W438-L440 VanDerWaalsContact O-N 3.15Å | ||
| 439 | E | 21.6 | Very low | 23.7 | Very low | 175 Ų | 175 | 138.8 Ų | 138.8 | 82% | 0.818 | 77% | 0.774 | S | S | * | * | trans | -54 | 114.3 | 164.1 | -87.7 | -178.3 | 143.8 | 0 | 0 | 109 | C437 V441 | C437-E439 PolarHBondContact O-N 3.06Å; E439-V441 VanDerWaalsContact C-N 3.25Å; E439-V441 PolarHBondContact O-N 3.3Å | ||
| 440 | L | 22.2 | Very low | 23.5 | Very low | 172 Ų | 172 | 141.8 Ų | 141.8 | 90% | 0.901 | 78% | 0.779 | S | S | * | * | trans | -65.1 | 91.5 | 161.1 | -113.2 | 137.8 | 0 | 0 | 0 | 107 | W438 S442 | W438-L440 PolarHBondContact O-N 3.01Å; W438-L440 VanDerWaalsContact O-N 3.15Å; L440-S442 PolarHBondContact O-N 3.2Å | ||
| 441 | V | 21.2 | Very low | 23.5 | Very low | 114 Ų | 114 | 142.1 Ų | 142.1 | 69% | 0.691 | 78% | 0.78 | S | S | * | * | trans | -67.2 | 100.1 | 167.2 | 178.7 | 0 | 0 | 0 | 0 | 107 | E439 V443 | E439-V441 VanDerWaalsContact C-N 3.25Å; E439-V441 PolarHBondContact O-N 3.3Å; V441-V443 HydrophobicContact CG1-CG2 4.48Å; V441-V443 PolarHBondContact O-N 3.22Å; V441-V443 VanDerWaalsContact O-N 3.09Å | ||
| 442 | S | 22.2 | Very low | 23.4 | Very low | 96 Ų | 96 | 143.4 Ų | 143.4 | 67% | 0.671 | 79% | 0.787 | S | S | * | * | trans | -65.2 | 103.2 | 168.1 | 62.7 | 0 | 0 | 0 | 0 | 108.5 | L440 T444 | L440-S442 PolarHBondContact O-N 3.2Å; S442-T444 PolarHBondContact O-N 3.05Å | ||
| 443 | V | 23.1 | Very low | 23.4 | Very low | 134 Ų | 134 | 141.9 Ų | 141.9 | 81% | 0.812 | 78% | 0.783 | S | S | * | * | trans | -78.3 | 101.8 | 162.2 | -175.1 | 0 | 0 | 0 | 0 | 106.7 | V441 | V441-V443 HydrophobicContact CG1-CG2 4.48Å; V441-V443 PolarHBondContact O-N 3.22Å; V441-V443 VanDerWaalsContact O-N 3.09Å | ||
| 444 | T | 22.5 | Very low | 23.4 | Very low | 119 Ų | 119 | 142.2 Ų | 142.2 | 73% | 0.73 | 79% | 0.786 | S | S | * | * | trans | -60.6 | 128.8 | 173.1 | 44.1 | 0 | 0 | 0 | 0 | 110.8 | S442 | S442-T444 PolarHBondContact O-N 3.05Š| ||
| 445 | S | 25.6 | Very low | 23.5 | Very low | 104 Ų | 104 | 144.9 Ų | 144.9 | 73% | 0.727 | 79% | 0.79 | S | S | * | * | trans | -48.4 | 158 | 165.9 | -155 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 446 | P | 28.8 | Very low | 23.5 | Very low | 117 Ų | 117 | 145.9 Ų | 145.9 | 76% | 0.76 | 79% | 0.793 | S | S | * | * | -154.1 | 128.4 | 76.7 | 35.8 | -13.8 | 0 | 0 | 0 | 116.1 | |||||
| 447 | V | 24.8 | Very low | 23.6 | Very low | 135 Ų | 135 | 145.1 Ų | 145.1 | 82% | 0.818 | 79% | 0.792 | S | S | * | * | trans | -144.4 | 120.2 | 142.8 | -172.7 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 448 | E | 24.3 | Very low | 23.7 | Very low | 158 Ų | 158 | 147.2 Ų | 147.2 | 74% | 0.738 | 80% | 0.796 | S | S | * | * | trans | -57 | 138.3 | 172.8 | -62.5 | 171.4 | 148.4 | 0 | 0 | 111.5 | R450 | E448-R450 PolarHBondContact O-N 3.25Å; E448-R450 VanDerWaalsContact O-N 3.14Å | ||
