| 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 | 38.7 | Very low | 30.3 | Very low | 252 Ų | 252 | 150.7 Ų | 150.7 | 100% | 1.241 | 81% | 0.81 | S | S | * | * | 0 | 117.9 | 0 | -76.3 | 171.3 | 163.3 | 0 | 0 | 107.7 | |||||
| 2 | S | 27.1 | Very low | 30.3 | Very low | 101 Ų | 101 | 146.7 Ų | 146.7 | 71% | 0.706 | 80% | 0.798 | S | S | * | * | trans | -115 | 120.2 | -171.6 | 174.7 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 3 | V | 28.5 | Very low | 30.2 | Very low | 130 Ų | 130 | 149.2 Ų | 149.2 | 79% | 0.788 | 80% | 0.8 | S | S | * | * | trans | -116.8 | 111 | 169.3 | -176.7 | 0 | 0 | 0 | 0 | 107.1 | I5 | V3-I5 HydrophobicContact CG1-CG1 4.1Š| ||
| 4 | R | 25.5 | Very low | 30.3 | Very low | 229 Ų | 229 | 147 Ų | 147 | 86% | 0.864 | 80% | 0.795 | S | S | * | * | trans | -97.4 | 114.3 | 170.5 | -72.3 | -177.9 | -177.9 | 176.6 | 0 | 107.6 | ||||
| 5 | I | 33.5 | Very low | 30.3 | Very low | 143 Ų | 143 | 152.9 Ų | 152.9 | 73% | 0.733 | 80% | 0.801 | S | S | * | * | trans | -96.3 | 116.5 | 169.1 | -55.8 | 179.2 | 0 | 0 | 0 | 107.2 | V3 V7 | V3-I5 HydrophobicContact CG1-CG1 4.1Å; I5-V7 HydrophobicContact CG2-CG2 3.8Å | ||
| 6 | K | 25.9 | Very low | 30.4 | Very low | 207 Ų | 207 | 158 Ų | 158 | 90% | 0.9 | 81% | 0.807 | S | S | * | * | trans | -93.7 | 100 | 175.4 | -158.4 | 178.1 | -172.2 | -177.2 | 0 | 106.6 | ||||
| 7 | V | 35.2 | Very low | 30.4 | Very low | 111 Ų | 111 | 156.2 Ų | 156.2 | 67% | 0.673 | 80% | 0.799 | S | S | * | * | trans | -97.7 | 98.1 | 170.3 | -174.1 | 0 | 0 | 0 | 0 | 107.4 | I5 L9 | I5-V7 HydrophobicContact CG2-CG2 3.8Å; V7-L9 HydrophobicContact CG1-CD1 4.13Å | ||
| 8 | G | 25 | Very low | 30.5 | Very low | 71 Ų | 71 | 152.9 Ų | 152.9 | 73% | 0.732 | 80% | 0.799 | S | S | * | * | trans | -84.6 | 112.6 | 164.4 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 9 | L | 30.2 | Very low | 30.5 | Very low | 136 Ų | 136 | 153.6 Ų | 153.6 | 71% | 0.712 | 80% | 0.803 | S | S | * | * | trans | -127.4 | 92.3 | 169.5 | -115.9 | 152.9 | 0 | 0 | 0 | 107.5 | V7 I11 | V7-L9 HydrophobicContact CG1-CD1 4.13Å; L9-I11 HydrophobicContact CD2-CD1 3.7Å; L9-I11 HydrophobicContact CD2-CG1 3.9Å | ||
| 10 | T | 28.2 | Very low | 30.6 | Very low | 139 Ų | 139 | 154.4 Ų | 154.4 | 85% | 0.853 | 80% | 0.802 | S | S | * | * | trans | -83.6 | 108.8 | 166.1 | 43.1 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 11 | I | 35.2 | Very low | 30.6 | Very low | 139 Ų | 139 | 156 Ų | 156 | 71% | 0.713 | 80% | 0.803 | S | S | * | * | trans | -130.9 | 111.8 | 161.5 | -58.5 | 176.9 | 0 | 0 | 0 | 106.5 | L9 | L9-I11 HydrophobicContact CD2-CD1 3.7Å; L9-I11 HydrophobicContact CD2-CG1 3.9Å | ||
| 12 | P | 30.9 | Very low | 30.3 | Very low | 102 Ų | 102 | 150.7 Ų | 150.7 | 66% | 0.662 | 79% | 0.785 | S | S | * | * | trans | -85.7 | 143.5 | 174.8 | 34.6 | -29.4 | 0 | 0 | 0 | 110.1 | ||||
| 13 | H | 28.7 | Very low | 30.4 | Very low | 179 Ų | 179 | 157.6 Ų | 157.6 | 83% | 0.829 | 80% | 0.795 | S | S | * | * | trans | 58.3 | 92 | 165 | -65 | -73.7 | 0 | 0 | 0 | 117.9 | ||||
| 14 | V | 31.4 | Very low | 30.4 | Very low | 119 Ų | 119 | 154.2 Ų | 154.2 | 72% | 0.721 | 79% | 0.787 | S | S | * | * | -166.6 | 100.3 | 113.2 | 178.7 | 0 | 0 | 0 | 0 | 106.8 | W16 | V14-W16 HydrophobicContact CG1-CG 4.26Š| |||
| 15 | R | 30.1 | Very low | 30.7 | Very low | 235 Ų | 235 | 152.8 Ų | 152.8 | 89% | 0.887 | 78% | 0.783 | S | S | * | * | trans | -90.9 | 98.7 | 164.6 | -85.5 | -176.2 | 166.5 | 174.5 | -4 | 108.1 | N17 | R15-N17 PolarHBondContact O-N 3.47Š| ||
| 16 | W | 33.2 | Very low | 30.5 | Very low | 235 Ų | 235 | 150.9 Ų | 150.9 | 89% | 0.89 | 78% | 0.783 | S | S | * | * | trans | -79.7 | 104.9 | 160.5 | -86.5 | 93.3 | 0 | 0 | 0 | 108.6 | V14 A18 | V14-W16 HydrophobicContact CG1-CG 4.26Å; W16-A18 PolarHBondContact O-N 3.27Å | ||
| 17 | N | 30.3 | Very low | 30.7 | Very low | 128 Ų | 128 | 148.8 Ų | 148.8 | 68% | 0.684 | 78% | 0.78 | S | S | * | * | trans | -68.3 | 93.4 | 170.5 | -78.5 | -32.9 | 0 | 0 | 0 | 109.8 | R15 L19 | R15-N17 PolarHBondContact O-N 3.47Å; N17-L19 PolarHBondContact O-N 3.33Å | ||
| 18 | A | 31.5 | Very low | 30.7 | Very low | 96 Ų | 96 | 149.8 Ų | 149.8 | 79% | 0.793 | 78% | 0.781 | S | S | * | * | trans | -82.6 | 14 | 169.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | W16 | W16-A18 PolarHBondContact O-N 3.27Š| ||
| 19 | L | 30.5 | Very low | 31.2 | Very low | 166 Ų | 166 | 157.4 Ų | 157.4 | 87% | 0.869 | 79% | 0.787 | S | S | * | * | S | Bend | trans | -125.4 | 27.8 | -167.3 | -116.5 | 144.5 | 0 | 0 | 0 | 114.6 | N17 | N17-L19 PolarHBondContact O-N 3.33Š|
| 20 | Q | 32 | Very low | 31.8 | Very low | 170 Ų | 170 | 155.1 Ų | 155.1 | 79% | 0.794 | 78% | 0.779 | S | S | * | * | S | Bend | trans | -120.3 | 8.4 | 168.4 | -79.6 | -146.3 | -16.4 | 0 | 0 | 115.3 | V22 | Q20-V22 PolarHBondContact O-N 3.48Š|
| 21 | F | 31.6 | Very low | 32.4 | Very low | 188 Ų | 188 | 155.4 Ų | 155.4 | 83% | 0.825 | 78% | 0.775 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.2 | 7.9 | -173.9 | -110.4 | -82.9 | 0 | 0 | 0 | 116.6 | ||
| 22 | V | 32.4 | Very low | 33 | Very low | 140 Ų | 140 | 152.9 Ų | 152.9 | 85% | 0.848 | 77% | 0.77 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -116.7 | -4.9 | -172.8 | -178.1 | 0 | 0 | 0 | 0 | 114.8 | Q20 | Q20-V22 PolarHBondContact O-N 3.48Š|
| 23 | R | 29.5 | Very low | 33.7 | Very low | 246 Ų | 246 | 154.4 Ų | 154.4 | 93% | 0.928 | 77% | 0.766 | S | S | * | * | S | Bend | trans | -140.6 | 80.5 | 176.6 | -78 | -174.8 | 171.1 | 159.3 | -2.4 | 111.7 | ||
| 24 | G | 27.1 | Very low | 34.3 | Very low | 60 Ų | 60 | 153.8 Ų | 153.8 | 62% | 0.619 | 76% | 0.762 | S | S | * | * | trans | 163 | 42.7 | 171.8 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 25 | Y | 32 | Very low | 35 | Very low | 199 Ų | 199 | 152.7 Ų | 152.7 | 78% | 0.78 | 75% | 0.751 | S | S | * | * | trans | -138.9 | 82 | 159.5 | -86.5 | -76.8 | 0 | 0 | 0 | 110.7 | ||||
| 26 | S | 30.1 | Very low | 35.7 | Very low | 103 Ų | 103 | 144.1 Ų | 144.1 | 72% | 0.72 | 73% | 0.731 | S | S | * | * | trans | -66.3 | 123.1 | 145.9 | 51 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 27 | L | 30.5 | Very low | 36.4 | Very low | 162 Ų | 162 | 136.4 Ų | 136.4 | 85% | 0.848 | 71% | 0.707 | S | S | * | * | trans | 39.7 | 86.5 | 156.5 | -79.5 | 106.6 | 0 | 0 | 0 | 117.6 | ||||
| 28 | I | 35.2 | Very low | 37.3 | Very low | 133 Ų | 133 | 132.2 Ų | 132.2 | 68% | 0.682 | 69% | 0.694 | S | S | * | * | trans | -131.7 | 112.9 | 144.4 | -59.7 | -178.4 | 0 | 0 | 0 | 108.6 | T30 | I28-T30 PolarHBondContact O-N 2.96Š| ||
| 29 | R | 35.5 | Very low | 38 | Very low | 231 Ų | 231 | 136.3 Ų | 136.3 | 87% | 0.872 | 69% | 0.689 | S | S | * | * | trans | -67.8 | 114.4 | 175 | -72.3 | 173.8 | 173.1 | 177.1 | -2.7 | 109.9 | ||||
| 30 | T | 40.9 | Very low | 38.6 | Very low | 87 Ų | 87 | 138 Ų | 138 | 53% | 0.534 | 68% | 0.683 | S | S | . | * | trans | -139.4 | 107.3 | 152.5 | 53.7 | 0 | 0 | 0 | 0 | 111 | I28 S32 | I28-T30 PolarHBondContact O-N 2.96Å; T30-S32 PolarHBondContact O-N 3.31Å; T30-S32 VanDerWaalsContact O-N 3.15Å | ||
| 31 | N | 42.6 | Very low | 39.2 | Very low | 146 Ų | 146 | 133.7 Ų | 133.7 | 78% | 0.781 | 67% | 0.671 | S | S | * | * | H | α-helix | trans | -67.8 | -4.6 | 179.1 | -112.1 | -34.5 | 0 | 0 | 0 | 113.9 | N35 | N31-N35 PolarHBondContact O-ND2 3.13Å; N31-N35 VanDerWaalsContact O-ND2 3.16Å |
| 32 | S | 46.6 | Very low | 39.8 | Very low | 86 Ų | 86 | 134.1 Ų | 134.1 | 60% | 0.601 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -87.8 | -32 | -176.8 | 53.6 | 0 | 0 | 0 | 0 | 113.2 | T30 N35 A36 | T30-S32 PolarHBondContact O-N 3.31Å; T30-S32 VanDerWaalsContact O-N 3.15Å; S32-N35 PolarHBondContact O-N 3.11Å; S32-A36 PolarHBondContact O-N 3.38Å; S32-A36 VanDerWaalsContact O-N 3.1Å |
| 33 | F | 45 | Very low | 40.2 | Very low | 134 Ų | 134 | 134.7 Ų | 134.7 | 59% | 0.588 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -72.3 | -41.8 | -175.1 | -160.6 | -104.1 | 0 | 0 | 0 | 112.3 | N35 A36 I37 | F33-N35 VanDerWaalsContact C-N 3.34Å; F33-N35 PolarHBondContact O-N 3.48Å; F33-A36 PolarHBondContact O-N 3.27Å; F33-I37 HydrophobicContact CD1-CD1 3.63Å; F33-I37 HydrophobicContact CE1-CD1 3.27Å; F33-I37 HydrophobicContact CE1-CG1 4.43Å; F33-I37 HydrophobicContact CG-CD1 4.49Å; F33-I37 HydrophobicContact CZ-CD1 3.89Å; F33-I37 WeakPolarHBondContact O-CG1 3.42Å; F33-I37 PolarHBondContact O-N 3.07Å; F33-I37 VanDerWaalsContact O-N 3.07Å |
| 34 | F | 42.1 | Very low | 40.9 | Very low | 166 Ų | 166 | 127.7 Ų | 127.7 | 73% | 0.728 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -69.9 | -28.6 | 174.8 | -79.5 | -80.3 | 0 | 0 | 0 | 113.2 | G38 | F34-G38 WeakPolarHBondContact O-CA 3.34Å; F34-G38 PolarHBondContact O-N 3Å |
| 35 | N | 46.7 | Very low | 41.8 | Very low | 95 Ų | 95 | 128 Ų | 128 | 51% | 0.508 | 64% | 0.639 | S | S | . | * | H | α-helix | trans | -72.1 | -36.7 | 173.9 | -95.6 | -47.3 | 0 | 0 | 0 | 112.5 | N31 S32 F33 R39 | N31-N35 PolarHBondContact O-ND2 3.13Å; N31-N35 VanDerWaalsContact O-ND2 3.16Å; S32-N35 PolarHBondContact O-N 3.11Å; F33-N35 VanDerWaalsContact C-N 3.34Å; F33-N35 PolarHBondContact O-N 3.48Å; N35-R39 WeakPolarHBondContact O-CB 3.36Å; N35-R39 VanDerWaalsContact O-CG 3.28Å; N35-R39 WeakPolarHBondContact O-CG 3.35Å; N35-R39 PolarHBondContact O-N 3.47Å |
| 36 | A | 43.6 | Very low | 42.3 | Very low | 55 Ų | 55 | 123.1 Ų | 123.1 | 46% | 0.455 | 63% | 0.626 | S | S | . | * | H | α-helix | trans | -70.4 | -40.4 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | S32 F33 R40 | S32-A36 PolarHBondContact O-N 3.38Å; S32-A36 VanDerWaalsContact O-N 3.1Å; F33-A36 PolarHBondContact O-N 3.27Å; A36-R40 PolarHBondContact O-N 3.48Å; A36-R40 VanDerWaalsContact O-N 3.15Å |
| 37 | I | 49.2 | Very low | 43.1 | Very low | 74 Ų | 74 | 124.9 Ų | 124.9 | 38% | 0.379 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -71.3 | -42.3 | 175.3 | -67 | 175.2 | 0 | 0 | 0 | 110.8 | F33 R39 R40 C41 | F33-I37 HydrophobicContact CD1-CD1 3.63Å; F33-I37 HydrophobicContact CE1-CD1 3.27Å; F33-I37 HydrophobicContact CE1-CG1 4.43Å; F33-I37 HydrophobicContact CG-CD1 4.49Å; F33-I37 HydrophobicContact CZ-CD1 3.89Å; F33-I37 WeakPolarHBondContact O-CG1 3.42Å; F33-I37 PolarHBondContact O-N 3.07Å; F33-I37 VanDerWaalsContact O-N 3.07Å; I37-R39 VanDerWaalsContact C-N 3.31Å; I37-R39 PolarHBondContact O-N 2.79Å; I37-R40 PolarHBondContact O-N 2.92Å; I37-R40 VanDerWaalsContact O-N 3.14Å; I37-C41 PolarHBondContact O-N 3.33Å; I37-C41 PolarHBondContact O-SG 3.18Å; I37-C41 VanDerWaalsContact O-SG 3.35Å |
