| 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 | 33.6 | Very low | 29.8 | Very low | 240 Ų | 240 | 163.4 Ų | 163.4 | 100% | 1.182 | 83% | 0.832 | S | S | * | * | 0 | 112.2 | 0 | -87.4 | -174.3 | -92.3 | 0 | 0 | 106.2 | |||||
| 2 | E | 32.3 | Very low | 29.8 | Very low | 202 Ų | 202 | 167.8 Ų | 167.8 | 94% | 0.944 | 83% | 0.831 | S | S | * | * | trans | 61.4 | 110.6 | 162.3 | -67.5 | 170.8 | 172.5 | 0 | 0 | 119.9 | ||||
| 3 | E | 25.9 | Very low | 29.7 | Very low | 186 Ų | 186 | 168 Ų | 168 | 87% | 0.869 | 83% | 0.828 | S | S | * | * | trans | -84.5 | 174.3 | 161.8 | -70.5 | 179 | 134.7 | 0 | 0 | 111 | ||||
| 4 | E | 26.6 | Very low | 29.8 | Very low | 165 Ų | 165 | 162.9 Ų | 162.9 | 77% | 0.771 | 83% | 0.826 | S | S | * | * | trans | 91.7 | 134.3 | 163.8 | -54.6 | -160.1 | 137.7 | 0 | 0 | 117 | ||||
| 5 | H | 27.8 | Very low | 29.8 | Very low | 159 Ų | 159 | 157.9 Ų | 157.9 | 74% | 0.736 | 82% | 0.819 | S | S | * | * | cis | -160.6 | 126.3 | -0.1 | -116.4 | 44.9 | 0 | 0 | 0 | 107.7 | G7 | H5-G7 PolarHBondContact O-N 3.35Š| ||
| 6 | Q | 27 | Very low | 29.8 | Very low | 213 Ų | 213 | 159.1 Ų | 159.1 | 100% | 0.995 | 82% | 0.82 | S | S | * | * | trans | -82.9 | 93.9 | 166.3 | -103.4 | 166.9 | -29.5 | 0 | 0 | 108.6 | ||||
| 7 | G | 26.6 | Very low | 29.7 | Very low | 63 Ų | 63 | 160.6 Ų | 160.6 | 65% | 0.649 | 82% | 0.822 | S | S | * | * | trans | -165 | 54.4 | -178.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | H5 | H5-G7 PolarHBondContact O-N 3.35Š| ||
| 8 | D | 30.5 | Very low | 29.9 | Very low | 120 Ų | 120 | 160.9 Ų | 160.9 | 64% | 0.642 | 83% | 0.826 | S | S | * | * | trans | -152.3 | 27.1 | 176 | -142.9 | 8 | 0 | 0 | 0 | 115.6 | ||||
| 9 | L | 32.1 | Very low | 29.7 | Very low | 167 Ų | 167 | 160.4 Ų | 160.4 | 87% | 0.874 | 83% | 0.831 | S | S | * | * | S | Bend | trans | -95.3 | -9.2 | 172.3 | -116.3 | 99.4 | 0 | 0 | 0 | 114.2 | ||
| 10 | V | 33.4 | Very low | 29.6 | Very low | 129 Ų | 129 | 155.4 Ų | 155.4 | 78% | 0.782 | 82% | 0.82 | S | S | * | * | S | Bend | trans | -92.4 | -17.4 | -177.9 | -179 | 0 | 0 | 0 | 0 | 112.6 | ||
| 11 | H | 31.4 | Very low | 29.5 | Very low | 153 Ų | 153 | 154 Ų | 154 | 71% | 0.708 | 82% | 0.82 | S | S | * | * | S | Bend | trans | -88.8 | -5.9 | -178 | -84.4 | -56.3 | 0 | 0 | 0 | 116 | ||
| 12 | R | 30.5 | Very low | 29.2 | Very low | 216 Ų | 216 | 147.3 Ų | 147.3 | 82% | 0.815 | 80% | 0.803 | S | S | * | * | S | Bend | trans | -97.1 | -6.2 | -179.7 | -84.2 | -174.6 | 175.2 | 164.3 | 1.4 | 116.3 | ||
| 13 | Q | 28.6 | Very low | 29.1 | Very low | 171 Ų | 171 | 143.4 Ų | 143.4 | 80% | 0.799 | 79% | 0.787 | S | S | * | * | G | 310 helix | trans | -85.7 | -11.1 | 175.7 | -89.7 | 175.9 | -28.1 | 0 | 0 | 114.5 | A15 | Q13-A15 VanDerWaalsContact C-N 3.32Å; Q13-A15 PolarHBondContact O-N 3.5Å |
| 14 | A | 30.7 | Very low | 29.4 | Very low | 97 Ų | 97 | 140.2 Ų | 140.2 | 80% | 0.802 | 78% | 0.775 | S | S | * | * | G | 310 helix | trans | -83.3 | -3 | 177.4 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||