| 449 | P | 26.5 | Very low | 23.9 | Very low | 129 Ų | 129 | 141.9 Ų | 141.9 | 84% | 0.838 | 80% | 0.798 | S | S | * | * | trans | -77.5 | 100.8 | 162 | 31 | -25.8 | 0 | 0 | 0 | 107.3 | L451 | P449-L451 PolarHBondContact O-N 3.18Š| ||
| 450 | R | 24.4 | Very low | 24 | Very low | 216 Ų | 216 | 136.1 Ų | 136.1 | 82% | 0.815 | 79% | 0.785 | S | S | * | * | trans | -60.5 | 125.4 | 162.6 | -78.2 | -173.4 | 177.1 | -178.2 | -0.8 | 108 | E448 C452 | E448-R450 PolarHBondContact O-N 3.25Å; E448-R450 VanDerWaalsContact O-N 3.14Å; R450-C452 PolarHBondContact O-N 3.06Å; R450-C452 VanDerWaalsContact O-N 3.09Å | ||
| 451 | L | 22.5 | Very low | 24.2 | Very low | 174 Ų | 174 | 134.2 Ų | 134.2 | 91% | 0.911 | 79% | 0.787 | S | S | * | * | trans | -47.5 | 110.7 | 166.9 | -76.4 | 138 | 0 | 0 | 0 | 109.4 | P449 | P449-L451 PolarHBondContact O-N 3.18Š| ||
| 452 | C | 25 | Very low | 24.5 | Very low | 122 Ų | 122 | 136 Ų | 136 | 82% | 0.824 | 79% | 0.789 | S | S | * | * | trans | -86.2 | 113.9 | 163 | -77.2 | 0 | 0 | 0 | 0 | 107.8 | R450 T454 | R450-C452 PolarHBondContact O-N 3.06Å; R450-C452 VanDerWaalsContact O-N 3.09Å; C452-T454 PolarHBondContact O-N 3.26Å | ||
| 453 | E | 21.8 | Very low | 24.9 | Very low | 178 Ų | 178 | 136.4 Ų | 136.4 | 83% | 0.832 | 78% | 0.784 | S | S | * | * | trans | -57.7 | 126.4 | 169.1 | -71.6 | 174.9 | 148.1 | 0 | 0 | 110 | T455 | E453-T455 VanDerWaalsContact C-N 3.33Å; E453-T455 PolarHBondContact O-N 3.31Å | ||
| 454 | T | 24.2 | Very low | 25.7 | Very low | 134 Ų | 134 | 134.5 Ų | 134.5 | 82% | 0.822 | 78% | 0.776 | S | S | * | * | trans | -76.1 | 82.6 | 175.3 | -35.9 | 0 | 0 | 0 | 0 | 109.5 | C452 M456 | C452-T454 PolarHBondContact O-N 3.26Å; T454-M456 PolarHBondContact O-N 3.05Å | ||
| 455 | T | 23.1 | Very low | 26.8 | Very low | 115 Ų | 115 | 134 Ų | 134 | 71% | 0.706 | 77% | 0.773 | S | S | * | * | trans | -77.3 | 104.1 | 164.4 | 22.1 | 0 | 0 | 0 | 0 | 109.7 | E453 I457 | E453-T455 VanDerWaalsContact C-N 3.33Å; E453-T455 PolarHBondContact O-N 3.31Å; T455-I457 PolarHBondContact O-N 2.88Å | ||
| 456 | M | 22.9 | Very low | 27.6 | Very low | 184 Ų | 184 | 136.1 Ų | 136.1 | 91% | 0.906 | 77% | 0.772 | S | S | * | * | trans | -66.2 | 106 | 164.2 | -71.4 | -96.9 | -76.7 | 0 | 0 | 108.6 | T454 | T454-M456 PolarHBondContact O-N 3.05Š| ||
| 457 | I | 24.6 | Very low | 28.3 | Very low | 137 Ų | 137 | 139.6 Ų | 139.6 | 70% | 0.703 | 77% | 0.771 | S | S | * | * | trans | -106.8 | 118.4 | 170.3 | -57 | 178.5 | 0 | 0 | 0 | 107.8 | T455 A459 | T455-I457 PolarHBondContact O-N 2.88Å; I457-A459 PolarHBondContact O-N 3.34Å | ||