| 38 | G | 47.8 | Very low | 43.7 | Very low | 40 Ų | 40 | 123.3 Ų | 123.3 | 41% | 0.412 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -61.2 | -35.8 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | F34 R42 | F34-G38 WeakPolarHBondContact O-CA 3.34Å; F34-G38 PolarHBondContact O-N 3Å; G38-R42 PolarHBondContact O-N 3.41Å |
| 39 | R | 47.3 | Very low | 44 | Very low | 182 Ų | 182 | 123.9 Ų | 123.9 | 69% | 0.687 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -72.4 | -36.7 | 173.5 | -72.8 | 179 | -169 | -169.8 | 3.7 | 112.7 | N35 I37 R42 F43 | N35-R39 WeakPolarHBondContact O-CB 3.36Å; N35-R39 VanDerWaalsContact O-CG 3.28Å; N35-R39 WeakPolarHBondContact O-CG 3.35Å; N35-R39 PolarHBondContact O-N 3.47Å; I37-R39 VanDerWaalsContact C-N 3.31Å; I37-R39 PolarHBondContact O-N 2.79Å; R39-R42 PolarHBondContact O-N 2.89Å; R39-F43 PolarHBondContact O-N 2.92Å |
| 40 | R | 43.3 | Very low | 44.5 | Very low | 201 Ų | 201 | 119.8 Ų | 119.8 | 76% | 0.758 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -69 | -39.5 | 174.7 | -87.1 | -177.8 | 168.8 | 178.4 | -2.7 | 112.6 | A36 I37 R42 F43 V44 | A36-R40 PolarHBondContact O-N 3.48Å; A36-R40 VanDerWaalsContact O-N 3.15Å; I37-R40 PolarHBondContact O-N 2.92Å; I37-R40 VanDerWaalsContact O-N 3.14Å; R40-R42 VanDerWaalsContact C-N 3.34Å; R40-R42 PolarHBondContact O-N 3.15Å; R40-F43 PolarHBondContact O-N 2.98Å; R40-V44 PolarHBondContact O-N 3.23Å; R40-V44 VanDerWaalsContact O-N 3.16Å |
| 41 | C | 44 | Very low | 44.8 | Very low | 79 Ų | 79 | 126.4 Ų | 126.4 | 53% | 0.534 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -66.3 | -33.6 | 175.6 | -67.4 | 0 | 0 | 0 | 0 | 112.4 | I37 F43 A45 | I37-C41 PolarHBondContact O-N 3.33Å; I37-C41 PolarHBondContact O-SG 3.18Å; I37-C41 VanDerWaalsContact O-SG 3.35Å; C41-F43 VanDerWaalsContact C-N 3.34Å; C41-A45 PolarHBondContact O-N 2.89Å |
| 42 | R | 43.3 | Very low | 44.9 | Very low | 197 Ų | 197 | 124.8 Ų | 124.8 | 74% | 0.743 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -64.1 | -36.6 | 170.8 | -90.6 | -173 | -177 | 177.8 | 2 | 113 | G38 R39 R40 L46 | G38-R42 PolarHBondContact O-N 3.41Å; R39-R42 PolarHBondContact O-N 2.89Å; R40-R42 VanDerWaalsContact C-N 3.34Å; R40-R42 PolarHBondContact O-N 3.15Å; R42-L46 WeakPolarHBondContact O-CD1 3.46Å; R42-L46 VanDerWaalsContact O-CG 3.31Å; R42-L46 WeakPolarHBondContact O-CG 3.35Å; R42-L46 PolarHBondContact O-N 3.47Å; R42-L46 VanDerWaalsContact O-N 3.17Å |
| 43 | F | 40.9 | Very low | 44.6 | Very low | 153 Ų | 153 | 123.7 Ų | 123.7 | 67% | 0.671 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -71.1 | -38 | 179.8 | -111.1 | -86.7 | 0 | 0 | 0 | 112.9 | R39 R40 C41 L46 M47 | R39-F43 PolarHBondContact O-N 2.92Å; R40-F43 PolarHBondContact O-N 2.98Å; C41-F43 VanDerWaalsContact C-N 3.34Å; F43-L46 PolarHBondContact O-N 2.9Å; F43-M47 VanDerWaalsContact O-CG 3.29Å; F43-M47 WeakPolarHBondContact O-CG 3.45Å; F43-M47 PolarHBondContact O-N 3.46Å |
| 44 | V | 45.2 | Very low | 44.4 | Very low | 98 Ų | 98 | 126.5 Ų | 126.5 | 59% | 0.594 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -69.6 | -40.2 | 177.6 | 178.4 | 0 | 0 | 0 | 0 | 111.3 | R40 L46 M47 E48 | R40-V44 PolarHBondContact O-N 3.23Å; R40-V44 VanDerWaalsContact O-N 3.16Å; V44-L46 VanDerWaalsContact C-N 3.29Å; V44-L46 PolarHBondContact O-N 3.16Å; V44-M47 PolarHBondContact O-N 2.94Å; V44-E48 PolarHBondContact O-N 3.4Å |
| 45 | A | 45.7 | Very low | 44.2 | Very low | 66 Ų | 66 | 128.6 Ų | 128.6 | 55% | 0.545 | 63% | 0.626 | S | S | . | * | H | α-helix | trans | -66.4 | -28.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | C41 | C41-A45 PolarHBondContact O-N 2.89Å |
| 46 | L | 42 | Very low | 44.1 | Very low | 97 Ų | 97 | 127.7 Ų | 127.7 | 51% | 0.508 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -78 | -34.3 | 174.8 | -74.8 | 167.9 | 0 | 0 | 0 | 112.5 | R42 F43 V44 R49 D50 | R42-L46 WeakPolarHBondContact O-CD1 3.46Å; R42-L46 VanDerWaalsContact O-CG 3.31Å; R42-L46 WeakPolarHBondContact O-CG 3.35Å; R42-L46 PolarHBondContact O-N 3.47Å; R42-L46 VanDerWaalsContact O-N 3.17Å; F43-L46 PolarHBondContact O-N 2.9Å; V44-L46 VanDerWaalsContact C-N 3.29Å; V44-L46 PolarHBondContact O-N 3.16Å; L46-R49 WeakPolarHBondContact O-CB 3.3Å; L46-R49 PolarHBondContact O-N 3.25Å; L46-D50 PolarHBondContact O-N 2.91Å |
| 47 | M | 47 | Very low | 43.8 | Very low | 140 Ų | 140 | 132.9 Ų | 132.9 | 69% | 0.69 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -71.5 | -32.2 | 178.9 | -73.7 | -106 | -75.4 | 0 | 0 | 113.3 | F43 V44 R49 | F43-M47 VanDerWaalsContact O-CG 3.29Å; F43-M47 WeakPolarHBondContact O-CG 3.45Å; F43-M47 PolarHBondContact O-N 3.46Å; V44-M47 PolarHBondContact O-N 2.94Å; M47-R49 VanDerWaalsContact C-N 3.32Å |
| 48 | E | 44.5 | Very low | 43.2 | Very low | 129 Ų | 129 | 139.1 Ų | 139.1 | 60% | 0.603 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -73.1 | -24.9 | 171.4 | -78.4 | -161.6 | 149.7 | 0 | 0 | 113.1 | V44 R51 L52 | V44-E48 PolarHBondContact O-N 3.4Å; E48-R51 PolarHBondContact O-N 3.26Å; E48-L52 PolarHBondContact O-N 3.44Å |
| 49 | R | 41.3 | Very low | 42.5 | Very low | 146 Ų | 146 | 148.8 Ų | 148.8 | 55% | 0.551 | 69% | 0.69 | S | S | * | * | H | α-helix | trans | -66.4 | -40.2 | 178.9 | -167.8 | 178.5 | 169.9 | 162.4 | -1.9 | 112.4 | L46 M47 | L46-R49 WeakPolarHBondContact O-CB 3.3Å; L46-R49 PolarHBondContact O-N 3.25Å; M47-R49 VanDerWaalsContact C-N 3.32Å |
| 50 | D | 46.1 | Very low | 42.1 | Very low | 144 Ų | 144 | 147.8 Ų | 147.8 | 77% | 0.77 | 70% | 0.698 | S | S | * | * | H | α-helix | trans | -77.6 | -26.7 | 179.1 | -74 | -17.3 | 0 | 0 | 0 | 112.7 | L46 | L46-D50 PolarHBondContact O-N 2.91Å |
| 51 | R | 46.7 | Very low | 41.9 | Very low | 226 Ų | 226 | 142.2 Ų | 142.2 | 85% | 0.853 | 69% | 0.688 | S | S | * | * | H | α-helix | trans | -78 | -25.6 | -179.2 | -159.6 | 176 | 179.7 | 176 | 0.1 | 113.4 | E48 | E48-R51 PolarHBondContact O-N 3.26Å |
| 52 | L | 44.6 | Very low | 41.6 | Very low | 113 Ų | 113 | 145 Ų | 145 | 59% | 0.592 | 70% | 0.702 | S | S | * | * | H | α-helix | trans | -97.2 | -7.1 | -176.9 | -67.8 | 171.8 | 0 | 0 | 0 | 114.1 | E48 W54 | E48-L52 PolarHBondContact O-N 3.44Å; L52-W54 VanDerWaalsContact C-N 3.3Å; L52-W54 HydrophobicContact CB-CG 4.42Å; L52-W54 VanDerWaalsContact O-CD1 3.25Å; L52-W54 PolarHBondContact O-N 2.91Å |
| 53 | G | 39.6 | Very low | 41.4 | Very low | 63 Ų | 63 | 143.9 Ų | 143.9 | 65% | 0.649 | 70% | 0.703 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 66.3 | 29.1 | 176.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | K55 | G53-K55 PolarHBondContact O-N 2.88Š|
| 54 | W | 41.9 | Very low | 41.5 | Very low | 193 Ų | 193 | 141.3 Ų | 141.3 | 73% | 0.731 | 70% | 0.702 | S | S | * | * | trans | -77.4 | 96 | -177.4 | -78.7 | 38.1 | 0 | 0 | 0 | 111 | L52 | L52-W54 VanDerWaalsContact C-N 3.3Å; L52-W54 HydrophobicContact CB-CG 4.42Å; L52-W54 VanDerWaalsContact O-CD1 3.25Å; L52-W54 PolarHBondContact O-N 2.91Å | ||
| 55 | K | 37.2 | Very low | 41.6 | Very low | 209 Ų | 209 | 142.5 Ų | 142.5 | 91% | 0.909 | 71% | 0.711 | S | S | * | * | trans | -84.5 | 100.8 | 160.1 | -70.4 | -175.5 | 178 | -178.9 | 0 | 108.7 | G53 | G53-K55 PolarHBondContact O-N 2.88Š| ||
| 56 | S | 45.4 | Very low | 41.3 | Very low | 76 Ų | 76 | 145.2 Ų | 145.2 | 53% | 0.531 | 72% | 0.721 | S | S | . | * | trans | -159.1 | 109.6 | 166.7 | 170.7 | 0 | 0 | 0 | 0 | 111.2 | R58 | S56-R58 PolarHBondContact O-N 2.92Å; S56-R58 VanDerWaalsContact O-N 3.16Å | ||
| 57 | D | 36.8 | Very low | 41.2 | Very low | 164 Ų | 164 | 150 Ų | 150 | 88% | 0.877 | 74% | 0.738 | S | S | * | * | trans | -79.6 | 33.4 | 175.9 | -75 | -38.3 | 0 | 0 | 0 | 113.9 | ||||
| 58 | R | 36.6 | Very low | 41 | Very low | 205 Ų | 205 | 150.2 Ų | 150.2 | 77% | 0.774 | 74% | 0.741 | S | S | * | * | trans | -140 | 137.2 | 175.8 | -65.9 | -176.1 | -159 | -156.7 | 3.2 | 109.6 | S56 | S56-R58 PolarHBondContact O-N 2.92Å; S56-R58 VanDerWaalsContact O-N 3.16Å | ||
| 59 | W | 32.7 | Very low | 40.7 | Very low | 243 Ų | 243 | 149.5 Ų | 149.5 | 92% | 0.92 | 75% | 0.748 | S | S | * | * | trans | 90 | 62.9 | 178.4 | -46.8 | 102.3 | 0 | 0 | 0 | 116.4 | ||||
| 60 | L | 39.1 | Very low | 40.5 | Very low | 162 Ų | 162 | 147 Ų | 147 | 85% | 0.848 | 75% | 0.752 | S | S | * | * | trans | -88.5 | 123.7 | 136.7 | -83.6 | 163.5 | 0 | 0 | 0 | 106.8 | T62 | L60-T62 PolarHBondContact O-N 2.87Å; L60-T62 VanDerWaalsContact O-N 3.1Å | ||
| 61 | P | 38.5 | Very low | 40.1 | Very low | 84 Ų | 84 | 147.1 Ų | 147.1 | 55% | 0.545 | 75% | 0.752 | S | S | . | * | trans | -64.9 | 113.5 | 160.1 | 26.3 | -26.3 | 0 | 0 | 0 | 106.5 | F63 | P61-F63 HydrophobicContact CB-CE2 4.48Å; P61-F63 HydrophobicContact CG-CD2 4.46Å; P61-F63 HydrophobicContact CG-CE2 3.82Å; P61-F63 HydrophobicContact CG-CZ 4.02Å; P61-F63 WeakPolarHBondContact O-CD2 3.39Å; P61-F63 PolarHBondContact O-N 2.96Å | ||
| 62 | T | 39.2 | Very low | 39.5 | Very low | 138 Ų | 138 | 143 Ų | 143 | 85% | 0.847 | 75% | 0.747 | S | S | * | * | trans | -60.3 | 94 | 162.5 | 4.3 | 0 | 0 | 0 | 0 | 106.5 | L60 P64 | L60-T62 PolarHBondContact O-N 2.87Å; L60-T62 VanDerWaalsContact O-N 3.1Å; T62-P64 WeakPolarHBondContact O-CD 3.5Å | ||
| 63 | F | 39.2 | Very low | 39 | Very low | 173 Ų | 173 | 144.4 Ų | 144.4 | 76% | 0.759 | 76% | 0.755 | S | S | * | * | trans | -63.4 | 120.7 | 166.2 | -69.2 | -79.1 | 0 | 0 | 0 | 106.7 | P61 | P61-F63 HydrophobicContact CB-CE2 4.48Å; P61-F63 HydrophobicContact CG-CD2 4.46Å; P61-F63 HydrophobicContact CG-CE2 3.82Å; P61-F63 HydrophobicContact CG-CZ 4.02Å; P61-F63 WeakPolarHBondContact O-CD2 3.39Å; P61-F63 PolarHBondContact O-N 2.96Å | ||
| 64 | P | 42 | Very low | 38.8 | Very low | 99 Ų | 99 | 146.9 Ų | 146.9 | 64% | 0.643 | 76% | 0.762 | S | S | * | * | trans | -58.6 | 146.2 | 169 | 25.3 | -31.8 | 0 | 0 | 0 | 108.2 | T62 V66 | T62-P64 WeakPolarHBondContact O-CD 3.5Å; P64-V66 PolarHBondContact O-N 3.23Å | ||
| 65 | P | 47.8 | Very low | 38.6 | Very low | 122 Ų | 122 | 143.4 Ų | 143.4 | 79% | 0.792 | 77% | 0.765 | S | S | * | * | trans | -55.4 | 115.8 | 174.5 | 23.2 | -32 | 0 | 0 | 0 | 108.4 | K67 | P65-K67 PolarHBondContact O-N 2.97Š| ||
| 66 | V | 40 | Very low | 38.6 | Very low | 124 Ų | 124 | 139.6 Ų | 139.6 | 75% | 0.752 | 76% | 0.759 | S | S | * | * | trans | -64.5 | 101.7 | 172 | 177.1 | 0 | 0 | 0 | 0 | 106.3 | P64 L68 | P64-V66 PolarHBondContact O-N 3.23Å; V66-L68 VanDerWaalsContact C-N 3.34Å; V66-L68 HydrophobicContact CG1-CD2 4.42Å; V66-L68 PolarHBondContact O-N 3.43Å | ||
| 67 | K | 38.5 | Very low | 37.8 | Very low | 198 Ų | 198 | 140 Ų | 140 | 86% | 0.861 | 77% | 0.768 | S | S | * | * | trans | -61.9 | 99.8 | 165.4 | -79.3 | -178.2 | 177.9 | 179 | 0 | 106.8 | P65 | P65-K67 PolarHBondContact O-N 2.97Š| ||