| 15 | A | 30.1 | Very low | 29.5 | Very low | 87 Ų | 87 | 137.8 Ų | 137.8 | 72% | 0.719 | 77% | 0.774 | S | S | * | * | G | 310 helix | trans | -105.8 | 0.8 | -171.7 | 0 | 0 | 0 | 0 | 0 | 115 | Q13 | Q13-A15 VanDerWaalsContact C-N 3.32Å; Q13-A15 PolarHBondContact O-N 3.5Å |
| 16 | Q | 28.9 | Very low | 29.7 | Very low | 178 Ų | 178 | 137.3 Ų | 137.3 | 83% | 0.832 | 78% | 0.777 | S | S | * | * | S | Bend | trans | -125.4 | 5.4 | -171.2 | -98.8 | -176.5 | -17.1 | 0 | 0 | 117.4 | ||
| 17 | E | 29 | Very low | 29.8 | Very low | 184 Ų | 184 | 129.5 Ų | 129.5 | 86% | 0.86 | 74% | 0.744 | S | S | * | * | trans | -104 | 2.6 | 178.8 | -96.7 | -173.5 | 165.7 | 0 | 0 | 116.6 | V19 | E17-V19 PolarHBondContact O-N 2.74Š| ||
| 18 | N | 33 | Very low | 29.9 | Very low | 167 Ų | 167 | 135.9 Ų | 135.9 | 89% | 0.893 | 75% | 0.748 | S | S | * | * | trans | -98.9 | 79.7 | 175.6 | -82.4 | -27.2 | 0 | 0 | 0 | 112.3 | ||||
| 19 | V | 26 | Very low | 30 | Very low | 151 Ų | 151 | 137.3 Ų | 137.3 | 92% | 0.915 | 75% | 0.749 | S | S | * | * | trans | -100.8 | 90 | 158.4 | -175.1 | 0 | 0 | 0 | 0 | 107.8 | E17 | E17-V19 PolarHBondContact O-N 2.74Š| ||
| 20 | G | 27.2 | Very low | 30.1 | Very low | 59 Ų | 59 | 131.6 Ų | 131.6 | 61% | 0.608 | 73% | 0.73 | S | S | * | * | S | Bend | trans | -168.6 | 148.2 | 176 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||
| 21 | P | 28 | Very low | 29.9 | Very low | 128 Ų | 128 | 128 Ų | 128 | 83% | 0.831 | 70% | 0.703 | S | S | * | * | -74.4 | 153 | -126.6 | 30.1 | -35.5 | 0 | 0 | 0 | 115.5 | I23 | P21-I23 PolarHBondContact O-N 3.15Š| |||
| 22 | A | 28.4 | Very low | 30 | Very low | 99 Ų | 99 | 122.6 Ų | 122.6 | 82% | 0.818 | 68% | 0.682 | S | S | * | * | trans | -31 | 108.5 | -175.3 | 0 | 0 | 0 | 0 | 0 | 115.4 | L24 | A22-L24 PolarHBondContact O-N 3.43Š| ||
| 23 | I | 29.9 | Very low | 30.4 | Very low | 120 Ų | 120 | 118.5 Ų | 118.5 | 62% | 0.615 | 68% | 0.683 | S | S | * | * | trans | -63.8 | 115.3 | 169 | -57.9 | 174.7 | 0 | 0 | 0 | 107.8 | P21 | P21-I23 PolarHBondContact O-N 3.15Š| ||
| 24 | L | 32 | Very low | 30.8 | Very low | 118 Ų | 118 | 118.6 Ų | 118.6 | 62% | 0.618 | 68% | 0.683 | S | S | * | * | trans | -59.3 | 134.7 | 170.8 | -86.5 | 149.7 | 0 | 0 | 0 | 109.3 | A22 N26 V27 | A22-L24 PolarHBondContact O-N 3.43Å; L24-N26 PolarHBondContact O-N 3.27Å; L24-V27 PolarHBondContact O-N 3.16Å | ||
| 25 | P | 28.5 | Very low | 30.8 | Very low | 115 Ų | 115 | 117.1 Ų | 117.1 | 75% | 0.747 | 66% | 0.659 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.2 | 4.8 | -170.4 | 25 | -33.5 | 0 | 0 | 0 | 115.9 | ||
| 26 | N | 31.4 | Very low | 30.9 | Very low | 148 Ų | 148 | 116.2 Ų | 116.2 | 79% | 0.791 | 65% | 0.646 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.4 | -0.7 | -179.9 | -76 | -9.2 | 0 | 0 | 0 | 114.5 | L24 | L24-N26 PolarHBondContact O-N 3.27Š|