| 458 | N | 23.6 | Very low | 30.1 | Very low | 160 Ų | 160 | 137 Ų | 137 | 86% | 0.856 | 76% | 0.757 | S | S | * | * | trans | -54.6 | 115.1 | 170.3 | -87.7 | -25.9 | 0 | 0 | 0 | 109.9 | G460 | N458-G460 VanDerWaalsContact C-N 3.34Å; N458-G460 PolarHBondContact O-N 2.91Å | ||
| 459 | A | 26.5 | Very low | 32 | Very low | 107 Ų | 107 | 130.4 Ų | 130.4 | 88% | 0.884 | 73% | 0.731 | S | S | * | * | trans | -77.6 | 84.2 | 171.6 | 0 | 0 | 0 | 0 | 0 | 110 | I457 | I457-A459 PolarHBondContact O-N 3.34Š| ||
| 460 | G | 23.4 | Very low | 34.4 | Very low | 53 Ų | 53 | 128.3 Ų | 128.3 | 55% | 0.546 | 72% | 0.718 | S | S | . | * | trans | -80.4 | 151.1 | 152.7 | 0 | 0 | 0 | 0 | 0 | 109.4 | N458 M462 | N458-G460 VanDerWaalsContact C-N 3.34Å; N458-G460 PolarHBondContact O-N 2.91Å; G460-M462 PolarHBondContact O-N 3.37Å | ||
| 461 | S | 27.8 | Very low | 37.1 | Very low | 133 Ų | 133 | 118.8 Ų | 118.8 | 93% | 0.93 | 68% | 0.683 | S | S | * | * | trans | -39.4 | 109.2 | -174.5 | 60.7 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 462 | M | 27.8 | Very low | 39.6 | Very low | 151 Ų | 151 | 111.2 Ų | 111.2 | 74% | 0.744 | 65% | 0.645 | S | S | * | * | trans | -97.3 | 122.3 | 177.4 | -79.2 | -153.8 | 161.8 | 0 | 0 | 110.8 | G460 S464 | G460-M462 PolarHBondContact O-N 3.37Å; M462-S464 PolarHBondContact O-N 2.94Å | ||
| 463 | D | 30.8 | Very low | 42.1 | Very low | 104 Ų | 104 | 113 Ų | 113 | 56% | 0.556 | 64% | 0.638 | S | S | * | * | trans | -61.2 | 119.4 | 168.4 | -159.9 | -20.6 | 0 | 0 | 0 | 109 | T465 Q466 | D463-T465 PolarHBondContact O-N 3.33Å; D463-T465 PolarHBondContact OD1-OG1 3.49Å; D463-Q466 PolarHBondContact O-N 3.1Å | ||
| 464 | S | 38 | Very low | 44.5 | Very low | 94 Ų | 94 | 106 Ų | 106 | 66% | 0.657 | 61% | 0.607 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.1 | -0.2 | -170.8 | 59.1 | 0 | 0 | 0 | 0 | 114.3 | M462 | M462-S464 PolarHBondContact O-N 2.94Š|
| 465 | T | 45.5 | Very low | 47 | Very low | 109 Ų | 109 | 101.8 Ų | 101.8 | 67% | 0.669 | 58% | 0.577 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.3 | -17.2 | 178.9 | 55.5 | 0 | 0 | 0 | 0 | 114 | D463 | D463-T465 PolarHBondContact O-N 3.33Å; D463-T465 PolarHBondContact OD1-OG1 3.49Å |
| 466 | Q | 42.6 | Very low | 49.4 | Very low | 149 Ų | 149 | 103.9 Ų | 103.9 | 70% | 0.696 | 57% | 0.572 | S | S | * | * | S | Bend | trans | -95.9 | -20 | -169.4 | -73.8 | -175.8 | 4.6 | 0 | 0 | 116.1 | D463 | D463-Q466 PolarHBondContact O-N 3.1Š|
| 467 | Y | 43.6 | Very low | 51.7 | Low | 190 Ų | 190 | 99.4 Ų | 99.4 | 75% | 0.745 | 55% | 0.551 | S | S | * | * | S | Bend | trans | -137.9 | 111.2 | 170.2 | -83.2 | -87.6 | 0 | 0 | 0 | 109.6 | G469 | Y467-G469 PolarHBondContact O-N 2.85Š|