| 68 | L | 43.9 | Very low | 37.8 | Very low | 143 Ų | 143 | 140.4 Ų | 140.4 | 75% | 0.749 | 77% | 0.768 | S | S | * | * | trans | -60.9 | 136.6 | 168.4 | -67.2 | 171.6 | 0 | 0 | 0 | 108 | V66 S70 | V66-L68 VanDerWaalsContact C-N 3.34Å; V66-L68 HydrophobicContact CG1-CD2 4.42Å; V66-L68 PolarHBondContact O-N 3.43Å; L68-S70 PolarHBondContact O-N 2.96Å; L68-S70 VanDerWaalsContact O-N 3.1Å | ||
| 69 | P | 37 | Very low | 37.5 | Very low | 115 Ų | 115 | 135.8 Ų | 135.8 | 75% | 0.747 | 77% | 0.768 | S | S | * | * | trans | -58.5 | 119.4 | 173.5 | 22.4 | -30.2 | 0 | 0 | 0 | 108.8 | L71 | P69-L71 PolarHBondContact O-N 3.43Š| ||
| 70 | S | 38.7 | Very low | 37.8 | Very low | 92 Ų | 92 | 130 Ų | 130 | 64% | 0.643 | 76% | 0.762 | S | S | * | * | trans | -60.5 | 107 | 169.9 | 50.6 | 0 | 0 | 0 | 0 | 107.8 | L68 N72 | L68-S70 PolarHBondContact O-N 2.96Å; L68-S70 VanDerWaalsContact O-N 3.1Å; S70-N72 PolarHBondContact O-N 3.34Å | ||
| 71 | L | 37.8 | Very low | 37.4 | Very low | 148 Ų | 148 | 131.2 Ų | 131.2 | 78% | 0.775 | 76% | 0.763 | S | S | * | * | trans | -70.1 | 87.6 | 168.4 | -77.9 | 163.7 | 0 | 0 | 0 | 107.6 | P69 N73 | P69-L71 PolarHBondContact O-N 3.43Å; L71-N73 PolarHBondContact O-N 3.31Å | ||
| 72 | N | 32.2 | Very low | 37.3 | Very low | 138 Ų | 138 | 132.3 Ų | 132.3 | 74% | 0.738 | 77% | 0.773 | S | S | * | * | trans | -67.5 | 84.4 | 167.3 | -70.2 | -6.7 | 0 | 0 | 0 | 108.4 | S70 | S70-N72 PolarHBondContact O-N 3.34Š| ||
| 73 | N | 35.5 | Very low | 37.3 | Very low | 143 Ų | 143 | 132.9 Ų | 132.9 | 77% | 0.765 | 77% | 0.769 | S | S | * | * | trans | -113.9 | 89.8 | 158.2 | -73.2 | -20 | 0 | 0 | 0 | 107.2 | L71 | L71-N73 PolarHBondContact O-N 3.31Š| ||
| 74 | S | 34.1 | Very low | 37.1 | Very low | 115 Ų | 115 | 130.7 Ų | 130.7 | 80% | 0.804 | 77% | 0.77 | S | S | * | * | trans | -140.8 | 131.2 | 158.3 | -56 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 75 | P | 39.1 | Very low | 36.4 | Very low | 121 Ų | 121 | 132 Ų | 132 | 79% | 0.786 | 77% | 0.772 | S | S | * | * | trans | -109.8 | 112.5 | 146.9 | 17.5 | 1.1 | 0 | 0 | 0 | 108.9 | ||||
| 76 | T | 37.1 | Very low | 35.9 | Very low | 129 Ų | 129 | 131.2 Ų | 131.2 | 79% | 0.791 | 77% | 0.769 | S | S | * | * | trans | 93.6 | 105.1 | 133.8 | -39.2 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 77 | A | 28.9 | Very low | 35.6 | Very low | 85 Ų | 85 | 136.4 Ų | 136.4 | 70% | 0.702 | 78% | 0.775 | S | S | * | * | trans | 75.5 | 105.7 | 139.6 | 0 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 78 | L | 35.6 | Very low | 35.4 | Very low | 171 Ų | 171 | 134.3 Ų | 134.3 | 90% | 0.895 | 77% | 0.772 | S | S | * | * | -168.8 | 116.9 | 104.7 | -92.1 | 159.6 | 0 | 0 | 0 | 111.3 | |||||
| 79 | S | 31.9 | Very low | 35 | Very low | 108 Ų | 108 | 135.1 Ų | 135.1 | 76% | 0.755 | 78% | 0.776 | S | S | * | * | trans | 54.2 | 125.6 | 150.7 | -147 | 0 | 0 | 0 | 0 | 122.8 | ||||
| 80 | P | 38.7 | Very low | 34.7 | Very low | 123 Ų | 123 | 135.3 Ų | 135.3 | 80% | 0.799 | 78% | 0.78 | S | S | * | * | trans | -111.3 | 85.8 | 177 | 38.2 | -23.8 | 0 | 0 | 0 | 112.5 | ||||
| 81 | E | 30.1 | Very low | 34.9 | Very low | 187 Ų | 187 | 136.2 Ų | 136.2 | 87% | 0.874 | 78% | 0.784 | S | S | * | * | trans | -151.2 | 147 | 160.9 | -71.3 | -162.4 | 158.7 | 0 | 0 | 110.7 | ||||
| 82 | S | 36.2 | Very low | 35 | Very low | 107 Ų | 107 | 136 Ų | 136 | 75% | 0.748 | 79% | 0.788 | S | S | * | * | trans | 105.3 | 113.2 | 168.9 | 119.2 | 0 | 0 | 0 | 0 | 118 | ||||
| 83 | L | 39.6 | Very low | 34.9 | Very low | 149 Ų | 149 | 136.5 Ų | 136.5 | 78% | 0.78 | 79% | 0.791 | S | S | * | * | trans | 99.6 | 65.8 | 143 | -64.1 | 161.4 | 0 | 0 | 0 | 118 | ||||
| 84 | V | 34 | Very low | 35 | Very low | 128 Ų | 128 | 135.5 Ų | 135.5 | 78% | 0.776 | 80% | 0.795 | S | S | * | * | -63.8 | 148.7 | 125.4 | -161 | 0 | 0 | 0 | 0 | 107.8 | |||||
| 85 | D | 27.7 | Very low | 34.9 | Very low | 126 Ų | 126 | 139.4 Ų | 139.4 | 67% | 0.674 | 80% | 0.801 | S | S | * | * | trans | 87.2 | 99.5 | 173.2 | -59.9 | -27.1 | 0 | 0 | 0 | 118 | ||||
| 86 | S | 36.9 | Very low | 34.7 | Very low | 105 Ų | 105 | 139.9 Ų | 139.9 | 73% | 0.734 | 80% | 0.801 | S | S | * | * | 175.5 | 103.2 | 115.8 | 35.5 | 0 | 0 | 0 | 0 | 111.7 | |||||
| 87 | W | 35.2 | Very low | 34.6 | Very low | 234 Ų | 234 | 139 Ų | 139 | 89% | 0.886 | 80% | 0.8 | S | S | * | * | 83 | 104.5 | 106.3 | -65.7 | 19.5 | 0 | 0 | 0 | 113.7 | |||||
| 88 | I | 34.5 | Very low | 34.8 | Very low | 154 Ų | 154 | 139.7 Ų | 139.7 | 79% | 0.79 | 81% | 0.806 | S | S | * | * | 37 | 121.7 | 88.1 | -40.4 | -177.9 | 0 | 0 | 0 | 115.1 | |||||
| 89 | L | 33.9 | Very low | 34.8 | Very low | 159 Ų | 159 | 137.5 Ų | 137.5 | 83% | 0.832 | 80% | 0.802 | S | S | * | * | trans | 108.7 | 97.4 | 157.7 | -63 | 172.9 | 0 | 0 | 0 | 118.6 | ||||
| 90 | S | 30.3 | Very low | 35.1 | Very low | 119 Ų | 119 | 137.8 Ų | 137.8 | 83% | 0.832 | 80% | 0.804 | S | S | * | * | 56.2 | 158.7 | 127.5 | -104.2 | 0 | 0 | 0 | 0 | 123.9 | |||||
| 91 | P | 44.5 | Very low | 34.7 | Very low | 111 Ų | 111 | 140.5 Ų | 140.5 | 72% | 0.721 | 81% | 0.806 | S | S | * | * | trans | -113.4 | 158.5 | -141.2 | 42.5 | -33.9 | 0 | 0 | 0 | 115.3 | ||||
| 92 | V | 39.9 | Very low | 35 | Very low | 144 Ų | 144 | 142.8 Ų | 142.8 | 87% | 0.873 | 81% | 0.807 | S | S | * | * | trans | -152 | 140.3 | 157 | 165.6 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 93 | D | 28.8 | Very low | 34.8 | Very low | 149 Ų | 149 | 145.2 Ų | 145.2 | 80% | 0.797 | 81% | 0.81 | S | S | * | * | trans | -53.5 | 141.6 | 176.8 | -57.3 | -63.8 | 0 | 0 | 0 | 114.6 | ||||
| 94 | S | 37.9 | Very low | 34.7 | Very low | 122 Ų | 122 | 144.5 Ų | 144.5 | 85% | 0.853 | 81% | 0.813 | S | S | * | * | trans | -167.1 | 112.2 | 147.3 | -81.8 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 95 | E | 31.4 | Very low | 34.8 | Very low | 196 Ų | 196 | 143.9 Ų | 143.9 | 92% | 0.916 | 81% | 0.814 | S | S | * | * | trans | -63.5 | 123.1 | 161.2 | -61.3 | -166.8 | 152.4 | 0 | 0 | 110.1 | ||||
| 96 | V | 36.2 | Very low | 35.1 | Very low | 132 Ų | 132 | 149 Ų | 149 | 80% | 0.8 | 82% | 0.824 | S | S | * | * | trans | -157.5 | 118.1 | 146.8 | 173.3 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 97 | S | 33.4 | Very low | 35.4 | Very low | 109 Ų | 109 | 148 Ų | 148 | 76% | 0.762 | 82% | 0.817 | S | S | * | * | trans | 28.5 | 107.4 | 149.6 | -56.6 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 98 | A | 34.3 | Very low | 35.8 | Very low | 101 Ų | 101 | 142.3 Ų | 142.3 | 84% | 0.835 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -75.7 | 127.8 | 161.4 | 0 | 0 | 0 | 0 | 0 | 111 | ||
| 99 | P | 36.3 | Very low | 36.3 | Very low | 125 Ų | 125 | 140 Ų | 140 | 81% | 0.812 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -85.7 | 122.5 | 161.6 | 28.3 | -20 | 0 | 0 | 0 | 109.9 | E101 | P99-E101 PolarHBondContact O-N 3.09Š|
| 100 | S | 37.6 | Very low | 37.1 | Very low | 114 Ų | 114 | 139 Ų | 139 | 80% | 0.797 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -47.6 | 120.3 | 163.2 | 174.2 | 0 | 0 | 0 | 0 | 111.4 | ||
| 101 | E | 30.7 | Very low | 38.1 | Very low | 179 Ų | 179 | 139.2 Ų | 139.2 | 84% | 0.836 | 78% | 0.784 | S | S | * | * | trans | 169.3 | 102.2 | 149.9 | -98.2 | 170.2 | -152 | 0 | 0 | 109.6 | P99 | P99-E101 PolarHBondContact O-N 3.09Š| ||
| 102 | R | 34.9 | Very low | 38.8 | Very low | 236 Ų | 236 | 136.8 Ų | 136.8 | 89% | 0.891 | 77% | 0.77 | S | S | * | * | trans | 176.5 | 122.9 | 140.9 | -103.4 | 166 | 179 | 165.8 | 1.1 | 113.8 | ||||
| 103 | L | 33.5 | Very low | 39.5 | Very low | 157 Ų | 157 | 137.4 Ų | 137.4 | 82% | 0.822 | 77% | 0.768 | S | S | * | * | trans | 77.3 | 74.2 | 148.7 | -55 | 167.6 | 0 | 0 | 0 | 117.9 | ||||
| 104 | T | 37.5 | Very low | 40.6 | Very low | 135 Ų | 135 | 132 Ų | 132 | 83% | 0.828 | 74% | 0.742 | S | S | * | * | trans | -100 | 92.5 | 147.8 | 46.2 | 0 | 0 | 0 | 0 | 109.4 | R106 | T104-R106 VanDerWaalsContact C-N 3.28Å; T104-R106 PolarHBondContact O-N 3Å | ||
| 105 | S | 35.2 | Very low | 41.6 | Very low | 115 Ų | 115 | 130.3 Ų | 130.3 | 80% | 0.804 | 73% | 0.728 | S | S | * | * | trans | -66.1 | 92.7 | 157.9 | 49.1 | 0 | 0 | 0 | 0 | 108 | S107 | S105-S107 PolarHBondContact O-N 3.02Å; S105-S107 VanDerWaalsContact O-N 3.11Å | ||
| 106 | R | 34.5 | Very low | 42.7 | Very low | 232 Ų | 232 | 129 Ų | 129 | 88% | 0.875 | 72% | 0.722 | S | S | * | * | trans | -68.7 | 96 | 168.2 | -91.4 | 178.3 | 158.9 | -176.2 | -5.6 | 108.3 | T104 S108 | T104-R106 VanDerWaalsContact C-N 3.28Å; T104-R106 PolarHBondContact O-N 3Å; R106-S108 PolarHBondContact O-N 3.16Å | ||
| 107 | S | 41.8 | Very low | 43.5 | Very low | 85 Ų | 85 | 128.7 Ų | 128.7 | 59% | 0.594 | 72% | 0.72 | S | S | * | * | trans | -73.8 | 111.1 | 153.4 | 56.4 | 0 | 0 | 0 | 0 | 106.9 | S105 D109 | S105-S107 PolarHBondContact O-N 3.02Å; S105-S107 VanDerWaalsContact O-N 3.11Å; S107-D109 VanDerWaalsContact C-N 3.27Å; S107-D109 PolarHBondContact O-N 3.1Å; S107-D109 VanDerWaalsContact O-N 3.07Å | ||
| 108 | S | 44.3 | Very low | 44.6 | Very low | 114 Ų | 114 | 125.5 Ų | 125.5 | 80% | 0.797 | 70% | 0.697 | S | S | * | * | trans | -72.4 | 89 | 163.9 | 50.6 | 0 | 0 | 0 | 0 | 107.3 | R106 D110 | R106-S108 PolarHBondContact O-N 3.16Å; S108-D110 PolarHBondContact O-N 2.86Å; S108-D110 VanDerWaalsContact O-N 3.13Å | ||
| 109 | D | 45.4 | Very low | 45.8 | Very low | 107 Ų | 107 | 125.9 Ų | 125.9 | 57% | 0.572 | 68% | 0.677 | S | S | * | * | trans | -72.2 | 103.9 | 170.8 | -67.9 | -35.8 | 0 | 0 | 0 | 107.9 | S107 F111 | S107-D109 VanDerWaalsContact C-N 3.27Å; S107-D109 PolarHBondContact O-N 3.1Å; S107-D109 VanDerWaalsContact O-N 3.07Å; D109-F111 HydrophobicContact CB-CD2 4.03Å; D109-F111 HydrophobicContact CB-CE2 3.44Å; D109-F111 VanDerWaalsContact CB-CE2 3.44Å; D109-F111 HydrophobicContact CB-CZ 3.95Å; D109-F111 WeakPolarHBondContact O-CD2 3.47Å; D109-F111 PolarHBondContact O-N 2.96Å | ||
| 110 | D | 50 | Low | 47.3 | Very low | 136 Ų | 136 | 121.6 Ų | 121.6 | 73% | 0.727 | 66% | 0.656 | S | S | * | * | trans | -76.2 | 89.1 | -178.7 | -147.5 | -21.6 | 0 | 0 | 0 | 109 | S108 S112 | S108-D110 PolarHBondContact O-N 2.86Å; S108-D110 VanDerWaalsContact O-N 3.13Å; D110-S112 PolarHBondContact O-N 2.96Å; D110-S112 PolarHBondContact OD1-OG 3.1Å | ||
| 111 | F | 52.3 | Low | 48.9 | Very low | 124 Ų | 124 | 121.3 Ų | 121.3 | 54% | 0.544 | 64% | 0.642 | S | S | . | * | G | 310 helix | trans | -78.8 | 16.7 | -178.8 | -73.8 | -78.9 | 0 | 0 | 0 | 113.9 | D109 N113 S114 | D109-F111 HydrophobicContact CB-CD2 4.03Å; D109-F111 HydrophobicContact CB-CE2 3.44Å; D109-F111 VanDerWaalsContact CB-CE2 3.44Å; D109-F111 HydrophobicContact CB-CZ 3.95Å; D109-F111 WeakPolarHBondContact O-CD2 3.47Å; D109-F111 PolarHBondContact O-N 2.96Å; F111-N113 PolarHBondContact O-N 3.02Å; F111-N113 VanDerWaalsContact O-N 3.11Å; F111-S114 PolarHBondContact O-N 2.94Å |