| 27 | V | 29.2 | Very low | 31 | Very low | 50 Ų | 50 | 112.3 Ų | 112.3 | 30% | 0.303 | 64% | 0.644 | S | S | . | * | trans | -104.9 | 94.7 | 176.2 | -170.5 | 0 | 0 | 0 | 0 | 108 | L24 | L24-V27 PolarHBondContact O-N 3.16Š| ||
| 28 | R | 30 | Very low | 31.1 | Very low | 196 Ų | 196 | 107.1 Ų | 107.1 | 74% | 0.74 | 63% | 0.633 | S | S | * | * | trans | -87.1 | 136.6 | 170.8 | -82.6 | -170.5 | 176.4 | -171.4 | -0.6 | 109.7 | F227 | R28-F227 HydrophobicContact CB-CE2 4.49Å; R28-F227 WeakPolarHBondContact O-CE2 3.49Å | ||
| 29 | F | 31.9 | Very low | 30.9 | Very low | 151 Ų | 151 | 103.5 Ų | 103.5 | 66% | 0.662 | 61% | 0.61 | S | S | * | * | trans | -75.6 | 136.6 | 176.2 | -70.4 | -90.9 | 0 | 0 | 0 | 110.9 | ||||
| 30 | G | 33.5 | Very low | 31.1 | Very low | 46 Ų | 46 | 97.5 Ų | 97.5 | 47% | 0.474 | 58% | 0.576 | S | S | . | * | S | Bend | trans | 80.3 | 168.2 | 172.5 | 0 | 0 | 0 | 0 | 0 | 115.5 | F227 | G30-F227 WeakPolarHBondContact O-CZ 3.19Š|
| 31 | Y | 29.9 | Very low | 31.1 | Very low | 54 Ų | 54 | 98.9 Ų | 98.9 | 21% | 0.212 | 58% | 0.582 | C | S | . | * | S | Bend | trans | -57.2 | 150 | 172.8 | -75.4 | -94.4 | 0 | 0 | 0 | 110.7 | F35 A40 | Y31-F35 HydrophobicContact CD1-CB 4.35Å; Y31-F35 HydrophobicContact CD1-CG 4.35Å; Y31-A40 HydrophobicContact CD2-CB 3.58Å; Y31-A40 HydrophobicContact CE2-CB 3.35Å; Y31-A40 HydrophobicContact CG-CB 4.34Å |
| 32 | P | 33.8 | Very low | 31 | Very low | 40 Ų | 40 | 97.3 Ų | 97.3 | 26% | 0.26 | 56% | 0.564 | S | S | . | * | trans | -50.6 | 145 | 171.7 | -18.8 | 26.4 | 0 | 0 | 0 | 110.4 | E34 F35 F227 | P32-E34 PolarHBondContact O-N 2.96Å; P32-F35 HydrophobicContact CB-CD2 4.33Å; P32-F35 HydrophobicContact CG-CD2 4.06Å; P32-F35 WeakPolarHBondContact O-CB 3.29Å; P32-F35 PolarHBondContact O-N 3.41Å; P32-F227 HydrophobicContact CG-CE1 4.17Å | ||
| 33 | P | 37.9 | Very low | 30.9 | Very low | 130 Ų | 130 | 93.2 Ų | 93.2 | 84% | 0.844 | 53% | 0.531 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.4 | -11.6 | 178.7 | 23 | -32.5 | 0 | 0 | 0 | 113.9 | F35 | P33-F35 VanDerWaalsContact C-N 3.29Š|
| 34 | E | 38.7 | Very low | 30.9 | Very low | 172 Ų | 172 | 89.9 Ų | 89.9 | 80% | 0.804 | 52% | 0.517 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.3 | -15.7 | 173.7 | -48 | -176.7 | -135.1 | 0 | 0 | 113 | P32 | P32-E34 PolarHBondContact O-N 2.96Š|
| 35 | F | 30.7 | Very low | 30.5 | Very low | 66 Ų | 66 | 91.7 Ų | 91.7 | 29% | 0.289 | 52% | 0.517 | S | S | . | . | S | Bend | trans | -97.6 | 114.5 | 175.6 | -85.8 | -93 | 0 | 0 | 0 | 109.9 | Y31 P32 P33 A37 P44 | Y31-F35 HydrophobicContact CD1-CB 4.35Å; Y31-F35 HydrophobicContact CD1-CG 4.35Å; P32-F35 HydrophobicContact CB-CD2 4.33Å; P32-F35 HydrophobicContact CG-CD2 4.06Å; P32-F35 WeakPolarHBondContact O-CB 3.29Å; P32-F35 PolarHBondContact O-N 3.41Å; P33-F35 VanDerWaalsContact C-N 3.29Å; F35-A37 PolarHBondContact O-N 3.28Å; F35-P44 HydrophobicContact CE1-CB 4.48Å |