| 468 | P | 62.3 | Low | 53.9 | Low | 80 Ų | 80 | 92.9 Ų | 92.9 | 52% | 0.519 | 52% | 0.518 | S | S | . | . | trans | -71.1 | 108 | 178.3 | 29.6 | -30.7 | 0 | 0 | 0 | 106.9 | S472 | P468-S472 WeakPolarHBondContact CB-OG 3.3Š| ||
| 469 | G | 66.1 | Low | 56.2 | Low | 19 Ų | 19 | 90 Ų | 90 | 20% | 0.196 | 50% | 0.497 | C | S | . | . | trans | -62.7 | 173.1 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112 | E195 Y467 L471 S472 | E195-G469 WeakPolarHBondContact OE1-CA 3.24Å; Y467-G469 PolarHBondContact O-N 2.85Å; G469-L471 PolarHBondContact O-N 3.17Å; G469-S472 WeakPolarHBondContact O-CB 3.42Å; G469-S472 PolarHBondContact O-N 3.22Å; G469-S472 PolarHBondContact O-OG 3.33Å | ||
| 470 | P | 75.1 | Confident | 58.1 | Low | 86 Ų | 86 | 87.9 Ų | 87.9 | 56% | 0.558 | 49% | 0.486 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.5 | -28.3 | -166.6 | 11.2 | -22.1 | 0 | 0 | 0 | 114.4 | Y192 E195 | Y192-P470 HydrophobicContact CD1-CB 4.12Å; Y192-P470 HydrophobicContact CD1-CG 3.73Å; Y192-P470 HydrophobicContact CE1-CB 3.5Å; Y192-P470 VanDerWaalsContact CE1-CB 3.5Å; Y192-P470 HydrophobicContact CE1-CG 3.36Å; E195-P470 WeakPolarHBondContact OE2-CD 3.49Å; E195-P470 WeakPolarHBondContact OE2-CG 3.46Å |
| 471 | L | 80.9 | Confident | 59.9 | Low | 16 Ų | 16 | 86.9 Ų | 86.9 | 8% | 0.084 | 47% | 0.468 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -94.2 | 2.2 | 179.8 | -61.8 | 178.3 | 0 | 0 | 0 | 115 | Y192 E195 L196 Y200 V250 L254 G469 K473 V474 W475 | Y192-L471 VanDerWaalsContact O-CD1 3.26Å; Y192-L471 WeakPolarHBondContact O-CD1 3.24Å; E195-L471 PolarHBondContact OE1-N 2.82Å; E195-L471 PolarHBondContact OE2-N 3.14Å; E195-L471 VanDerWaalsContact OE2-N 3.16Å; L196-L471 HydrophobicContact CB-CD1 3.67Å; L196-L471 HydrophobicContact CD1-CD1 4.11Å; L196-L471 HydrophobicContact CG-CD1 4.41Å; Y200-L471 HydrophobicContact CD2-CB 4.2Å; Y200-L471 HydrophobicContact CE2-CB 3.91Å; V250-L471 HydrophobicContact CG1-CD2 4.45Å; L254-L471 HydrophobicContact CD1-CD1 4.42Å; G469-L471 PolarHBondContact O-N 3.17Å; L471-K473 VanDerWaalsContact C-N 3.26Å; L471-K473 PolarHBondContact O-N 3.23Å; L471-K473 VanDerWaalsContact O-N 3.12Å; L471-V474 HydrophobicContact CD2-CG2 4.48Å; L471-V474 WeakPolarHBondContact O-CB 3.29Å; L471-V474 PolarHBondContact O-N 2.77Å; L471-W475 PolarHBondContact O-N 3.04Å; L471-W475 VanDerWaalsContact O-N 3.16Å |