| 112 | S | 59.6 | Low | 50.8 | Low | 61 Ų | 61 | 120.9 Ų | 120.9 | 43% | 0.427 | 63% | 0.633 | S | S | . | * | G | 310 helix | trans | -61.1 | -19.1 | -179.1 | 41.5 | 0 | 0 | 0 | 0 | 113.7 | D110 | D110-S112 PolarHBondContact O-N 2.96Å; D110-S112 PolarHBondContact OD1-OG 3.1Å |
| 113 | N | 54.1 | Low | 52.9 | Low | 156 Ų | 156 | 116 Ų | 116 | 83% | 0.834 | 62% | 0.62 | S | S | * | * | G | 310 helix | trans | -111.8 | 12.8 | 179.2 | -68.1 | -37.8 | 0 | 0 | 0 | 115.1 | F111 | F111-N113 PolarHBondContact O-N 3.02Å; F111-N113 VanDerWaalsContact O-N 3.11Å |
| 114 | S | 52.8 | Low | 54.9 | Low | 36 Ų | 36 | 114.4 Ų | 114.4 | 25% | 0.252 | 61% | 0.608 | S | S | . | * | S | Bend | trans | -77 | 133.5 | 178.3 | -153.1 | 0 | 0 | 0 | 0 | 110.3 | F111 E116 S118 | F111-S114 PolarHBondContact O-N 2.94Å; S114-E116 PolarHBondContact O-N 2.95Å; S114-S118 WeakPolarHBondContact OG-CB 3.35Å |
| 115 | P | 57.7 | Low | 56.8 | Low | 87 Ų | 87 | 111.8 Ų | 111.8 | 57% | 0.565 | 59% | 0.589 | S | S | * | * | trans | -55.5 | 141.4 | -178.1 | 20.6 | -31.4 | 0 | 0 | 0 | 110.8 | V117 S118 | P115-V117 PolarHBondContact O-N 3.19Å; P115-S118 WeakPolarHBondContact O-CB 3.37Å; P115-S118 PolarHBondContact O-N 3.13Å | ||
| 116 | E | 53.9 | Low | 58.7 | Low | 169 Ų | 169 | 108.4 Ų | 108.4 | 79% | 0.79 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -49.1 | -30.6 | -172.6 | -68.1 | 179.5 | 154.3 | 0 | 0 | 114.1 | S114 S118 R119 G120 | S114-E116 PolarHBondContact O-N 2.95Å; E116-S118 VanDerWaalsContact C-N 3.26Å; E116-S118 PolarHBondContact O-N 3.43Å; E116-R119 WeakPolarHBondContact O-CB 3.42Å; E116-R119 PolarHBondContact O-N 2.94Å; E116-R119 VanDerWaalsContact O-N 3.07Å; E116-G120 PolarHBondContact O-N 3.37Å; E116-G120 VanDerWaalsContact O-N 3.08Å |
| 117 | V | 53.7 | Low | 60.8 | Low | 125 Ų | 125 | 102 Ų | 102 | 76% | 0.758 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -58 | -37.3 | 175.4 | -174.4 | 0 | 0 | 0 | 0 | 112.3 | P115 H121 | P115-V117 PolarHBondContact O-N 3.19Å; V117-H121 PolarHBondContact O-N 3.04Å |
| 118 | S | 57.5 | Low | 62.3 | Low | 41 Ų | 41 | 101 Ų | 101 | 29% | 0.287 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -70.6 | -36.8 | 176.3 | -57.3 | 0 | 0 | 0 | 0 | 111.5 | S114 P115 E116 H121 W122 | S114-S118 WeakPolarHBondContact OG-CB 3.35Å; P115-S118 WeakPolarHBondContact O-CB 3.37Å; P115-S118 PolarHBondContact O-N 3.13Å; E116-S118 VanDerWaalsContact C-N 3.26Å; E116-S118 PolarHBondContact O-N 3.43Å; S118-H121 PolarHBondContact O-N 3.46Å; S118-W122 PolarHBondContact O-N 2.94Å; S118-W122 VanDerWaalsContact O-N 3.15Å |
| 119 | R | 59.4 | Low | 63.9 | Low | 110 Ų | 110 | 99.3 Ų | 99.3 | 42% | 0.415 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -65.3 | -48.7 | 178.4 | -87.4 | -177.1 | 165.3 | 147.7 | -1.8 | 111.6 | E116 H121 W122 E123 | E116-R119 WeakPolarHBondContact O-CB 3.42Å; E116-R119 PolarHBondContact O-N 2.94Å; E116-R119 VanDerWaalsContact O-N 3.07Å; R119-H121 VanDerWaalsContact C-N 3.28Å; R119-H121 PolarHBondContact O-N 2.96Å; R119-W122 PolarHBondContact O-N 3.28Å; R119-E123 PolarHBondContact O-N 3.39Å |
| 120 | G | 67.4 | Low | 65.3 | Low | 35 Ų | 35 | 98.2 Ų | 98.2 | 36% | 0.361 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -60.9 | -37.1 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | E116 Q124 | E116-G120 PolarHBondContact O-N 3.37Å; E116-G120 VanDerWaalsContact O-N 3.08Å; G120-Q124 WeakPolarHBondContact O-CB 3.42Å; G120-Q124 PolarHBondContact O-N 2.92Å |
| 121 | H | 72 | Confident | 66.5 | Low | 108 Ų | 108 | 99.4 Ų | 99.4 | 50% | 0.5 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -66.3 | -39.4 | 176.8 | -171.2 | 59.8 | 0 | 0 | 0 | 112.9 | V117 S118 R119 Q124 L125 | V117-H121 PolarHBondContact O-N 3.04Å; S118-H121 PolarHBondContact O-N 3.46Å; R119-H121 VanDerWaalsContact C-N 3.28Å; R119-H121 PolarHBondContact O-N 2.96Å; H121-Q124 PolarHBondContact O-N 3.03Å; H121-L125 WeakPolarHBondContact O-CG 3.48Å; H121-L125 PolarHBondContact O-N 3.36Å |
| 122 | W | 69.7 | Low | 67.4 | Low | 170 Ų | 170 | 102.9 Ų | 102.9 | 64% | 0.644 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -71 | -38.7 | 177.5 | -78 | 116.5 | 0 | 0 | 0 | 112.8 | S118 R119 Q124 L125 E126 | S118-W122 PolarHBondContact O-N 2.94Å; S118-W122 VanDerWaalsContact O-N 3.15Å; R119-W122 PolarHBondContact O-N 3.28Å; W122-Q124 VanDerWaalsContact C-N 3.31Å; W122-Q124 PolarHBondContact O-N 3.33Å; W122-L125 HydrophobicContact CE3-CD1 3.91Å; W122-L125 HydrophobicContact CZ3-CD1 4.01Å; W122-L125 PolarHBondContact O-N 3.36Å; W122-E126 WeakPolarHBondContact O-CB 3.42Å; W122-E126 PolarHBondContact O-N 3.5Å |
| 123 | E | 78.3 | Confident | 68 | Low | 133 Ų | 133 | 108.3 Ų | 108.3 | 62% | 0.621 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -60.9 | -41.5 | 172.6 | -75.1 | 176.2 | -177.3 | 0 | 0 | 111.5 | R119 E126 L127 | R119-E123 PolarHBondContact O-N 3.39Å; E123-E126 PolarHBondContact O-N 2.83Å; E123-L127 WeakPolarHBondContact O-CG 3.38Å; E123-L127 PolarHBondContact O-N 3.04Å |
| 124 | Q | 76.3 | Confident | 68.5 | Low | 124 Ų | 124 | 102.7 Ų | 102.7 | 58% | 0.579 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -66.6 | -39 | 177.5 | -162.4 | 172.6 | 24.7 | 0 | 0 | 112.2 | G120 H121 W122 L127 C128 | G120-Q124 WeakPolarHBondContact O-CB 3.42Å; G120-Q124 PolarHBondContact O-N 2.92Å; H121-Q124 PolarHBondContact O-N 3.03Å; W122-Q124 VanDerWaalsContact C-N 3.31Å; W122-Q124 PolarHBondContact O-N 3.33Å; Q124-L127 PolarHBondContact O-N 3.15Å; Q124-C128 PolarHBondContact O-N 3.39Å; Q124-C128 PolarHBondContact O-SG 3.05Å |
| 125 | L | 77.4 | Confident | 69 | Low | 79 Ų | 79 | 106.1 Ų | 106.1 | 41% | 0.414 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -64.7 | -39.6 | 173.2 | -79.9 | 170.8 | 0 | 0 | 0 | 112.2 | H121 W122 C128 R129 | H121-L125 WeakPolarHBondContact O-CG 3.48Å; H121-L125 PolarHBondContact O-N 3.36Å; W122-L125 HydrophobicContact CE3-CD1 3.91Å; W122-L125 HydrophobicContact CZ3-CD1 4.01Å; W122-L125 PolarHBondContact O-N 3.36Å; L125-C128 PolarHBondContact O-N 3.36Å; L125-R129 WeakPolarHBondContact O-CB 3.41Å; L125-R129 PolarHBondContact O-N 2.82Å |
| 126 | E | 75 | Confident | 68.8 | Low | 45 Ų | 45 | 105.1 Ų | 105.1 | 21% | 0.21 | 52% | 0.521 | C | S | . | . | H | α-helix | trans | -68.7 | -39.2 | 178 | -177 | 54.1 | -153.9 | 0 | 0 | 111.6 | W122 E123 R129 Q130 | W122-E126 WeakPolarHBondContact O-CB 3.42Å; W122-E126 PolarHBondContact O-N 3.5Å; E123-E126 PolarHBondContact O-N 2.83Å; E126-R129 WeakPolarHBondContact O-CB 3.41Å; E126-R129 PolarHBondContact O-N 3.35Å; E126-R129 IonicContact OE1-CZ 3.66Å; E126-R129 IonicContact OE1-NE 2.82Å; E126-R129 PolarHBondContact OE1-NE 3.33Å; E126-R129 IonicContact OE1-NH2 3.25Å; E126-R129 PolarHBondContact OE1-NH2 3.13Å; E126-R129 IonicContact OE2-CZ 3.28Å; E126-R129 IonicContact OE2-NE 3.38Å; E126-R129 PolarHBondContact OE2-NE 3.01Å; E126-R129 IonicContact OE2-NH2 3.65Å; E126-Q130 WeakPolarHBondContact O-CB 3.48Å; E126-Q130 VanDerWaalsContact O-CG 3.31Å; E126-Q130 WeakPolarHBondContact O-CG 3.48Å; E126-Q130 PolarHBondContact O-N 3.37Å; E126-Q130 PolarHBondContact OE1-NE2 3.42Å |
| 127 | L | 77.5 | Confident | 68.3 | Low | 97 Ų | 97 | 103.3 Ų | 103.3 | 51% | 0.508 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -60.9 | -45.6 | 170.6 | -76.5 | 168.8 | 0 | 0 | 0 | 111.8 | E123 Q124 R129 Q130 Q131 | E123-L127 WeakPolarHBondContact O-CG 3.38Å; E123-L127 PolarHBondContact O-N 3.04Å; Q124-L127 PolarHBondContact O-N 3.15Å; L127-R129 VanDerWaalsContact C-N 3.29Å; L127-R129 PolarHBondContact O-N 3.42Å; L127-Q130 PolarHBondContact O-N 3.31Å; L127-Q131 WeakPolarHBondContact O-CB 3.32Å; L127-Q131 VanDerWaalsContact O-CG 3.31Å; L127-Q131 WeakPolarHBondContact O-CG 3.33Å; L127-Q131 PolarHBondContact O-N 3.4Å |
| 128 | C | 74.2 | Confident | 67.9 | Low | 63 Ų | 63 | 100.5 Ų | 100.5 | 43% | 0.426 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.5 | -36.7 | 175.2 | -76.4 | 0 | 0 | 0 | 0 | 112.4 | Q124 L125 R132 | Q124-C128 PolarHBondContact O-N 3.39Å; Q124-C128 PolarHBondContact O-SG 3.05Å; L125-C128 PolarHBondContact O-N 3.36Å; C128-R132 PolarHBondContact O-N 3.38Å; C128-R132 VanDerWaalsContact O-N 3.12Å |
| 129 | R | 77.2 | Confident | 67.2 | Low | 80 Ų | 80 | 103.8 Ų | 103.8 | 30% | 0.302 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -65.3 | -48.3 | 175.5 | -170.2 | -170.3 | 73.9 | 89.2 | 1.6 | 110.9 | L125 E126 L127 Q131 R132 Y133 T136 | L125-R129 WeakPolarHBondContact O-CB 3.41Å; L125-R129 PolarHBondContact O-N 2.82Å; E126-R129 WeakPolarHBondContact O-CB 3.41Å; E126-R129 PolarHBondContact O-N 3.35Å; E126-R129 IonicContact OE1-CZ 3.66Å; E126-R129 IonicContact OE1-NE 2.82Å; E126-R129 PolarHBondContact OE1-NE 3.33Å; E126-R129 IonicContact OE1-NH2 3.25Å; E126-R129 PolarHBondContact OE1-NH2 3.13Å; E126-R129 IonicContact OE2-CZ 3.28Å; E126-R129 IonicContact OE2-NE 3.38Å; E126-R129 PolarHBondContact OE2-NE 3.01Å; E126-R129 IonicContact OE2-NH2 3.65Å; L127-R129 VanDerWaalsContact C-N 3.29Å; L127-R129 PolarHBondContact O-N 3.42Å; R129-Q131 VanDerWaalsContact C-N 3.31Å; R129-Q131 PolarHBondContact O-N 3.41Å; R129-R132 PolarHBondContact O-N 2.9Å; R129-R132 VanDerWaalsContact O-N 3.14Å; R129-Y133 HydrophobicContact CG-CD2 4.09Å; R129-Y133 PolarHBondContact O-N 2.66Å; R129-T136 PolarHBondContact NH1-OG1 3.32Å; R129-T136 PolarHBondContact NH2-OG1 3.14Å |
| 130 | Q | 76.2 | Confident | 66.3 | Low | 83 Ų | 83 | 103.1 Ų | 103.1 | 39% | 0.388 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -61.5 | -39.1 | 178.3 | -72.4 | 176.9 | 18.3 | 0 | 0 | 111.9 | E126 L127 R132 G134 | E126-Q130 WeakPolarHBondContact O-CB 3.48Å; E126-Q130 VanDerWaalsContact O-CG 3.31Å; E126-Q130 WeakPolarHBondContact O-CG 3.48Å; E126-Q130 PolarHBondContact O-N 3.37Å; E126-Q130 PolarHBondContact OE1-NE2 3.42Å; L127-Q130 PolarHBondContact O-N 3.31Å; Q130-R132 VanDerWaalsContact C-N 3.34Å; Q130-R132 PolarHBondContact O-N 3.24Å; Q130-G134 CarbonylContact O-C 3.47Å; Q130-G134 WeakPolarHBondContact O-CA 3.48Å; Q130-G134 PolarHBondContact O-N 2.82Å |
| 131 | Q | 74.4 | Confident | 65.3 | Low | 161 Ų | 161 | 109 Ų | 109 | 75% | 0.752 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -65.2 | -35 | 174.8 | -75.6 | 177.7 | 0.1 | 0 | 0 | 113 | L127 R129 | L127-Q131 WeakPolarHBondContact O-CB 3.32Å; L127-Q131 VanDerWaalsContact O-CG 3.31Å; L127-Q131 WeakPolarHBondContact O-CG 3.33Å; L127-Q131 PolarHBondContact O-N 3.4Å; R129-Q131 VanDerWaalsContact C-N 3.31Å; R129-Q131 PolarHBondContact O-N 3.41Å |