| 36 | P | 30.6 | Very low | 30.3 | Very low | 68 Ų | 68 | 93.2 Ų | 93.2 | 44% | 0.442 | 51% | 0.509 | S | S | . | . | trans | -56.8 | 135.8 | 173.6 | -18 | 28.8 | 0 | 0 | 0 | 109.8 | A38 Q39 | P36-A38 PolarHBondContact O-N 3.22Å; P36-Q39 HydrophobicContact CG-CG 4.44Å; P36-Q39 PolarHBondContact O-N 3.11Å | ||
| 37 | A | 31.6 | Very low | 29.8 | Very low | 96 Ų | 96 | 96.7 Ų | 96.7 | 79% | 0.793 | 51% | 0.513 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.9 | -23.1 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | F35 Q39 | F35-A37 PolarHBondContact O-N 3.28Å; A37-Q39 VanDerWaalsContact C-N 3.32Å; A37-Q39 PolarHBondContact O-N 3.38Å |
| 38 | A | 31 | Very low | 29.5 | Very low | 76 Ų | 76 | 98.7 Ų | 98.7 | 63% | 0.628 | 53% | 0.529 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.9 | -23.1 | 173.6 | 0 | 0 | 0 | 0 | 0 | 114.4 | P36 | P36-A38 PolarHBondContact O-N 3.22Š|
| 39 | Q | 28.3 | Very low | 29.2 | Very low | 91 Ų | 91 | 101 Ų | 101 | 43% | 0.425 | 54% | 0.537 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -89.7 | -15.9 | 179.5 | -70.8 | -178.5 | -4.5 | 0 | 0 | 113.3 | P36 A37 A41 Q42 G43 | P36-Q39 HydrophobicContact CG-CG 4.44Å; P36-Q39 PolarHBondContact O-N 3.11Å; A37-Q39 VanDerWaalsContact C-N 3.32Å; A37-Q39 PolarHBondContact O-N 3.38Å; Q39-A41 PolarHBondContact O-N 2.99Å; Q39-Q42 WeakPolarHBondContact O-CA 3.47Å; Q39-Q42 PolarHBondContact O-N 3.03Å; Q39-G43 PolarHBondContact O-N 3.29Å |
| 40 | A | 29.7 | Very low | 28.7 | Very low | 24 Ų | 24 | 102.5 Ų | 102.5 | 20% | 0.198 | 55% | 0.547 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -62 | -26.9 | 173.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | Y31 Q42 | Y31-A40 HydrophobicContact CD2-CB 3.58Å; Y31-A40 HydrophobicContact CE2-CB 3.35Å; Y31-A40 HydrophobicContact CG-CB 4.34Å; A40-Q42 VanDerWaalsContact C-N 3.32Å |
| 41 | A | 28.5 | Very low | 28.2 | Very low | 88 Ų | 88 | 103.1 Ų | 103.1 | 73% | 0.727 | 55% | 0.552 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.7 | -8.2 | 171.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | Q39 | Q39-A41 PolarHBondContact O-N 2.99Š|
| 42 | Q | 26.5 | Very low | 27.9 | Very low | 95 Ų | 95 | 110.5 Ų | 110.5 | 44% | 0.444 | 59% | 0.586 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -109.8 | -5.2 | -172.9 | -65.4 | -168.5 | -5.4 | 0 | 0 | 114.4 | Q39 A40 T279 | Q39-Q42 WeakPolarHBondContact O-CA 3.47Å; Q39-Q42 PolarHBondContact O-N 3.03Å; A40-Q42 VanDerWaalsContact C-N 3.32Å; Q42-T279 WeakPolarHBondContact O-CG2 3.47Å |
| 43 | G | 25.3 | Very low | 27.5 | Very low | 13 Ų | 13 | 114.2 Ų | 114.2 | 13% | 0.134 | 61% | 0.613 | C | S | . | * | trans | 67.5 | 145.8 | -179.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | Q39 Y45 | Q39-G43 PolarHBondContact O-N 3.29Å; G43-Y45 PolarHBondContact O-N 3.29Å | ||
| 44 | P | 29.3 | Very low | 26.8 | Very low | 50 Ų | 50 | 114.8 Ų | 114.8 | 33% | 0.325 | 61% | 0.609 | S | S | . | * | trans | -77.7 | 124.9 | -175.7 | 31.2 | -31.6 | 0 | 0 | 0 | 110.8 | F35 Y46 | F35-P44 HydrophobicContact CE1-CB 4.48Å; P44-Y46 HydrophobicContact CB-CD2 3.79Å; P44-Y46 HydrophobicContact CB-CE2 3.6Å; P44-Y46 HydrophobicContact CG-CD2 4.12Å; P44-Y46 HydrophobicContact CG-CE2 4.1Å; P44-Y46 PolarHBondContact O-N 3.46Å | ||