| 472 | S | 76.9 | Confident | 61.4 | Low | 15 Ų | 15 | 82 Ų | 82 | 11% | 0.105 | 43% | 0.431 | C | S | . | . | H | α-helix | trans | -52.9 | -35.1 | -179.3 | 58.3 | 0 | 0 | 0 | 0 | 115.3 | Y200 P468 G469 W475 R476 | Y200-S472 WeakPolarHBondContact OH-CA 3.24Å; Y200-S472 WeakPolarHBondContact OH-CB 3.49Å; P468-S472 WeakPolarHBondContact CB-OG 3.3Å; G469-S472 WeakPolarHBondContact O-CB 3.42Å; G469-S472 PolarHBondContact O-N 3.22Å; G469-S472 PolarHBondContact O-OG 3.33Å; S472-W475 PolarHBondContact O-N 3.23Å; S472-R476 WeakPolarHBondContact O-CG 3.42Å; S472-R476 PolarHBondContact O-N 3.46Å; S472-R476 VanDerWaalsContact O-N 3.12Å |
| 473 | K | 75.6 | Confident | 62.4 | Low | 159 Ų | 159 | 77.6 Ų | 77.6 | 69% | 0.691 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -67.9 | -39 | 177 | -71 | 179.9 | -179 | 174 | 0 | 112.1 | L471 W475 R476 L477 | L471-K473 VanDerWaalsContact C-N 3.26Å; L471-K473 PolarHBondContact O-N 3.23Å; L471-K473 VanDerWaalsContact O-N 3.12Å; K473-W475 VanDerWaalsContact C-N 3.32Å; K473-R476 PolarHBondContact O-N 3.45Å; K473-L477 WeakPolarHBondContact O-CG 3.49Å; K473-L477 PolarHBondContact O-N 3.12Å |
| 474 | V | 73.9 | Confident | 62.9 | Low | 30 Ų | 30 | 76 Ų | 76 | 18% | 0.182 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -64.9 | -42.4 | 177.8 | 177.8 | 0 | 0 | 0 | 0 | 109.8 | V250 L471 L477 A478 | V250-V474 HydrophobicContact CG2-CG1 3.43Å; V250-V474 VanDerWaalsContact CG2-CG1 3.43Å; L471-V474 HydrophobicContact CD2-CG2 4.48Å; L471-V474 WeakPolarHBondContact O-CB 3.29Å; L471-V474 PolarHBondContact O-N 2.77Å; V474-L477 PolarHBondContact O-N 3.09Å; V474-A478 PolarHBondContact O-N 3.23Å |
| 475 | W | 75.5 | Confident | 62.7 | Low | 47 Ų | 47 | 76.7 Ų | 76.7 | 18% | 0.178 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -59.1 | -47.6 | 174.8 | 175.3 | -122 | 0 | 0 | 0 | 112.9 | Y200 F201 V216 L471 S472 K473 L477 A478 K479 | Y200-W475 HydrophobicContact CD1-CB 3.62Å; Y200-W475 AromaticContact CD1-CD1 3.54Å; Y200-W475 AromaticContact CD1-CD2 3.79Å; Y200-W475 HydrophobicContact CD1-CD2 3.79Å; Y200-W475 HydrophobicContact CD1-CE3 4.48Å; Y200-W475 AromaticContact CD1-CG 3.37Å; Y200-W475 HydrophobicContact CD1-CG 3.37Å; Y200-W475 AromaticContact CD1-NE1 3.97Å; Y200-W475 HydrophobicContact CD2-CB 4.38Å; Y200-W475 HydrophobicContact CE1-CB 4Å; Y200-W475 AromaticContact CE1-CD1 3.82Å; Y200-W475 AromaticContact CE1-CG 3.95Å; Y200-W475 HydrophobicContact CE1-CG 3.95Å; Y200-W475 HydrophobicContact CG-CB 3.85Å; Y200-W475 HydrophobicContact CG-CD2 4.17Å; Y200-W475 HydrophobicContact CG-CE3 4.45Å; Y200-W475 AromaticContact CG-CG 3.94Å; Y200-W475 HydrophobicContact CG-CG 3.94Å; Y200-W475 WeakPolarHBondContact O-CH2 3.23Å; Y200-W475 WeakPolarHBondContact O-CZ3 3.45Å; F201-W475 HydrophobicContact CD1-CZ3 4.44Å; F201-W475 HydrophobicContact CD2-CE3 4.45Å; F201-W475 HydrophobicContact CE1-CZ3 4.28Å; F201-W475 HydrophobicContact