| 132 | R | 71.3 | Confident | 63.6 | Low | 198 Ų | 198 | 108.3 Ų | 108.3 | 75% | 0.747 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -85.7 | -33.7 | -178.1 | -79.2 | -170 | -178.5 | -167.4 | 2 | 114.7 | C128 R129 Q130 | C128-R132 PolarHBondContact O-N 3.38Å; C128-R132 VanDerWaalsContact O-N 3.12Å; R129-R132 PolarHBondContact O-N 2.9Å; R129-R132 VanDerWaalsContact O-N 3.14Å; Q130-R132 VanDerWaalsContact C-N 3.34Å; Q130-R132 PolarHBondContact O-N 3.24Å |
| 133 | Y | 72.8 | Confident | 62.3 | Low | 175 Ų | 175 | 106.7 Ų | 106.7 | 69% | 0.686 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -124 | 4.5 | -169.3 | -57.8 | -71.4 | 0 | 0 | 0 | 113.6 | R129 | R129-Y133 HydrophobicContact CG-CD2 4.09Å; R129-Y133 PolarHBondContact O-N 2.66Å |
| 134 | G | 64.7 | Low | 60.4 | Low | 38 Ų | 38 | 106.3 Ų | 106.3 | 39% | 0.392 | 58% | 0.578 | S | S | . | * | trans | 77.2 | 171.9 | -174.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | Q130 T136 | Q130-G134 CarbonylContact O-C 3.47Å; Q130-G134 WeakPolarHBondContact O-CA 3.48Å; Q130-G134 PolarHBondContact O-N 2.82Å; G134-T136 PolarHBondContact O-N 3.06Å | ||
| 135 | S | 62.7 | Low | 58.6 | Low | 107 Ų | 107 | 105.4 Ų | 105.4 | 75% | 0.748 | 59% | 0.586 | S | S | * | * | trans | -72.2 | 106.8 | 171.2 | 50.5 | 0 | 0 | 0 | 0 | 109 | S137 | S135-S137 PolarHBondContact O-N 3.44Š| ||
| 136 | T | 53.2 | Low | 56.7 | Low | 67 Ų | 67 | 107 Ų | 107 | 41% | 0.411 | 60% | 0.604 | S | S | . | * | trans | -71 | 112.8 | 163.2 | 50.1 | 0 | 0 | 0 | 0 | 107.1 | R129 G134 S138 | R129-T136 PolarHBondContact NH1-OG1 3.32Å; R129-T136 PolarHBondContact NH2-OG1 3.14Å; G134-T136 PolarHBondContact O-N 3.06Å; T136-S138 PolarHBondContact O-N 3.37Å | ||
| 137 | S | 44.3 | Very low | 54.7 | Low | 131 Ų | 131 | 113.6 Ų | 113.6 | 92% | 0.916 | 64% | 0.637 | S | S | * | * | trans | -64.3 | 74.8 | 166.3 | 61.6 | 0 | 0 | 0 | 0 | 109.3 | S135 | S135-S137 PolarHBondContact O-N 3.44Š| ||
| 138 | S | 45 | Very low | 52.8 | Low | 66 Ų | 66 | 114.7 Ų | 114.7 | 46% | 0.462 | 65% | 0.652 | S | S | . | * | trans | -125.4 | 107.3 | 166.8 | 62.2 | 0 | 0 | 0 | 0 | 105.8 | T136 C140 | T136-S138 PolarHBondContact O-N 3.37Å; S138-C140 PolarHBondContact O-N 3.49Å | ||
| 139 | S | 41.6 | Very low | 50.9 | Low | 110 Ų | 110 | 116.3 Ų | 116.3 | 77% | 0.769 | 66% | 0.664 | S | S | * | * | trans | -63.7 | 58.8 | 176.2 | 66.7 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 140 | C | 41 | Very low | 49 | Very low | 96 Ų | 96 | 118.6 Ų | 118.6 | 65% | 0.649 | 68% | 0.683 | S | S | * | * | trans | -110 | -8.1 | 179.7 | -47.9 | 0 | 0 | 0 | 0 | 111.5 | S138 | S138-C140 PolarHBondContact O-N 3.49Š| ||
| 141 | F | 45.9 | Very low | 47.2 | Very low | 158 Ų | 158 | 122.3 Ų | 122.3 | 69% | 0.693 | 71% | 0.705 | S | S | * | * | trans | -123.4 | 52.6 | 169.8 | -75.5 | -81.1 | 0 | 0 | 0 | 110.4 | M143 | F141-M143 PolarHBondContact O-N 3.22Å; F141-M143 VanDerWaalsContact O-N 3.12Å | ||
| 142 | S | 36.4 | Very low | 45.4 | Very low | 94 Ų | 94 | 117.7 Ų | 117.7 | 66% | 0.657 | 70% | 0.701 | S | S | * | * | trans | -80.4 | 71.1 | 154.4 | -65.5 | 0 | 0 | 0 | 0 | 107.5 | T144 | S142-T144 VanDerWaalsContact C-N 3.26Å; S142-T144 PolarHBondContact O-N 3.25Å; S142-T144 VanDerWaalsContact O-N 3.08Å | ||
| 143 | M | 43.2 | Very low | 43.6 | Very low | 135 Ų | 135 | 117 Ų | 117 | 67% | 0.665 | 71% | 0.706 | S | S | * | * | trans | -74.4 | 93.5 | 160.2 | -65.6 | -161.3 | 88.3 | 0 | 0 | 105.9 | F141 S145 | F141-M143 PolarHBondContact O-N 3.22Å; F141-M143 VanDerWaalsContact O-N 3.12Å; M143-S145 PolarHBondContact O-N 3.06Å | ||
| 144 | T | 38.2 | Very low | 41.9 | Very low | 126 Ų | 126 | 115 Ų | 115 | 77% | 0.773 | 71% | 0.712 | S | S | * | * | trans | -63.9 | 88.9 | 160.2 | 49.1 | 0 | 0 | 0 | 0 | 107.1 | S142 S146 | S142-T144 VanDerWaalsContact C-N 3.26Å; S142-T144 PolarHBondContact O-N 3.25Å; S142-T144 VanDerWaalsContact O-N 3.08Å; T144-S146 PolarHBondContact O-N 3.3Å | ||
| 145 | S | 38.8 | Very low | 40.6 | Very low | 105 Ų | 105 | 121.5 Ų | 121.5 | 73% | 0.734 | 73% | 0.73 | S | S | * | * | trans | -70.2 | 89.5 | 161.1 | 17.7 | 0 | 0 | 0 | 0 | 107.2 | M143 M147 | M143-S145 PolarHBondContact O-N 3.06Å; S145-M147 PolarHBondContact O-N 3.38Å | ||
| 146 | S | 36.5 | Very low | 39.5 | Very low | 113 Ų | 113 | 122 Ų | 122 | 79% | 0.79 | 73% | 0.731 | S | S | * | * | trans | -61.6 | 116.8 | 159.3 | -77.3 | 0 | 0 | 0 | 0 | 107.9 | T144 | T144-S146 PolarHBondContact O-N 3.3Š| ||
| 147 | M | 34.4 | Very low | 38.9 | Very low | 183 Ų | 183 | 127.1 Ų | 127.1 | 90% | 0.901 | 76% | 0.755 | S | S | * | * | trans | -58 | 130.7 | 176.1 | -57.7 | 173.9 | 68.2 | 0 | 0 | 110.4 | S145 | S145-M147 PolarHBondContact O-N 3.38Š| ||
| 148 | S | 37.5 | Very low | 38.8 | Very low | 119 Ų | 119 | 126.2 Ų | 126.2 | 83% | 0.832 | 74% | 0.743 | S | S | * | * | trans | -126.5 | 112.4 | 148.7 | 59.9 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 149 | S | 34.3 | Very low | 38.5 | Very low | 97 Ų | 97 | 130.7 Ų | 130.7 | 68% | 0.678 | 76% | 0.762 | S | S | * | * | trans | -71.1 | 136.1 | 179.5 | -163.4 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 150 | D | 37.2 | Very low | 38.2 | Very low | 129 Ų | 129 | 132.3 Ų | 132.3 | 69% | 0.69 | 76% | 0.762 | S | S | * | * | 152.8 | 112.1 | 122.6 | -79.9 | -12.6 | 0 | 0 | 0 | 112.2 | |||||
| 151 | N | 37.6 | Very low | 38.3 | Very low | 160 Ų | 160 | 133.8 Ų | 133.8 | 86% | 0.856 | 77% | 0.768 | S | S | * | * | trans | 66.4 | 78.3 | 142.9 | -54.7 | -14.4 | 0 | 0 | 0 | 118.1 | ||||
| 152 | G | 35.9 | Very low | 38.1 | Very low | 65 Ų | 65 | 131.2 Ų | 131.2 | 67% | 0.67 | 77% | 0.769 | S | S | * | * | trans | -139.9 | 117.1 | 155.5 | 0 | 0 | 0 | 0 | 0 | 109.3 | T154 | G152-T154 PolarHBondContact O-N 3.4Š| ||
| 153 | E | 34.2 | Very low | 38.1 | Very low | 183 Ų | 183 | 137.4 Ų | 137.4 | 86% | 0.855 | 79% | 0.785 | S | S | * | * | trans | -51.6 | 103.4 | -175.8 | -63.3 | 173.6 | 147.1 | 0 | 0 | 112.7 | F155 | E153-F155 PolarHBondContact O-N 3.17Š| ||
| 154 | T | 36.5 | Very low | 37.6 | Very low | 133 Ų | 133 | 133.6 Ų | 133.6 | 82% | 0.816 | 78% | 0.78 | S | S | * | * | trans | -81.6 | 108.4 | 166.4 | -45.1 | 0 | 0 | 0 | 0 | 108.2 | G152 | G152-T154 PolarHBondContact O-N 3.4Š| ||
| 155 | F | 37.9 | Very low | 37.3 | Very low | 175 Ų | 175 | 132.8 Ų | 132.8 | 77% | 0.768 | 78% | 0.78 | S | S | * | * | trans | -55.6 | 128.2 | 171 | -71.1 | -89.8 | 0 | 0 | 0 | 110.1 | E153 L157 | E153-F155 PolarHBondContact O-N 3.17Å; F155-L157 PolarHBondContact O-N 3.16Å; F155-L157 VanDerWaalsContact O-N 3.12Å | ||
| 156 | P | 38.9 | Very low | 37.2 | Very low | 117 Ų | 117 | 135.1 Ų | 135.1 | 76% | 0.76 | 78% | 0.784 | S | S | * | * | trans | -72.3 | 108.5 | 176.7 | 28.6 | -30.6 | 0 | 0 | 0 | 108.9 | V158 | P156-V158 PolarHBondContact O-N 3.18Å; P156-V158 VanDerWaalsContact O-N 3.07Å | ||
| 157 | L | 41.5 | Very low | 37.3 | Very low | 175 Ų | 175 | 136.2 Ų | 136.2 | 92% | 0.916 | 79% | 0.786 | S | S | * | * | trans | -82.7 | 62.2 | 169.5 | -147.9 | 104.9 | 0 | 0 | 0 | 109.3 | F155 | F155-L157 PolarHBondContact O-N 3.16Å; F155-L157 VanDerWaalsContact O-N 3.12Å | ||
| 158 | V | 41.5 | Very low | 37.7 | Very low | 111 Ų | 111 | 137.3 Ų | 137.3 | 67% | 0.673 | 78% | 0.781 | S | S | * | * | trans | -144.3 | 92.6 | 168.5 | -171.7 | 0 | 0 | 0 | 0 | 108.6 | P156 | P156-V158 PolarHBondContact O-N 3.18Å; P156-V158 VanDerWaalsContact O-N 3.07Å | ||
| 159 | D | 39.6 | Very low | 38.1 | Very low | 160 Ų | 160 | 136 Ų | 136 | 86% | 0.856 | 77% | 0.77 | S | S | * | * | trans | -88 | 102.1 | 146.1 | -84.1 | -26.7 | 0 | 0 | 0 | 106.6 | V161 | D159-V161 PolarHBondContact O-N 3.17Š| ||
| 160 | D | 35.3 | Very low | 38.6 | Very low | 144 Ų | 144 | 137 Ų | 137 | 77% | 0.77 | 77% | 0.774 | S | S | * | * | trans | 24.5 | 83.9 | 142.8 | -66.9 | -27.8 | 0 | 0 | 0 | 117.6 | ||||
| 161 | V | 43 | Very low | 38.7 | Very low | 128 Ų | 128 | 138.3 Ų | 138.3 | 78% | 0.776 | 78% | 0.778 | S | S | * | * | trans | -104.9 | 91.2 | 142.8 | -175.2 | 0 | 0 | 0 | 0 | 106.7 | D159 F163 | D159-V161 PolarHBondContact O-N 3.17Å; V161-F163 PolarHBondContact O-N 3.46Å | ||
| 162 | S | 41.1 | Very low | 38.9 | Very low | 103 Ų | 103 | 136.8 Ų | 136.8 | 72% | 0.72 | 77% | 0.77 | S | S | * | * | trans | -26.1 | 114 | 168.7 | 37.7 | 0 | 0 | 0 | 0 | 113.7 | G164 | S162-G164 PolarHBondContact O-N 2.85Š| ||
| 163 | F | 37.6 | Very low | 39.3 | Very low | 224 Ų | 224 | 138.1 Ų | 138.1 | 98% | 0.982 | 77% | 0.774 | S | S | * | * | trans | -60.9 | 96.5 | 159.9 | -85 | -100.1 | 0 | 0 | 0 | 108.9 | V161 | V161-F163 PolarHBondContact O-N 3.46Š| ||
| 164 | G | 32.6 | Very low | 39.8 | Very low | 55 Ų | 55 | 141 Ų | 141 | 57% | 0.567 | 78% | 0.778 | S | S | * | * | trans | -171.8 | 115.5 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | S162 | S162-G164 PolarHBondContact O-N 2.85Š| ||
| 165 | S | 31.8 | Very low | 40.1 | Very low | 110 Ų | 110 | 143.3 Ų | 143.3 | 77% | 0.769 | 77% | 0.771 | S | S | * | * | S | Bend | trans | 60.9 | 112.4 | 168.8 | 67.1 | 0 | 0 | 0 | 0 | 118.8 | ||
| 166 | D | 36 | Very low | 40.5 | Very low | 154 Ų | 154 | 142.8 Ų | 142.8 | 82% | 0.824 | 78% | 0.776 | S | S | * | * | trans | 42.3 | 90.1 | 132.6 | -59.3 | -28.1 | 0 | 0 | 0 | 119.1 | ||||
| 167 | V | 38.8 | Very low | 40.6 | Very low | 136 Ų | 136 | 145.5 Ų | 145.5 | 82% | 0.824 | 78% | 0.776 | S | S | * | * | trans | -148.9 | 76 | 131.2 | -166.5 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 168 | Y | 43.1 | Very low | 40.6 | Very low | 206 Ų | 206 | 149.6 Ų | 149.6 | 81% | 0.808 | 78% | 0.779 | S | S | * | * | trans | -66.7 | 130.3 | 140.8 | -102.8 | -94.5 | 0 | 0 | 0 | 105.9 | ||||
| 169 | P | 46.6 | Very low | 40.7 | Very low | 92 Ų | 92 | 150 Ų | 150 | 60% | 0.597 | 77% | 0.773 | S | S | * | * | trans | -59.8 | 131.5 | 160 | 27.3 | -29.5 | 0 | 0 | 0 | 105.8 | M171 | P169-M171 PolarHBondContact O-N 3.28Š| ||
| 170 | P | 43 | Very low | 40.9 | Very low | 118 Ų | 118 | 145.6 Ų | 145.6 | 77% | 0.766 | 77% | 0.766 | S | S | * | * | trans | -60.3 | 109.2 | -175.7 | 24 | -31 | 0 | 0 | 0 | 107.8 | D172 | P170-D172 PolarHBondContact O-N 3.21Š| ||
| 171 | M | 41.2 | Very low | 41.6 | Very low | 156 Ų | 156 | 149 Ų | 149 | 77% | 0.768 | 77% | 0.768 | S | S | * | * | trans | -72.7 | 83.3 | 173 | -79.7 | -106.3 | -84.3 | 0 | 0 | 107.3 | P169 A173 | P169-M171 PolarHBondContact O-N 3.28Å; M171-A173 PolarHBondContact O-N 3.49Å | ||
| 172 | D | 41.8 | Very low | 42 | Very low | 128 Ų | 128 | 146.5 Ų | 146.5 | 68% | 0.684 | 76% | 0.76 | S | S | * | * | trans | -63.5 | 90.5 | 159.4 | -94.8 | -21.9 | 0 | 0 | 0 | 107.9 | P170 R174 R175 | P170-D172 PolarHBondContact O-N 3.21Å; D172-R174 PolarHBondContact O-N 3.14Å; D172-R175 PolarHBondContact O-N 3.15Å; D172-R175 VanDerWaalsContact O-N 3.11Å | ||
| 173 | A | 44.2 | Very low | 42.6 | Very low | 92 Ų | 92 | 149.5 Ų | 149.5 | 76% | 0.76 | 77% | 0.768 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.8 | 19.5 | -178.7 | 0 | 0 | 0 | 0 | 0 | 114.6 | M171 | M171-A173 PolarHBondContact O-N 3.49Š|