| 45 | Y | 23.4 | Very low | 26.1 | Very low | 156 Ų | 156 | 113.5 Ų | 113.5 | 61% | 0.612 | 61% | 0.607 | S | S | * | * | trans | -61.4 | 111.8 | 164.4 | -68 | -93.5 | 0 | 0 | 0 | 109 | G43 | G43-Y45 PolarHBondContact O-N 3.29Š| ||
| 46 | Y | 24.8 | Very low | 25.9 | Very low | 147 Ų | 147 | 121.9 Ų | 121.9 | 58% | 0.576 | 64% | 0.637 | S | S | * | * | trans | -125.2 | 150.4 | 166.4 | -80.2 | -72.8 | 0 | 0 | 0 | 112.3 | P44 | P44-Y46 HydrophobicContact CB-CD2 3.79Å; P44-Y46 HydrophobicContact CB-CE2 3.6Å; P44-Y46 HydrophobicContact CG-CD2 4.12Å; P44-Y46 HydrophobicContact CG-CE2 4.1Å; P44-Y46 PolarHBondContact O-N 3.46Å | ||
| 47 | Y | 21.2 | Very low | 25.8 | Very low | 222 Ų | 222 | 125.5 Ų | 125.5 | 87% | 0.871 | 65% | 0.651 | S | S | * | * | trans | -67.1 | 142.1 | -164.1 | -91.4 | -110.1 | 0 | 0 | 0 | 114.1 | R49 | Y47-R49 PolarHBondContact O-N 3.13Š| ||
| 48 | S | 22.1 | Very low | 25.4 | Very low | 92 Ų | 92 | 126.2 Ų | 126.2 | 64% | 0.643 | 65% | 0.651 | S | S | * | * | trans | -38.9 | 115.1 | 164.7 | 174.8 | 0 | 0 | 0 | 0 | 112.6 | Q50 | S48-Q50 PolarHBondContact O-N 3.5Å; S48-Q50 PolarHBondContact OG-N 3.22Å | ||
| 49 | R | 24 | Very low | 25.3 | Very low | 243 Ų | 243 | 133.3 Ų | 133.3 | 92% | 0.917 | 66% | 0.661 | S | S | * | * | trans | -79.5 | 76.9 | 159.4 | -152.8 | -179.2 | -164.5 | -161.9 | 5.3 | 108.4 | Y47 G51 | Y47-R49 PolarHBondContact O-N 3.13Å; R49-G51 PolarHBondContact O-N 2.99Å | ||
| 50 | Q | 21.9 | Very low | 25.1 | Very low | 184 Ų | 184 | 136.6 Ų | 136.6 | 86% | 0.86 | 68% | 0.682 | S | S | * | * | trans | -60.5 | 104.3 | 154.5 | -84.8 | -173.9 | -9.8 | 0 | 0 | 107.5 | S48 | S48-Q50 PolarHBondContact O-N 3.5Å; S48-Q50 PolarHBondContact OG-N 3.22Å | ||
| 51 | G | 23.3 | Very low | 24.8 | Very low | 58 Ų | 58 | 139.9 Ų | 139.9 | 60% | 0.598 | 71% | 0.709 | S | S | * | * | trans | -175.3 | 64.6 | -174.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | R49 | R49-G51 PolarHBondContact O-N 2.99Š| ||
| 52 | K | 22.7 | Very low | 24.8 | Very low | 209 Ų | 209 | 141.4 Ų | 141.4 | 91% | 0.909 | 71% | 0.711 | S | S | * | * | trans | 36.7 | 108.2 | 147.2 | -63.5 | 178.2 | 178.6 | 177.3 | 0 | 118.4 | ||||
| 53 | S | 26.3 | Very low | 24.7 | Very low | 119 Ų | 119 | 143.3 Ų | 143.3 | 83% | 0.832 | 73% | 0.729 | S | S | * | * | trans | -142.4 | 96.8 | 138.1 | 168.7 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 54 | N | 24 | Very low | 24.7 | Very low | 142 Ų | 142 | 150.6 Ų | 150.6 | 76% | 0.759 | 77% | 0.765 | S | S | * | * | trans | -61.7 | 153.3 | 161.3 | -78.4 | -17.6 | 0 | 0 | 0 | 109.7 | ||||
| 55 | D | 23.5 | Very low | 24.3 | Very low | 144 Ų | 144 | 155.7 Ų | 155.7 | 77% | 0.77 | 79% | 0.785 | S | S | * | * | trans | 85.2 | 127.3 | 162.9 | -60.6 | -31 | 0 | 0 | 0 | 119.4 | ||||