CE2-CE3 4.02Å; F201-W475 HydrophobicContact CE2-CZ3 4.44Å; F201-W475 HydrophobicContact CZ-CE3 4.06Å; F201-W475 HydrophobicContact CZ-CZ3 4.27Å; V216-W475 HydrophobicContact CG1-CH2 3.62Å; V216-W475 HydrophobicContact CG1-CZ3 4.11Å; L471-W475 PolarHBondContact O-N 3.04Å; L471-W475 VanDerWaalsContact O-N 3.16Å; S472-W475 PolarHBondContact O-N 3.23Å; K473-W475 VanDerWaalsContact C-N 3.32Å; W475-L477 VanDerWaalsContact C-N 3.31Å; W475-L477 PolarHBondContact O-N 3.18Å; W475-A478 WeakPolarHBondContact O-CB 3.34Å; W475-A478 PolarHBondContact O-N 2.84Å; W475-K479 HydrophobicContact CD2-CG 4.46Å; W475-K479 HydrophobicContact CH2-CG 4.5Å; W475-K479 HydrophobicContact CZ2-CD 4.15Å; W475-K479 HydrophobicContact CZ2-CG 4.18Å; W475-K479 PolarHBondContact O-N 2.85Å |
| 476 | R | 74.9 | Confident | 62 | Low | 159 Ų | 159 | 79.6 Ų | 79.6 | 60% | 0.6 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -61.3 | -40.1 | 177.6 | -69.1 | 179.8 | -151.6 | 173.6 | 4.4 | 112.3 | S472 K473 G480 | S472-R476 WeakPolarHBondContact O-CG 3.42Å; S472-R476 PolarHBondContact O-N 3.46Å; S472-R476 VanDerWaalsContact O-N 3.12Å; K473-R476 PolarHBondContact O-N 3.45Å; R476-G480 PolarHBondContact O-N 3.42Å |
| 477 | L | 71 | Confident | 61.5 | Low | 90 Ų | 90 | 78.2 Ų | 78.2 | 47% | 0.471 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -63.4 | -44.9 | 175.3 | -73.4 | 168.5 | 0 | 0 | 0 | 111.1 | K473 V474 W475 K479 G480 I481 | K473-L477 WeakPolarHBondContact O-CG 3.49Å; K473-L477 PolarHBondContact O-N 3.12Å; V474-L477 PolarHBondContact O-N 3.09Å; W475-L477 VanDerWaalsContact C-N 3.31Å; W475-L477 PolarHBondContact O-N 3.18Å; L477-K479 PolarHBondContact O-N 3.42Å; L477-G480 PolarHBondContact O-N 3.09Å; L477-I481 VanDerWaalsContact O-CD1 3.29Å; L477-I481 WeakPolarHBondContact O-CD1 3.2Å; L477-I481 WeakPolarHBondContact O-CG1 3.48Å; L477-I481 PolarHBondContact O-N 2.88Å |
| 478 | A | 71 | Confident | 60.6 | Low | 0 Ų | 0 | 74.3 Ų | 74.3 | 0% | 0 | 43% | 0.434 | C | S | . | . | H | α-helix | trans | -59 | -47.2 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112 | F201 V246 V474 W475 G480 I481 I482 | F201-A478 HydrophobicContact CE1-CB 4.49Å; F201-A478 HydrophobicContact CZ-CB 3.88Å; V246-A478 HydrophobicContact CG1-CB 3.91Å; V474-A478 PolarHBondContact O-N 3.23Å; W475-A478 WeakPolarHBondContact O-CB 3.34Å; W475-A478 PolarHBondContact O-N 2.84Å; A478-G480 PolarHBondContact O-N 2.87Å; A478-I481 PolarHBondContact O-N 3.41Å; A478-I482 PolarHBondContact O-N 3.18Å |