| 174 | R | 43.8 | Very low | 43.6 | Very low | 245 Ų | 245 | 143.8 Ų | 143.8 | 93% | 0.925 | 75% | 0.752 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -112.5 | 3.2 | 169.6 | -65.7 | -172.4 | -173 | -176.3 | 3.5 | 113.8 | D172 | D172-R174 PolarHBondContact O-N 3.14Š|
| 175 | R | 42.6 | Very low | 45.4 | Very low | 180 Ų | 180 | 150.8 Ų | 150.8 | 68% | 0.679 | 76% | 0.761 | S | S | * | * | trans | -109.6 | 18.9 | 178 | -79.7 | -167.2 | 176.4 | -143.7 | 7.6 | 116 | D172 K177 E179 | D172-R175 PolarHBondContact O-N 3.15Å; D172-R175 VanDerWaalsContact O-N 3.11Å; R175-K177 PolarHBondContact O-N 3.34Å; R175-E179 IonicContact NH1-OE1 2.69Å | ||
| 176 | L | 46.1 | Very low | 47.7 | Very low | 165 Ų | 165 | 153.8 Ų | 153.8 | 86% | 0.864 | 76% | 0.763 | S | S | * | * | trans | -74.6 | 49.8 | 163.5 | -95.7 | 139.1 | 0 | 0 | 0 | 111.8 | ||||
| 177 | K | 40.6 | Very low | 50 | Low | 174 Ų | 174 | 151.8 Ų | 151.8 | 76% | 0.757 | 75% | 0.747 | S | S | * | * | S | Bend | trans | -99.6 | 96.8 | 162 | -78.2 | -174.6 | 178.1 | -179.2 | 0 | 106.7 | R175 E179 | R175-K177 PolarHBondContact O-N 3.34Å; K177-E179 VanDerWaalsContact C-N 3.26Å; K177-E179 PolarHBondContact O-N 3.06Å |
| 178 | W | 42.4 | Very low | 52.5 | Low | 260 Ų | 260 | 147.6 Ų | 147.6 | 99% | 0.985 | 72% | 0.724 | S | S | * | * | trans | 25.3 | 56 | 157.7 | -102.9 | 77 | 0 | 0 | 0 | 115.9 | G180 | W178-G180 PolarHBondContact O-N 2.83Š| ||
| 179 | E | 42.6 | Very low | 54.8 | Low | 119 Ų | 119 | 147.9 Ų | 147.9 | 56% | 0.556 | 72% | 0.724 | S | S | * | * | trans | -82.6 | 63.9 | 172 | -76.4 | -168.1 | -176.9 | 0 | 0 | 108 | R175 K177 R181 | R175-E179 IonicContact NH1-OE1 2.69Å; K177-E179 VanDerWaalsContact C-N 3.26Å; K177-E179 PolarHBondContact O-N 3.06Å; E179-R181 PolarHBondContact O-N 3.07Å | ||
| 180 | G | 43.8 | Very low | 57.1 | Low | 68 Ų | 68 | 147.3 Ų | 147.3 | 70% | 0.701 | 72% | 0.722 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.3 | 31.5 | 177.4 | 0 | 0 | 0 | 0 | 0 | 114.4 | W178 | W178-G180 PolarHBondContact O-N 2.83Š|
| 181 | R | 50.7 | Low | 59.5 | Low | 217 Ų | 217 | 145 Ų | 145 | 82% | 0.819 | 70% | 0.703 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -145.4 | -2.4 | -178.1 | -70.5 | -167.7 | -177.5 | -165 | 1.4 | 115.8 | E179 N183 V184 | E179-R181 PolarHBondContact O-N 3.07Å; R181-N183 VanDerWaalsContact C-N 3.33Å; R181-N183 PolarHBondContact O-N 3.37Å; R181-V184 WeakPolarHBondContact O-CG2 3.35Å; R181-V184 PolarHBondContact O-N 3.1Å |
| 182 | A | 51.7 | Low | 62 | Low | 74 Ų | 74 | 142.2 Ų | 142.2 | 61% | 0.612 | 69% | 0.69 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.9 | -7.6 | -169.3 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||
| 183 | N | 53.2 | Low | 64.6 | Low | 166 Ų | 166 | 141.1 Ų | 141.1 | 89% | 0.888 | 68% | 0.684 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -117.4 | 35.3 | 173.9 | -74.2 | -25.3 | 0 | 0 | 0 | 112.2 | R181 R185 | R181-N183 VanDerWaalsContact C-N 3.33Å; R181-N183 PolarHBondContact O-N 3.37Å; N183-R185 PolarHBondContact O-N 3.47Å; N183-R185 VanDerWaalsContact O-N 3.13Å |
| 184 | V | 58.8 | Low | 67 | Low | 104 Ų | 104 | 139.5 Ų | 139.5 | 63% | 0.63 | 67% | 0.671 | S | S | * | * | trans | -79.9 | 92.8 | 168.6 | -178.6 | 0 | 0 | 0 | 0 | 107.4 | R181 E186 | R181-V184 WeakPolarHBondContact O-CG2 3.35Å; R181-V184 PolarHBondContact O-N 3.1Å; V184-E186 PolarHBondContact O-N 3.41Å; V184-E186 VanDerWaalsContact O-N 3.12Å | ||
| 185 | R | 70.9 | Confident | 69.5 | Low | 203 Ų | 203 | 131.2 Ų | 131.2 | 77% | 0.766 | 64% | 0.644 | S | S | * | * | trans | -67.6 | 106.8 | 167.9 | -173.1 | 175.8 | -177.4 | 174.8 | 0.3 | 107.5 | N183 F187 | N183-R185 PolarHBondContact O-N 3.47Å; N183-R185 VanDerWaalsContact O-N 3.13Å; R185-F187 PolarHBondContact O-N 3.15Å | ||
| 186 | E | 80.4 | Confident | 72.1 | Confident | 173 Ų | 173 | 126.2 Ų | 126.2 | 81% | 0.808 | 63% | 0.631 | S | S | * | * | P | Polyproline II helix | trans | -69.7 | 118.4 | 173.3 | -67.8 | -173.9 | 171 | 0 | 0 | 108.8 | V184 | V184-E186 PolarHBondContact O-N 3.41Å; V184-E186 VanDerWaalsContact O-N 3.12Å |
| 187 | F | 84.2 | Confident | 74.5 | Confident | 111 Ų | 111 | 121 Ų | 121 | 49% | 0.487 | 61% | 0.611 | S | S | . | * | P | Polyproline II helix | trans | -74.8 | 127.9 | 172.7 | -72.9 | -78.5 | 0 | 0 | 0 | 109 | R185 D191 L192 I195 | R185-F187 PolarHBondContact O-N 3.15Å; F187-D191 HydrophobicContact CB-CB 4.25Å; F187-D191 HydrophobicContact CD1-CB 3.9Å; F187-L192 HydrophobicContact CB-CD2 3.68Å; F187-L192 HydrophobicContact CB-CG 3.83Å; F187-L192 HydrophobicContact CD2-CD2 4.49Å; F187-L192 HydrophobicContact CG-CD2 4.15Å; F187-I195 HydrophobicContact CD1-CD1 3.79Å; F187-I195 HydrophobicContact CE1-CD1 3.66Å; F187-I195 HydrophobicContact CZ-CD1 4.33Å |
| 188 | S | 91.4 | Very high | 77.2 | Confident | 49 Ų | 49 | 118.2 Ų | 118.2 | 34% | 0.343 | 60% | 0.601 | S | S | . | * | P | Polyproline II helix | trans | -64.9 | 157.8 | 170.4 | 71.7 | 0 | 0 | 0 | 0 | 109.8 | S190 D191 L192 | S188-S190 PolarHBondContact O-N 3.19Å; S188-S190 PolarHBondContact OG-OG 2.86Å; S188-D191 WeakPolarHBondContact CB-OD2 3.48Å; S188-D191 PolarHBondContact N-OD2 3.16Å; S188-D191 WeakPolarHBondContact O-CB 3.31Å; S188-D191 PolarHBondContact O-N 2.93Å; S188-D191 PolarHBondContact OG-N 3.21Å; S188-D191 PolarHBondContact OG-OD1 3.27Å; S188-D191 PolarHBondContact OG-OD2 3.38Å; S188-L192 PolarHBondContact O-N 3.1Å |
| 189 | R | 91.3 | Very high | 79.8 | Confident | 212 Ų | 212 | 108.6 Ų | 108.6 | 80% | 0.8 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -56.2 | -35.9 | 175.4 | -176.9 | 177.2 | 177.6 | 175.5 | -0.4 | 111.8 | L192 L193 | R189-L192 PolarHBondContact O-N 2.95Å; R189-L193 WeakPolarHBondContact O-CG 3.47Å; R189-L193 PolarHBondContact O-N 3.4Å; R189-L193 VanDerWaalsContact O-N 3.1Å |
| 190 | S | 94.3 | Very high | 82.5 | Confident | 80 Ų | 80 | 109 Ų | 109 | 56% | 0.559 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -63.5 | -41.9 | 173.8 | 32.3 | 0 | 0 | 0 | 0 | 112.3 | S188 L193 A194 | S188-S190 PolarHBondContact O-N 3.19Å; S188-S190 PolarHBondContact OG-OG 2.86Å; S190-L193 PolarHBondContact O-N 2.93Å; S190-A194 PolarHBondContact O-N 3.01Å |
| 191 | D | 92.8 | Very high | 85 | Confident | 69 Ų | 69 | 111.6 Ų | 111.6 | 37% | 0.369 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -64.4 | -43.4 | 178.1 | -56.4 | -35.9 | 0 | 0 | 0 | 110.8 | F187 S188 L193 A194 I195 | F187-D191 HydrophobicContact CB-CB 4.25Å; F187-D191 HydrophobicContact CD1-CB 3.9Å; S188-D191 WeakPolarHBondContact CB-OD2 3.48Å; S188-D191 PolarHBondContact N-OD2 3.16Å; S188-D191 WeakPolarHBondContact O-CB 3.31Å; S188-D191 PolarHBondContact O-N 2.93Å; S188-D191 PolarHBondContact OG-N 3.21Å; S188-D191 PolarHBondContact OG-OD1 3.27Å; S188-D191 PolarHBondContact OG-OD2 3.38Å; D191-L193 VanDerWaalsContact C-N 3.3Å; D191-L193 PolarHBondContact O-N 3.36Å; D191-A194 PolarHBondContact O-N 3.21Å; D191-I195 WeakPolarHBondContact O-CB 3.29Å; D191-I195 VanDerWaalsContact O-CG1 3.23Å; D191-I195 WeakPolarHBondContact O-CG1 3.34Å; D191-I195 PolarHBondContact O-N 3.18Å |
| 192 | L | 94.7 | Very high | 87.3 | Confident | 97 Ų | 97 | 105.8 Ų | 105.8 | 51% | 0.508 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -62.2 | -37.4 | 177.1 | -67.2 | 177.8 | 0 | 0 | 0 | 112.2 | F187 S188 R189 N196 | F187-L192 HydrophobicContact CB-CD2 3.68Å; F187-L192 HydrophobicContact CB-CG 3.83Å; F187-L192 HydrophobicContact CD2-CD2 4.49Å; F187-L192 HydrophobicContact CG-CD2 4.15Å; S188-L192 PolarHBondContact O-N 3.1Å; R189-L192 PolarHBondContact O-N 2.95Å; L192-N196 VanDerWaalsContact O-CB 3.27Å; L192-N196 WeakPolarHBondContact O-CB 3.48Å; L192-N196 PolarHBondContact O-N 2.99Å |
| 193 | L | 96.4 | Very high | 89.5 | Confident | 105 Ų | 105 | 108 Ų | 108 | 55% | 0.55 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -69.2 | -40.2 | 175.2 | -72.1 | 174.6 | 0 | 0 | 0 | 112.1 | R189 S190 D191 N196 A197 | R189-L193 WeakPolarHBondContact O-CG 3.47Å; R189-L193 PolarHBondContact O-N 3.4Å; R189-L193 VanDerWaalsContact O-N 3.1Å; S190-L193 PolarHBondContact O-N 2.93Å; D191-L193 VanDerWaalsContact C-N 3.3Å; D191-L193 PolarHBondContact O-N 3.36Å; L193-N196 PolarHBondContact O-N 3.39Å; L193-A197 WeakPolarHBondContact O-CB 3.49Å; L193-A197 PolarHBondContact O-N 2.8Å |
| 194 | A | 95.2 | Very high | 91.6 | Very high | 59 Ų | 59 | 106.6 Ų | 106.6 | 49% | 0.488 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -63.7 | -47.5 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | S190 D191 N196 A197 E198 | S190-A194 PolarHBondContact O-N 3.01Å; D191-A194 PolarHBondContact O-N 3.21Å; A194-N196 VanDerWaalsContact C-N 3.31Å; A194-N196 PolarHBondContact O-N 3.5Å; A194-A197 PolarHBondContact O-N 3.5Å; A194-E198 PolarHBondContact O-N 3.22Å |
| 195 | I | 95.2 | Very high | 93.5 | Very high | 71 Ų | 71 | 107.1 Ų | 107.1 | 36% | 0.364 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -59.7 | -43.2 | 176.5 | -68.2 | 164.7 | 0 | 0 | 0 | 110.2 | F187 D191 E198 T199 | F187-I195 HydrophobicContact CD1-CD1 3.79Å; F187-I195 HydrophobicContact CE1-CD1 3.66Å; F187-I195 HydrophobicContact CZ-CD1 4.33Å; D191-I195 WeakPolarHBondContact O-CB 3.29Å; D191-I195 VanDerWaalsContact O-CG1 3.23Å; D191-I195 WeakPolarHBondContact O-CG1 3.34Å; D191-I195 PolarHBondContact O-N 3.18Å; I195-E198 PolarHBondContact O-N 3.11Å; I195-T199 WeakPolarHBondContact O-CB 3.45Å; I195-T199 PolarHBondContact O-N 3.07Å; I195-T199 PolarHBondContact O-OG1 2.91Å |
| 196 | N | 97.1 | Very high | 94.7 | Very high | 75 Ų | 75 | 101.9 Ų | 101.9 | 40% | 0.401 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -63.8 | -42 | 177.4 | -172.7 | 11.1 | 0 | 0 | 0 | 112.3 | L192 L193 A194 T199 K200 | L192-N196 VanDerWaalsContact O-CB 3.27Å; L192-N196 WeakPolarHBondContact O-CB 3.48Å; L192-N196 PolarHBondContact O-N 2.99Å; L193-N196 PolarHBondContact O-N 3.39Å; A194-N196 VanDerWaalsContact C-N 3.31Å; A194-N196 PolarHBondContact O-N 3.5Å; N196-T199 PolarHBondContact O-N 3.03Å; N196-K200 WeakPolarHBondContact O-CG 3.29Å; N196-K200 PolarHBondContact O-N 2.92Å; N196-K200 WeakPolarHBondContact OD1-CE 3.48Å |
| 197 | A | 97.2 | Very high | 95.5 | Very high | 54 Ų | 54 | 96.6 Ų | 96.6 | 45% | 0.446 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -62.4 | -44.2 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | L193 A194 T199 K200 L201 | L193-A197 WeakPolarHBondContact O-CB 3.49Å; L193-A197 PolarHBondContact O-N 2.8Å; A194-A197 PolarHBondContact O-N 3.5Å; A197-T199 VanDerWaalsContact C-N 3.35Å; A197-K200 PolarHBondContact O-N 3.13Å; A197-L201 WeakPolarHBondContact O-CG 3.49Å; A197-L201 PolarHBondContact O-N 3.11Å; A197-L201 VanDerWaalsContact O-N 3.14Å |