| 56 | R | 25.3 | Very low | 24.3 | Very low | 242 Ų | 242 | 153.5 Ų | 153.5 | 91% | 0.913 | 79% | 0.79 | S | S | * | * | trans | 93.6 | 110.8 | 172 | -56.6 | 170.7 | 176.4 | -174.8 | -1.2 | 112.6 | ||||
| 57 | I | 28.5 | Very low | 24.2 | Very low | 145 Ų | 145 | 152.9 Ų | 152.9 | 74% | 0.744 | 80% | 0.801 | S | S | * | * | cis | -146.7 | 117.2 | 30.4 | -67 | 170.7 | 0 | 0 | 0 | 109.2 | R59 | I57-R59 HydrophobicContact CG2-CB 4.25Å; I57-R59 HydrophobicContact CG2-CG 4.03Å | ||
| 58 | S | 24.3 | Very low | 24.2 | Very low | 111 Ų | 111 | 146.9 Ų | 146.9 | 78% | 0.776 | 79% | 0.791 | S | S | * | * | trans | -76 | 118.7 | 154.1 | 176.2 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 59 | R | 28.8 | Very low | 24.4 | Very low | 225 Ų | 225 | 145.8 Ų | 145.8 | 85% | 0.849 | 78% | 0.777 | S | S | * | * | trans | -141 | 88.2 | 157 | -88 | -166.7 | -178.8 | 169.5 | 1.1 | 110.5 | I57 | I57-R59 HydrophobicContact CG2-CB 4.25Å; I57-R59 HydrophobicContact CG2-CG 4.03Å | ||
| 60 | N | 23 | Very low | 24.4 | Very low | 160 Ų | 160 | 140.1 Ų | 140.1 | 86% | 0.856 | 77% | 0.765 | S | S | * | * | trans | -75.3 | 120.6 | 144.6 | -74.6 | -32.2 | 0 | 0 | 0 | 108.3 | ||||
| 61 | A | 24.5 | Very low | 24.7 | Very low | 93 Ų | 93 | 138.3 Ų | 138.3 | 77% | 0.769 | 76% | 0.757 | S | S | * | * | trans | -179.5 | 132 | 137.3 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 62 | P | 28.1 | Very low | 24.8 | Very low | 119 Ų | 119 | 141.7 Ų | 141.7 | 77% | 0.773 | 77% | 0.766 | S | S | * | * | trans | -94.6 | 137.7 | -169.4 | 36 | -30.6 | 0 | 0 | 0 | 112.2 | ||||
| 63 | T | 24.7 | Very low | 25 | Very low | 136 Ų | 136 | 137.3 Ų | 137.3 | 83% | 0.834 | 76% | 0.757 | S | S | * | * | trans | -134.5 | 94.9 | 154.5 | 28.3 | 0 | 0 | 0 | 0 | 109.1 | E65 | T63-E65 PolarHBondContact O-N 3.37Å; T63-E65 VanDerWaalsContact O-N 3.17Å | ||
| 64 | N | 24.2 | Very low | 25.1 | Very low | 165 Ų | 165 | 135.1 Ų | 135.1 | 88% | 0.882 | 73% | 0.733 | S | S | * | * | trans | -69.2 | 93 | 157.8 | -78.9 | -33.5 | 0 | 0 | 0 | 107.8 | ||||
| 65 | E | 21.6 | Very low | 25.4 | Very low | 158 Ų | 158 | 133.6 Ų | 133.6 | 74% | 0.738 | 73% | 0.734 | S | S | * | * | trans | -115.7 | 127.3 | 154.5 | -78.1 | -168.6 | 164 | 0 | 0 | 108.6 | T63 V67 | T63-E65 PolarHBondContact O-N 3.37Å; T63-E65 VanDerWaalsContact O-N 3.17Å; E65-V67 PolarHBondContact O-N 3.41Å | ||
| 66 | P | 23.2 | Very low | 25.6 | Very low | 110 Ų | 110 | 135.3 Ų | 135.3 | 71% | 0.714 | 74% | 0.739 | S | S | * | * | trans | -72 | 100.7 | 172.1 | 28.9 | -28.7 | 0 | 0 | 0 | 107.9 | S68 | P66-S68 PolarHBondContact O-N 2.87Å; P66-S68 VanDerWaalsContact O-N 3.11Å | ||
| 67 | V | 22.8 | Very low | 25.8 | Very low | 133 Ų | 133 | 127.6 Ų | 127.6 | 81% | 0.806 | 71% | 0.713 | S | S | * | * | trans | -62.4 | 113.1 | 165.7 | 179.5 | 0 | 0 | 0 | 0 | 107.2 | E65 I69 | E65-V67 PolarHBondContact O-N 3.41Å; V67-I69 PolarHBondContact O-N 3.39Å | ||