| 479 | K | 70.4 | Confident | 59 | Low | 98 Ų | 98 | 77.6 Ų | 77.6 | 43% | 0.426 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -59.7 | -45.1 | 174.7 | -83.9 | -160.9 | 169.4 | -168.5 | 0 | 112.6 | W475 L477 I481 I482 G483 | W475-K479 HydrophobicContact CD2-CG 4.46Å; W475-K479 HydrophobicContact CH2-CG 4.5Å; W475-K479 HydrophobicContact CZ2-CD 4.15Å; W475-K479 HydrophobicContact CZ2-CG 4.18Å; W475-K479 PolarHBondContact O-N 2.85Å; L477-K479 PolarHBondContact O-N 3.42Å; K479-I481 VanDerWaalsContact C-N 3.29Å; K479-I481 PolarHBondContact O-N 2.87Å; K479-I482 PolarHBondContact O-N 2.7Å; K479-G483 PolarHBondContact O-N 2.88Å |
| 480 | G | 67 | Low | 57.1 | Low | 64 Ų | 64 | 82.5 Ų | 82.5 | 66% | 0.66 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -65.4 | -30.6 | -179.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | R476 L477 A478 | R476-G480 PolarHBondContact O-N 3.42Å; L477-G480 PolarHBondContact O-N 3.09Å; A478-G480 PolarHBondContact O-N 2.87Å |
| 481 | I | 61.4 | Low | 54.9 | Low | 32 Ų | 32 | 86 Ų | 86 | 16% | 0.164 | 49% | 0.491 | C | S | . | . | H | α-helix | trans | -73.5 | -38.9 | 178.6 | -70.7 | 161 | 0 | 0 | 0 | 111.8 | F273 L274 L277 L477 A478 K479 G483 | F273-I481 HydrophobicContact CB-CD1 4.13Å; F273-I481 WeakPolarHBondContact O-CD1 3.43Å; L274-I481 HydrophobicContact CD2-CD1 3.94Å; L274-I481 HydrophobicContact CD2-CG1 3.54Å; L277-I481 HydrophobicContact CD1-CG2 3.89Å; L277-I481 HydrophobicContact CD2-CG2 3.4Å; L277-I481 VanDerWaalsContact CD2-CG2 3.4Å; L277-I481 HydrophobicContact CG-CG2 3.93Å; L477-I481 VanDerWaalsContact O-CD1 3.29Å; L477-I481 WeakPolarHBondContact O-CD1 3.2Å; L477-I481 WeakPolarHBondContact O-CG1 3.48Å; L477-I481 PolarHBondContact O-N 2.88Å; A478-I481 PolarHBondContact O-N 3.41Å; K479-I481 VanDerWaalsContact C-N 3.29Å; K479-I481 PolarHBondContact O-N 2.87Å; I481-G483 VanDerWaalsContact C-N 3.31Å; I481-G483 PolarHBondContact O-N 3.48Å |
| 482 | I | 59.1 | Low | 52.5 | Low | 31 Ų | 31 | 97.8 Ų | 97.8 | 16% | 0.159 | 55% | 0.546 | C | S | . | . | H | α-helix | trans | -84.3 | -10.9 | -170.8 | -67.8 | 164.3 | 0 | 0 | 0 | 112 | T239 T242 Y243 A478 K479 | T239-I482 HydrophobicContact CG2-CG2 4.33Å; T242-I482 HydrophobicContact CG2-CD1 3.75Å; T242-I482 HydrophobicContact CG2-CG1 3.69Å; Y243-I482 HydrophobicContact CD1-CD1 3.32Å; Y243-I482 HydrophobicContact CD2-CD1 4.28Å; Y243-I482 HydrophobicContact CE1-CD1 3.19Å; Y243-I482 HydrophobicContact CE1-CG1 4.44Å; Y243-I482 HydrophobicContact CE2-CD1 4.16Å; Y243-I482 HydrophobicContact CE2-CG2 4.36Å; Y243-I482 HydrophobicContact CG-CD1 3.88Å; A478-I482 PolarHBondContact O-N 3.18Å; K479-I482 PolarHBondContact O-N 2.7Å |
| 483 | G | 48.3 | Very low | 51.3 | Low | 58 Ų | 58 | 102 Ų | 102 | 60% | 0.598 | 57% | 0.568 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 57.2 | 57.6 | 176.2 | 0 | 0 | 0 | 0 | 0 | 110.5 | K479 I481 S485 | K479-G483 PolarHBondContact O-N 2.88Å; I481-G483 VanDerWaalsContact C-N 3.31Å; I481-G483 PolarHBondContact O-N 3.48Å; G483-S485 PolarHBondContact O-N 2.57Å |