| 198 | E | 97.3 | Very high | 96.2 | Very high | 117 Ų | 117 | 95.3 Ų | 95.3 | 55% | 0.547 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -62.8 | -42.2 | 175.3 | -172.9 | 178.4 | -177 | 0 | 0 | 111.6 | A194 I195 K200 L201 L202 | A194-E198 PolarHBondContact O-N 3.22Å; I195-E198 PolarHBondContact O-N 3.11Å; E198-K200 VanDerWaalsContact C-N 3.33Å; E198-K200 PolarHBondContact O-N 3.07Å; E198-L201 WeakPolarHBondContact O-CB 3.41Å; E198-L201 PolarHBondContact O-N 2.97Å; E198-L201 VanDerWaalsContact O-N 3.13Å; E198-L202 HydrophobicContact CG-CD1 4.21Å; E198-L202 WeakPolarHBondContact O-CG 3.44Å; E198-L202 PolarHBondContact O-N 3.17Å |
| 199 | T | 97.2 | Very high | 96.5 | Very high | 58 Ų | 58 | 96.4 Ų | 96.4 | 36% | 0.356 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -61.6 | -43.7 | 179.5 | -55.4 | 0 | 0 | 0 | 0 | 110.6 | I195 N196 A197 L201 L202 E203 | I195-T199 WeakPolarHBondContact O-CB 3.45Å; I195-T199 PolarHBondContact O-N 3.07Å; I195-T199 PolarHBondContact O-OG1 2.91Å; N196-T199 PolarHBondContact O-N 3.03Å; A197-T199 VanDerWaalsContact C-N 3.35Å; T199-L201 VanDerWaalsContact C-N 3.33Å; T199-L201 PolarHBondContact O-N 2.81Å; T199-L202 PolarHBondContact O-N 2.64Å; T199-E203 HydrophobicContact CG2-CG 4.5Å; T199-E203 WeakPolarHBondContact O-CB 3.31Å; T199-E203 VanDerWaalsContact O-CG 3.31Å; T199-E203 WeakPolarHBondContact O-CG 3.43Å; T199-E203 PolarHBondContact O-N 3.31Å |
| 200 | K | 98 | Very high | 96.8 | Very high | 127 Ų | 127 | 93.3 Ų | 93.3 | 55% | 0.552 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -63.2 | -37.1 | 175.5 | -73.2 | 179.3 | 179.2 | -175.8 | 0 | 113 | N196 A197 E198 K204 | N196-K200 WeakPolarHBondContact O-CG 3.29Å; N196-K200 PolarHBondContact O-N 2.92Å; N196-K200 WeakPolarHBondContact OD1-CE 3.48Å; A197-K200 PolarHBondContact O-N 3.13Å; E198-K200 VanDerWaalsContact C-N 3.33Å; E198-K200 PolarHBondContact O-N 3.07Å; K200-K204 WeakPolarHBondContact O-CB 3.35Å; K200-K204 PolarHBondContact O-N 3.41Å |
| 201 | L | 97.8 | Very high | 97 | Very high | 123 Ų | 123 | 95.8 Ų | 95.8 | 64% | 0.644 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -66.1 | -43.1 | 175 | -73.6 | 169.6 | 0 | 0 | 0 | 111.3 | A197 E198 T199 K204 R205 | A197-L201 WeakPolarHBondContact O-CG 3.49Å; A197-L201 PolarHBondContact O-N 3.11Å; A197-L201 VanDerWaalsContact O-N 3.14Å; E198-L201 WeakPolarHBondContact O-CB 3.41Å; E198-L201 PolarHBondContact O-N 2.97Å; E198-L201 VanDerWaalsContact O-N 3.13Å; T199-L201 VanDerWaalsContact C-N 3.33Å; T199-L201 PolarHBondContact O-N 2.81Å; L201-K204 PolarHBondContact O-N 2.94Å; L201-R205 PolarHBondContact O-N 3.13Å |
| 202 | L | 97.6 | Very high | 97.2 | Very high | 94 Ų | 94 | 97 Ų | 97 | 49% | 0.492 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -65.9 | -40.1 | 176.8 | -71.8 | 172.4 | 0 | 0 | 0 | 112.1 | E198 T199 R205 N206 | E198-L202 HydrophobicContact CG-CD1 4.21Å; E198-L202 WeakPolarHBondContact O-CG 3.44Å; E198-L202 PolarHBondContact O-N 3.17Å; T199-L202 PolarHBondContact O-N 2.64Å; L202-R205 PolarHBondContact O-N 3.28Å; L202-N206 VanDerWaalsContact O-CB 3.29Å; L202-N206 WeakPolarHBondContact O-CB 3.28Å; L202-N206 PolarHBondContact O-N 3.08Å; L202-N206 PolarHBondContact O-ND2 3.32Å |
| 203 | E | 98 | Very high | 97.3 | Very high | 122 Ų | 122 | 94.8 Ų | 94.8 | 57% | 0.57 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -60.2 | -45.3 | 173.9 | -76.6 | 174.6 | 171.6 | 0 | 0 | 111.4 | T199 N206 A207 | T199-E203 HydrophobicContact CG2-CG 4.5Å; T199-E203 WeakPolarHBondContact O-CB 3.31Å; T199-E203 VanDerWaalsContact O-CG 3.31Å; T199-E203 WeakPolarHBondContact O-CG 3.43Å; T199-E203 PolarHBondContact O-N 3.31Å; E203-N206 PolarHBondContact O-N 3.07Å; E203-A207 PolarHBondContact O-N 3.18Å |
| 204 | K | 98 | Very high | 97.4 | Very high | 135 Ų | 135 | 94.8 Ų | 94.8 | 59% | 0.587 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -61.3 | -48.1 | 175.3 | -174.3 | -177 | 175.6 | -172.5 | 0 | 111.4 | K200 L201 N206 A207 E208 | K200-K204 WeakPolarHBondContact O-CB 3.35Å; K200-K204 PolarHBondContact O-N 3.41Å; L201-K204 PolarHBondContact O-N 2.94Å; K204-N206 VanDerWaalsContact C-N 3.3Å; K204-N206 PolarHBondContact O-N 3.31Å; K204-A207 WeakPolarHBondContact O-CB 3.35Å; K204-A207 PolarHBondContact O-N 3.12Å; K204-A207 VanDerWaalsContact O-N 3.15Å; K204-E208 WeakPolarHBondContact CE-OE1 3.27Å; K204-E208 WeakPolarHBondContact O-CG 3.49Å; K204-E208 PolarHBondContact O-N 3.46Å |
| 205 | R | 97.8 | Very high | 97.4 | Very high | 116 Ų | 116 | 95.7 Ų | 95.7 | 44% | 0.438 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -62.9 | -38.1 | 179.1 | -176.1 | 60.4 | -174.6 | 138.6 | 4.8 | 111.9 | L201 L202 E208 L209 | L201-R205 PolarHBondContact O-N 3.13Å; L202-R205 PolarHBondContact O-N 3.28Å; R205-E208 IonicContact NH1-OE2 3.66Å; R205-E208 PolarHBondContact NH1-OE2 3.01Å; R205-E208 PolarHBondContact O-N 3.02Å; R205-L209 HydrophobicContact CG-CD1 4.21Å; R205-L209 WeakPolarHBondContact O-CB 3.47Å; R205-L209 WeakPolarHBondContact O-CG 3.44Å; R205-L209 PolarHBondContact O-N 3.42Å |
| 206 | N | 97 | Very high | 97.5 | Very high | 93 Ų | 93 | 97.5 Ų | 97.5 | 50% | 0.497 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -65.6 | -37.1 | 175.1 | -84.7 | -24.1 | 0 | 0 | 0 | 112.3 | L202 E203 K204 K210 | L202-N206 VanDerWaalsContact O-CB 3.29Å; L202-N206 WeakPolarHBondContact O-CB 3.28Å; L202-N206 PolarHBondContact O-N 3.08Å; L202-N206 PolarHBondContact O-ND2 3.32Å; E203-N206 PolarHBondContact O-N 3.07Å; K204-N206 VanDerWaalsContact C-N 3.3Å; K204-N206 PolarHBondContact O-N 3.31Å; N206-K210 WeakPolarHBondContact O-CG 3.47Å; N206-K210 PolarHBondContact O-N 3.46Å |
| 207 | A | 97.7 | Very high | 97.5 | Very high | 61 Ų | 61 | 99.5 Ų | 99.5 | 50% | 0.504 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -65.3 | -42.1 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | E203 K204 K210 Y211 | E203-A207 PolarHBondContact O-N 3.18Å; K204-A207 WeakPolarHBondContact O-CB 3.35Å; K204-A207 PolarHBondContact O-N 3.12Å; K204-A207 VanDerWaalsContact O-N 3.15Å; A207-K210 PolarHBondContact O-N 3.15Å; A207-Y211 PolarHBondContact O-N 3.28Å; A207-Y211 VanDerWaalsContact O-N 3.13Å |
| 208 | E | 97.9 | Very high | 97.4 | Very high | 85 Ų | 85 | 102.9 Ų | 102.9 | 40% | 0.397 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -62.1 | -45.8 | 175 | -68.8 | 168.6 | -173.8 | 0 | 0 | 111.9 | K204 R205 K210 Y211 E212 | K204-E208 WeakPolarHBondContact CE-OE1 3.27Å; K204-E208 WeakPolarHBondContact O-CG 3.49Å; K204-E208 PolarHBondContact O-N 3.46Å; R205-E208 IonicContact NH1-OE2 3.66Å; R205-E208 PolarHBondContact NH1-OE2 3.01Å; R205-E208 PolarHBondContact O-N 3.02Å; E208-K210 VanDerWaalsContact C-N 3.32Å; E208-K210 PolarHBondContact O-N 3.33Å; E208-Y211 WeakPolarHBondContact O-CB 3.23Å; E208-Y211 PolarHBondContact O-N 3.43Å; E208-E212 PolarHBondContact O-N 3.47Å |
| 209 | L | 97.5 | Very high | 97.4 | Very high | 72 Ų | 72 | 101.9 Ų | 101.9 | 38% | 0.377 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -63.6 | -36.7 | 178.4 | -76.1 | 172.3 | 0 | 0 | 0 | 112.6 | R205 E212 A213 | R205-L209 HydrophobicContact CG-CD1 4.21Å; R205-L209 WeakPolarHBondContact O-CB 3.47Å; R205-L209 WeakPolarHBondContact O-CG 3.44Å; R205-L209 PolarHBondContact O-N 3.42Å; L209-E212 PolarHBondContact O-N 3.04Å; L209-A213 WeakPolarHBondContact O-CB 3.44Å; L209-A213 PolarHBondContact O-N 2.92Å |
| 210 | K | 98 | Very high | 97.4 | Very high | 147 Ų | 147 | 100.7 Ų | 100.7 | 64% | 0.639 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -62.8 | -44.3 | 173.6 | -77.7 | 177.4 | 179.2 | -177 | 0 | 111.4 | N206 A207 E208 A213 E214 | N206-K210 WeakPolarHBondContact O-CG 3.47Å; N206-K210 PolarHBondContact O-N 3.46Å; A207-K210 PolarHBondContact O-N 3.15Å; E208-K210 VanDerWaalsContact C-N 3.32Å; E208-K210 PolarHBondContact O-N 3.33Å; K210-A213 PolarHBondContact O-N 2.73Å; K210-E214 WeakPolarHBondContact O-CG 3.16Å; K210-E214 PolarHBondContact O-N 2.88Å |
| 211 | Y | 97.9 | Very high | 97.3 | Very high | 132 Ų | 132 | 99.7 Ų | 99.7 | 52% | 0.518 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -63.2 | -42.8 | 177.3 | -178.5 | -98.6 | 0 | 0 | 0 | 112.3 | A207 E208 E214 Q215 | A207-Y211 PolarHBondContact O-N 3.28Å; A207-Y211 VanDerWaalsContact O-N 3.13Å; E208-Y211 WeakPolarHBondContact O-CB 3.23Å; E208-Y211 PolarHBondContact O-N 3.43Å; Y211-E214 PolarHBondContact O-N 2.99Å; Y211-Q215 HydrophobicContact CD1-CG 4.41Å; Y211-Q215 VanDerWaalsContact CE1-CD 3.5Å; Y211-Q215 HydrophobicContact CE1-CG 3.96Å; Y211-Q215 VanDerWaalsContact CZ-NE2 3.29Å; Y211-Q215 PolarHBondContact O-N 3.36Å; Y211-Q215 PolarHBondContact OH-NE2 3.5Å |
| 212 | E | 97.4 | Very high | 97.2 | Very high | 94 Ų | 94 | 98.2 Ų | 98.2 | 44% | 0.439 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -61.5 | -45 | 175.6 | -172.7 | 178.5 | 174 | 0 | 0 | 111.5 | E208 L209 E214 Q215 L216 | E208-E212 PolarHBondContact O-N 3.47Å; L209-E212 PolarHBondContact O-N 3.04Å; E212-E214 VanDerWaalsContact C-N 3.35Å; E212-E214 PolarHBondContact O-N 3.47Å; E212-Q215 PolarHBondContact O-N 3.31Å; E212-L216 HydrophobicContact CG-CD1 4.42Å; E212-L216 WeakPolarHBondContact O-CG 3.34Å; E212-L216 PolarHBondContact O-N 2.82Å |
| 213 | A | 97.1 | Very high | 97.1 | Very high | 50 Ų | 50 | 101.6 Ų | 101.6 | 41% | 0.413 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -61.8 | -40.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | L209 K210 L216 L217 | L209-A213 WeakPolarHBondContact O-CB 3.44Å; L209-A213 PolarHBondContact O-N 2.92Å; K210-A213 PolarHBondContact O-N 2.73Å; A213-L216 PolarHBondContact O-N 2.91Å; A213-L217 WeakPolarHBondContact O-CG 3.34Å; A213-L217 PolarHBondContact O-N 3.03Å |
| 214 | E | 97.7 | Very high | 97.1 | Very high | 105 Ų | 105 | 99.3 Ų | 99.3 | 49% | 0.491 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -67.8 | -33.9 | 175.7 | -74.7 | 176 | -168.4 | 0 | 0 | 113.1 | K210 Y211 E212 R218 | K210-E214 WeakPolarHBondContact O-CG 3.16Å; K210-E214 PolarHBondContact O-N 2.88Å; Y211-E214 PolarHBondContact O-N 2.99Å; E212-E214 VanDerWaalsContact C-N 3.35Å; E212-E214 PolarHBondContact O-N 3.47Å; E214-R218 WeakPolarHBondContact O-CG 3.48Å; E214-R218 PolarHBondContact O-N 3.08Å; E214-R218 PolarHBondContact O-NE 3.43Å |
| 215 | Q | 96.6 | Very high | 97 | Very high | 79 Ų | 79 | 96.1 Ų | 96.1 | 37% | 0.369 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -65.7 | -48.7 | 171.6 | -78.4 | -165.9 | -17.8 | 0 | 0 | 111.3 | Y211 E212 L217 R218 D219 | Y211-Q215 HydrophobicContact CD1-CG 4.41Å; Y211-Q215 VanDerWaalsContact CE1-CD 3.5Å; Y211-Q215 HydrophobicContact CE1-CG 3.96Å; Y211-Q215 VanDerWaalsContact CZ-NE2 3.29Å; Y211-Q215 PolarHBondContact O-N 3.36Å; Y211-Q215 PolarHBondContact OH-NE2 3.5Å; E212-Q215 PolarHBondContact O-N 3.31Å; Q215-L217 VanDerWaalsContact C-N 3.28Å; Q215-L217 PolarHBondContact O-N 3.29Å; Q215-R218 PolarHBondContact O-N 2.92Å; Q215-R218 VanDerWaalsContact O-N 3.09Å; Q215-D219 PolarHBondContact O-N 3.03Å |