| 68 | S | 22.3 | Very low | 25.7 | Very low | 96 Ų | 96 | 129 Ų | 129 | 67% | 0.671 | 72% | 0.717 | S | S | * | * | trans | -59.5 | 128.9 | 171.7 | -169.7 | 0 | 0 | 0 | 0 | 108.5 | P66 D70 | P66-S68 PolarHBondContact O-N 2.87Å; P66-S68 VanDerWaalsContact O-N 3.11Å; S68-D70 PolarHBondContact O-N 2.91Å | ||
| 69 | I | 26.2 | Very low | 25.8 | Very low | 69 Ų | 69 | 128.1 Ų | 128.1 | 35% | 0.354 | 71% | 0.71 | S | S | . | * | trans | -68.2 | 100.1 | 175.9 | -59.9 | 170.5 | 0 | 0 | 0 | 106.9 | V67 Q71 | V67-I69 PolarHBondContact O-N 3.39Å; I69-Q71 PolarHBondContact O-N 3.45Å | ||
| 70 | D | 24 | Very low | 25.6 | Very low | 124 Ų | 124 | 119.6 Ų | 119.6 | 66% | 0.663 | 69% | 0.685 | S | S | * | * | trans | -66.7 | 100.8 | 167.3 | -85.2 | -29 | 0 | 0 | 0 | 108.3 | S68 V72 | S68-D70 PolarHBondContact O-N 2.91Å; D70-V72 PolarHBondContact O-N 2.89Å | ||
| 71 | Q | 26.8 | Very low | 25.9 | Very low | 147 Ų | 147 | 120.5 Ų | 120.5 | 69% | 0.687 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -54.2 | -2.7 | 176.4 | -74.4 | 179.3 | -24.5 | 0 | 0 | 114.8 | I69 | I69-Q71 PolarHBondContact O-N 3.45Š|
| 72 | V | 25.1 | Very low | 25.9 | Very low | 129 Ų | 129 | 121.1 Ų | 121.1 | 78% | 0.782 | 69% | 0.688 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.9 | -18.1 | -168.2 | -173.9 | 0 | 0 | 0 | 0 | 113 | D70 | D70-V72 PolarHBondContact O-N 2.89Š|
| 73 | T | 28.9 | Very low | 25.7 | Very low | 117 Ų | 117 | 122.4 Ų | 122.4 | 72% | 0.718 | 68% | 0.683 | S | S | * | * | S | Bend | trans | -94.6 | -2.4 | 175.9 | 25.7 | 0 | 0 | 0 | 0 | 114.3 | S75 | T73-S75 PolarHBondContact O-N 3.28Š|
| 74 | E | 27.8 | Very low | 25.8 | Very low | 73 Ų | 73 | 120.9 Ų | 120.9 | 34% | 0.341 | 67% | 0.669 | S | S | . | * | G | 310 helix | trans | -78.5 | -6.6 | -172 | -77.2 | -171.9 | 139.9 | 0 | 0 | 115.7 | M76 | E74-M76 VanDerWaalsContact C-N 3.25Å; E74-M76 PolarHBondContact O-N 3.27Å |
| 75 | S | 29.1 | Very low | 25.7 | Very low | 110 Ų | 110 | 119.2 Ų | 119.2 | 77% | 0.769 | 67% | 0.665 | S | S | * | * | G | 310 helix | trans | -74.3 | -7.4 | -175.7 | 63.1 | 0 | 0 | 0 | 0 | 115.2 | T73 | T73-S75 PolarHBondContact O-N 3.28Š|
| 76 | M | 28.7 | Very low | 25.8 | Very low | 180 Ų | 180 | 119.1 Ų | 119.1 | 89% | 0.887 | 67% | 0.668 | S | S | * | * | G | 310 helix | trans | -106.7 | -7.1 | 177.5 | -81 | -175 | 69.4 | 0 | 0 | 115.2 | E74 | E74-M76 VanDerWaalsContact C-N 3.25Å; E74-M76 PolarHBondContact O-N 3.27Å |
| 77 | E | 29.7 | Very low | 25.8 | Very low | 79 Ų | 79 | 119.2 Ų | 119.2 | 37% | 0.369 | 67% | 0.672 | S | S | . | * | trans | -107 | 16.6 | -175.5 | -72.6 | -158.5 | 178.7 | 0 | 0 | 114.9 | C79 R262 | E77-C79 PolarHBondContact O-N 3.27Å; E77-C79 VanDerWaalsContact O-N 3.07Å; E77-R262 IonicContact OE1-NH1 3.65Å; E77-R262 IonicContact OE1-NH2 3.36Å; E77-R262 IonicContact OE2-CZ 2.55Å; E77-R262 IonicContact OE2-NH1 2.67Å; E77-R262 PolarHBondContact OE2-NH1 3.37Å; E77-R262 IonicContact OE2-NH2 3.86Å; E77-R262 PolarHBondContact OE2-NH2 3.09Å | ||
| 78 | Q | 25.3 | Very low | 25.8 | Very low | 174 Ų | 174 | 121.8 Ų | 121.8 | 81% | 0.813 | 68% | 0.675 | S | S | * | * | trans | -79.1 | 91 | 172.1 | -70.9 | -171.7 | -5.8 | 0 | 0 | 111.3 | ||||