| 484 | T | 42.2 | Very low | 50 | Low | 71 Ų | 71 | 98.9 Ų | 98.9 | 44% | 0.436 | 56% | 0.561 | S | S | . | * | trans | -68.5 | 103.8 | 169 | 53.2 | 0 | 0 | 0 | 0 | 107.5 | Y243 E486 | Y243-T484 WeakPolarHBondContact OH-CG2 3.33Å; T484-E486 PolarHBondContact O-N 3.33Å; T484-E486 VanDerWaalsContact O-N 3.07Å | ||
| 485 | S | 33.2 | Very low | 48.6 | Very low | 108 Ų | 108 | 102.8 Ų | 102.8 | 76% | 0.755 | 58% | 0.582 | S | S | * | * | trans | -44.8 | 112.5 | 145.3 | 48.1 | 0 | 0 | 0 | 0 | 106.6 | G483 | G483-S485 PolarHBondContact O-N 2.57Š| ||
| 486 | E | 30.7 | Very low | 47.1 | Very low | 169 Ų | 169 | 106.1 Ų | 106.1 | 79% | 0.79 | 61% | 0.606 | S | S | * | * | trans | -46.7 | 137.6 | 157.8 | -71.6 | 175.6 | 155.9 | 0 | 0 | 106.8 | T484 S488 | T484-E486 PolarHBondContact O-N 3.33Å; T484-E486 VanDerWaalsContact O-N 3.07Å; E486-S488 PolarHBondContact O-N 3.47Å | ||
| 487 | P | 31.7 | Very low | 45.3 | Very low | 120 Ų | 120 | 102.8 Ų | 102.8 | 78% | 0.779 | 61% | 0.607 | S | S | * | * | trans | -56.5 | 115.7 | 164.1 | 26.5 | -27.9 | 0 | 0 | 0 | 104.3 | D489 | P487-D489 PolarHBondContact O-N 3.28Š| ||
| 488 | S | 26.4 | Very low | 43.6 | Very low | 109 Ų | 109 | 103.6 Ų | 103.6 | 76% | 0.762 | 62% | 0.616 | S | S | * | * | trans | -45.7 | 132.7 | 166.8 | 53.3 | 0 | 0 | 0 | 0 | 106.5 | E486 C490 | E486-S488 PolarHBondContact O-N 3.47Å; S488-C490 PolarHBondContact O-N 3.11Å | ||
| 489 | D | 26.7 | Very low | 41.7 | Very low | 149 Ų | 149 | 111 Ų | 111 | 80% | 0.797 | 66% | 0.66 | S | S | * | * | trans | -29.1 | 130.8 | 171.6 | -66.6 | -52.5 | 0 | 0 | 0 | 110.6 | P487 D491 | P487-D489 PolarHBondContact O-N 3.28Å; D489-D491 PolarHBondContact O-N 3.08Å | ||
| 490 | C | 27.6 | Very low | 39.5 | Very low | 122 Ų | 122 | 112 Ų | 112 | 82% | 0.824 | 68% | 0.678 | S | S | * | * | trans | -45.8 | 109.7 | 167.1 | -62.3 | 0 | 0 | 0 | 0 | 108.3 | S488 E492 | S488-C490 PolarHBondContact O-N 3.11Å; C490-E492 PolarHBondContact O-N 3.23Å | ||
| 491 | D | 28.5 | Very low | 37.2 | Very low | 159 Ų | 159 | 116 Ų | 116 | 85% | 0.85 | 68% | 0.679 | S | S | * | * | trans | -70.1 | 120.2 | 151.8 | -80.9 | -36 | 0 | 0 | 0 | 106.4 | D489 | D489-D491 PolarHBondContact O-N 3.08Š| ||
| 492 | E | 30.2 | Very low | 35 | Very low | 264 Ų | 264 | 123.6 Ų | 123.6 | 100% | 1.234 | 73% | 0.726 | S | S | * | * | trans | 95.6 | 0 | 177.2 | -57.3 | -170.2 | 168.8 | 0 | 0 | 118.8 | C490 | C490-E492 PolarHBondContact O-N 3.23Š|
Retrieved 492 of 492 residues in 1378.9 ms
(Link to these results)