| 216 | L | 96.9 | Very high | 97 | Very high | 108 Ų | 108 | 97.9 Ų | 97.9 | 57% | 0.565 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -60.7 | -36.5 | 179.7 | -71.8 | 173.2 | 0 | 0 | 0 | 112.7 | E212 A213 G220 | E212-L216 HydrophobicContact CG-CD1 4.42Å; E212-L216 WeakPolarHBondContact O-CG 3.34Å; E212-L216 PolarHBondContact O-N 2.82Å; A213-L216 PolarHBondContact O-N 2.91Å; L216-G220 PolarHBondContact O-N 3.43Å |
| 217 | L | 97.1 | Very high | 96.9 | Very high | 117 Ų | 117 | 96.1 Ų | 96.1 | 61% | 0.613 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -62.9 | -46.8 | 173.5 | -78.7 | 165.9 | 0 | 0 | 0 | 111.7 | A213 Q215 D219 G220 D221 | A213-L217 WeakPolarHBondContact O-CG 3.34Å; A213-L217 PolarHBondContact O-N 3.03Å; Q215-L217 VanDerWaalsContact C-N 3.28Å; Q215-L217 PolarHBondContact O-N 3.29Å; L217-D219 PolarHBondContact O-N 3.2Å; L217-G220 PolarHBondContact O-N 2.82Å; L217-D221 PolarHBondContact O-N 3.25Å |
| 218 | R | 96.1 | Very high | 96.9 | Very high | 125 Ų | 125 | 97.9 Ų | 97.9 | 47% | 0.472 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -63 | -41.5 | 177.3 | -76 | -178.4 | -75.6 | -149.1 | -5.2 | 112.5 | E214 Q215 G220 D221 N222 | E214-R218 WeakPolarHBondContact O-CG 3.48Å; E214-R218 PolarHBondContact O-N 3.08Å; E214-R218 PolarHBondContact O-NE 3.43Å; Q215-R218 PolarHBondContact O-N 2.92Å; Q215-R218 VanDerWaalsContact O-N 3.09Å; R218-G220 VanDerWaalsContact C-N 3.32Å; R218-D221 PolarHBondContact O-N 3.12Å; R218-N222 WeakPolarHBondContact O-CB 3.41Å; R218-N222 VanDerWaalsContact O-CG 3.27Å; R218-N222 PolarHBondContact O-N 3.07Å; R218-N222 PolarHBondContact O-ND2 2.9Å |
| 219 | D | 96.7 | Very high | 96.8 | Very high | 97 Ų | 97 | 96.2 Ų | 96.2 | 52% | 0.519 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -66.5 | -38.5 | 177.1 | -71.7 | -15.7 | 0 | 0 | 0 | 111.3 | Q215 L217 N222 Y223 | Q215-D219 PolarHBondContact O-N 3.03Å; L217-D219 PolarHBondContact O-N 3.2Å; D219-N222 PolarHBondContact O-N 2.92Å; D219-Y223 WeakPolarHBondContact O-CB 3.43Å; D219-Y223 PolarHBondContact O-N 2.83Å |
| 220 | G | 96.4 | Very high | 96.8 | Very high | 33 Ų | 33 | 99.5 Ų | 99.5 | 34% | 0.34 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -58.5 | -51.1 | 171.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | L216 L217 R218 N222 Y223 V224 | L216-G220 PolarHBondContact O-N 3.43Å; L217-G220 PolarHBondContact O-N 2.82Å; R218-G220 VanDerWaalsContact C-N 3.32Å; G220-N222 VanDerWaalsContact C-N 3.34Å; G220-N222 PolarHBondContact O-N 3.33Å; G220-Y223 WeakPolarHBondContact O-CB 3.44Å; G220-Y223 PolarHBondContact O-N 2.9Å; G220-Y223 VanDerWaalsContact O-N 3.16Å; G220-V224 WeakPolarHBondContact O-CG2 3.48Å; G220-V224 PolarHBondContact O-N 3.41Å |
| 221 | D | 95.8 | Very high | 96.6 | Very high | 105 Ų | 105 | 97 Ų | 97 | 56% | 0.561 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -63.9 | -38.8 | 179.4 | -69.2 | -19.1 | 0 | 0 | 0 | 112 | L217 R218 V224 S225 | L217-D221 PolarHBondContact O-N 3.25Å; R218-D221 PolarHBondContact O-N 3.12Å; D221-V224 PolarHBondContact O-N 3.23Å; D221-S225 WeakPolarHBondContact O-CB 3.31Å; D221-S225 PolarHBondContact O-N 3.12Å; D221-S225 PolarHBondContact O-OG 3.18Å |
| 222 | N | 96.2 | Very high | 96.5 | Very high | 93 Ų | 93 | 100.3 Ų | 100.3 | 50% | 0.497 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -63 | -41.2 | 173.4 | -79.3 | -29 | 0 | 0 | 0 | 111.9 | R218 D219 G220 K226 | R218-N222 WeakPolarHBondContact O-CB 3.41Å; R218-N222 VanDerWaalsContact O-CG 3.27Å; R218-N222 PolarHBondContact O-N 3.07Å; R218-N222 PolarHBondContact O-ND2 2.9Å; D219-N222 PolarHBondContact O-N 2.92Å; G220-N222 VanDerWaalsContact C-N 3.34Å; G220-N222 PolarHBondContact O-N 3.33Å; N222-K226 WeakPolarHBondContact O-CG 3.44Å; N222-K226 PolarHBondContact O-N 2.87Å; N222-K226 VanDerWaalsContact O-N 3.07Å |
| 223 | Y | 96.3 | Very high | 96.2 | Very high | 165 Ų | 165 | 103.8 Ų | 103.8 | 65% | 0.647 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -66.2 | -47.3 | 177.3 | -178.8 | -96.7 | 0 | 0 | 0 | 111.4 | D219 G220 S225 K226 V227 | D219-Y223 WeakPolarHBondContact O-CB 3.43Å; D219-Y223 PolarHBondContact O-N 2.83Å; G220-Y223 WeakPolarHBondContact O-CB 3.44Å; G220-Y223 PolarHBondContact O-N 2.9Å; G220-Y223 VanDerWaalsContact O-N 3.16Å; Y223-S225 VanDerWaalsContact C-N 3.32Å; Y223-S225 PolarHBondContact O-N 3.14Å; Y223-K226 PolarHBondContact O-N 3.07Å; Y223-V227 HydrophobicContact CD1-CG2 4.13Å; Y223-V227 HydrophobicContact CE1-CG2 3.69Å; Y223-V227 HydrophobicContact CE2-CG2 4.34Å; Y223-V227 WeakPolarHBondContact O-CG2 3.42Å; Y223-V227 PolarHBondContact O-N 3Å |
| 224 | V | 97.3 | Very high | 95.6 | Very high | 73 Ų | 73 | 110.2 Ų | 110.2 | 44% | 0.442 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -57.3 | -46.8 | 176 | 172.8 | 0 | 0 | 0 | 0 | 110.4 | G220 D221 K226 V227 E228 | G220-V224 WeakPolarHBondContact O-CG2 3.48Å; G220-V224 PolarHBondContact O-N 3.41Å; D221-V224 PolarHBondContact O-N 3.23Å; V224-K226 VanDerWaalsContact C-N 3.32Å; V224-K226 PolarHBondContact O-N 2.69Å; V224-V227 PolarHBondContact O-N 2.74Å; V224-V227 VanDerWaalsContact O-N 3.15Å; V224-E228 HydrophobicContact CG1-CG 4.4Å; V224-E228 WeakPolarHBondContact O-CG 3.45Å; V224-E228 PolarHBondContact O-N 3.48Å |
| 225 | S | 96.6 | Very high | 95.5 | Very high | 68 Ų | 68 | 110.5 Ų | 110.5 | 48% | 0.476 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -59 | -40.6 | 177.9 | -60.1 | 0 | 0 | 0 | 0 | 112.7 | D221 Y223 A229 | D221-S225 WeakPolarHBondContact O-CB 3.31Å; D221-S225 PolarHBondContact O-N 3.12Å; D221-S225 PolarHBondContact O-OG 3.18Å; Y223-S225 VanDerWaalsContact C-N 3.32Å; Y223-S225 PolarHBondContact O-N 3.14Å; S225-A229 WeakPolarHBondContact O-CB 3.49Å; S225-A229 PolarHBondContact O-N 3.11Å |
| 226 | K | 96.7 | Very high | 95.4 | Very high | 153 Ų | 153 | 112.2 Ų | 112.2 | 67% | 0.665 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -66.8 | -40.7 | 176.3 | -75.3 | 174.5 | -177.8 | 177 | 0 | 112.3 | N222 Y223 V224 A229 K230 | N222-K226 WeakPolarHBondContact O-CG 3.44Å; N222-K226 PolarHBondContact O-N 2.87Å; N222-K226 VanDerWaalsContact O-N 3.07Å; Y223-K226 PolarHBondContact O-N 3.07Å; V224-K226 VanDerWaalsContact C-N 3.32Å; V224-K226 PolarHBondContact O-N 2.69Å; K226-A229 PolarHBondContact O-N 2.95Å; K226-K230 WeakPolarHBondContact O-CB 3.46Å; K226-K230 PolarHBondContact O-N 3.12Å |
| 227 | V | 95.9 | Very high | 95.3 | Very high | 57 Ų | 57 | 112.4 Ų | 112.4 | 35% | 0.345 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -65.3 | -45 | 177 | 172.9 | 0 | 0 | 0 | 0 | 110.5 | Y223 V224 A229 K230 N231 | Y223-V227 HydrophobicContact CD1-CG2 4.13Å; Y223-V227 HydrophobicContact CE1-CG2 3.69Å; Y223-V227 HydrophobicContact CE2-CG2 4.34Å; Y223-V227 WeakPolarHBondContact O-CG2 3.42Å; Y223-V227 PolarHBondContact O-N 3Å; V224-V227 PolarHBondContact O-N 2.74Å; V224-V227 VanDerWaalsContact O-N 3.15Å; V227-A229 PolarHBondContact O-N 2.78Å; V227-K230 PolarHBondContact O-N 3.19Å; V227-N231 PolarHBondContact O-N 3.24Å |
| 228 | E | 96.7 | Very high | 95.2 | Very high | 98 Ų | 98 | 112.1 Ų | 112.1 | 46% | 0.458 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -61.8 | -42.8 | 175.9 | -72.5 | -174.7 | -178.2 | 0 | 0 | 112.2 | V224 K230 N231 R232 | V224-E228 HydrophobicContact CG1-CG 4.4Å; V224-E228 WeakPolarHBondContact O-CG 3.45Å; V224-E228 PolarHBondContact O-N 3.48Å; E228-K230 VanDerWaalsContact C-N 3.34Å; E228-K230 PolarHBondContact O-N 3.01Å; E228-N231 PolarHBondContact O-N 2.72Å; E228-R232 WeakPolarHBondContact O-CG 3.31Å; E228-R232 PolarHBondContact O-N 3.28Å; E228-R232 VanDerWaalsContact O-N 3.11Å |
| 229 | A | 96.5 | Very high | 95.2 | Very high | 50 Ų | 50 | 111.3 Ų | 111.3 | 41% | 0.413 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -61.8 | -41.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112 | S225 K226 V227 R232 | S225-A229 WeakPolarHBondContact O-CB 3.49Å; S225-A229 PolarHBondContact O-N 3.11Å; K226-A229 PolarHBondContact O-N 2.95Å; V227-A229 PolarHBondContact O-N 2.78Å; A229-R232 PolarHBondContact O-N 2.95Å |
| 230 | K | 97 | Very high | 95.1 | Very high | 140 Ų | 140 | 112.3 Ų | 112.3 | 61% | 0.609 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -65.7 | -39.9 | 176.4 | -171 | 178.3 | 179.6 | -177.5 | 0 | 112 | K226 V227 E228 R232 Q233 | K226-K230 WeakPolarHBondContact O-CB 3.46Å; K226-K230 PolarHBondContact O-N 3.12Å; V227-K230 PolarHBondContact O-N 3.19Å; E228-K230 VanDerWaalsContact C-N 3.34Å; E228-K230 PolarHBondContact O-N 3.01Å; K230-R232 VanDerWaalsContact C-N 3.26Å; K230-R232 PolarHBondContact O-N 2.84Å; K230-Q233 PolarHBondContact O-N 2.89Å; K230-Q233 VanDerWaalsContact O-N 3.13Å |
| 231 | N | 94.2 | Very high | 95 | Very high | 95 Ų | 95 | 117.9 Ų | 117.9 | 51% | 0.508 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -65.7 | -27.7 | 177 | -77.2 | -10.1 | 0 | 0 | 0 | 113 | V227 E228 Q233 M234 | V227-N231 PolarHBondContact O-N 3.24Å; E228-N231 PolarHBondContact O-N 2.72Å; N231-Q233 VanDerWaalsContact C-N 3.27Å; N231-Q233 PolarHBondContact O-N 2.85Å; N231-M234 VanDerWaalsContact OD1-CE 3.3Å; N231-M234 WeakPolarHBondContact OD1-CE 3.19Å |
| 232 | R | 95 | Very high | 94.9 | Very high | 202 Ų | 202 | 118.9 Ų | 118.9 | 76% | 0.762 | 58% | 0.578 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.2 | -13.3 | 174.2 | -68.4 | 179.3 | -163.4 | -178.4 | 7.1 | 114 | E228 A229 K230 | E228-R232 WeakPolarHBondContact O-CG 3.31Å; E228-R232 PolarHBondContact O-N 3.28Å; E228-R232 VanDerWaalsContact O-N 3.11Å; A229-R232 PolarHBondContact O-N 2.95Å; K230-R232 VanDerWaalsContact C-N 3.26Å; K230-R232 PolarHBondContact O-N 2.84Å |
| 233 | Q | 92.3 | Very high | 94.8 | Very high | 167 Ų | 167 | 121.1 Ų | 121.1 | 78% | 0.78 | 59% | 0.585 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.6 | -13.1 | 179.3 | -68.5 | 178.9 | -7.7 | 0 | 0 | 113.2 | K230 N231 | K230-Q233 PolarHBondContact O-N 2.89Å; K230-Q233 VanDerWaalsContact O-N 3.13Å; N231-Q233 VanDerWaalsContact C-N 3.27Å; N231-Q233 PolarHBondContact O-N 2.85Å |
| 234 | M | 83.6 | Confident | 94.7 | Very high | 185 Ų | 185 | 117.1 Ų | 117.1 | 91% | 0.911 | 58% | 0.579 | S | S | * | * | trans | -91.5 | 0 | 173.6 | -68.1 | -173.7 | -69.2 | 0 | 0 | 110 | N231 | N231-M234 VanDerWaalsContact OD1-CE 3.3Å; N231-M234 WeakPolarHBondContact OD1-CE 3.19Å |
Retrieved 234 of 234 residues in 94.9 ms
(Link to these results)