| 79 | C | 26.8 | Very low | 25.8 | Very low | 93 Ų | 93 | 126.7 Ų | 126.7 | 63% | 0.628 | 68% | 0.684 | S | S | * | * | trans | -95.6 | 101.9 | 148.4 | -83.3 | 0 | 0 | 0 | 0 | 107.9 | E77 R306 | E77-C79 PolarHBondContact O-N 3.27Å; E77-C79 VanDerWaalsContact O-N 3.07Å; C79-R306 PolarHBondContact O-NH1 3.14Å; C79-R306 VanDerWaalsContact O-NH1 3.11Å | ||
| 80 | S | 25.4 | Very low | 25.8 | Very low | 47 Ų | 47 | 129.2 Ų | 129.2 | 33% | 0.329 | 70% | 0.703 | S | S | . | * | trans | -77 | 133.5 | 162 | 50.6 | 0 | 0 | 0 | 0 | 108.1 | S82 E83 | S80-S82 PolarHBondContact O-N 3.42Å; S80-E83 PolarHBondContact OG-OE2 2.97Å | ||
| 81 | L | 28 | Very low | 25.7 | Very low | 178 Ų | 178 | 128.8 Ų | 128.8 | 93% | 0.932 | 71% | 0.705 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.5 | 1 | -178.2 | -97.3 | 148.7 | 0 | 0 | 0 | 113.8 | ||
| 82 | S | 25.6 | Very low | 25.6 | Very low | 107 Ų | 107 | 126.5 Ų | 126.5 | 75% | 0.748 | 70% | 0.701 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -117.1 | 8 | -172.6 | 53.2 | 0 | 0 | 0 | 0 | 115.3 | S80 | S80-S82 PolarHBondContact O-N 3.42Š|
| 83 | E | 24.1 | Very low | 25.6 | Very low | 146 Ų | 146 | 129.2 Ų | 129.2 | 68% | 0.682 | 70% | 0.702 | S | S | * | * | trans | -135.9 | 47.5 | -171.6 | -83.7 | 179.3 | 146.5 | 0 | 0 | 114.7 | S80 | S80-E83 PolarHBondContact OG-OE2 2.97Š| ||
| 84 | I | 26.7 | Very low | 25.5 | Very low | 104 Ų | 104 | 133.4 Ų | 133.4 | 53% | 0.533 | 70% | 0.704 | S | S | . | * | trans | -129.3 | 68.9 | 167.4 | -44.7 | 172.4 | 0 | 0 | 0 | 111.9 | ||||
| 85 | T | 21.7 | Very low | 25.5 | Very low | 130 Ų | 130 | 137.4 Ų | 137.4 | 80% | 0.798 | 72% | 0.723 | S | S | * | * | trans | -88.2 | 117.9 | 145.6 | 24.5 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 86 | L | 24.2 | Very low | 25.5 | Very low | 155 Ų | 155 | 136.2 Ų | 136.2 | 81% | 0.812 | 71% | 0.711 | S | S | * | * | S | Bend | trans | 47.4 | 138.1 | 159.3 | -79.9 | 115.2 | 0 | 0 | 0 | 121.6 | ||
| 87 | S | 22.4 | Very low | 25.4 | Very low | 113 Ų | 113 | 132.6 Ų | 132.6 | 79% | 0.79 | 69% | 0.692 | S | S | * | * | trans | 65.9 | 74 | 160.2 | 60.3 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 88 | Q | 23.3 | Very low | 25.4 | Very low | 187 Ų | 187 | 136.6 Ų | 136.6 | 87% | 0.874 | 72% | 0.716 | S | S | * | * | trans | -129.1 | 108 | 146.5 | -78.3 | -166.1 | -3.5 | 0 | 0 | 111.5 | V90 | Q88-V90 VanDerWaalsContact C-N 3.35Å; Q88-V90 PolarHBondContact O-N 3.12Å | ||
| 89 | K | 22.7 | Very low | 25.9 | Very low | 199 Ų | 199 | 131.4 Ų | 131.4 | 87% | 0.865 | 69% | 0.694 | S | S | * | * | trans | -61.2 | 93 | 165.7 | -154.7 | 177.8 | -166 | 173.5 | 0 | 107.4 | T91 | K89-T91 PolarHBondContact O-N 3.27Š| ||
| 90 | V | 25.2 | Very low | 26.2 | Very low | 121 Ų | 121 | 134 Ų | 134 | 73% | 0.733 | 69% | 0.691 | S | S | * | * | trans | -61.5 | 108.1 | 175 | 177.7 | 0 | 0 | 0 | 0 | 107.9 | Q88 V92 | Q88-V90 VanDerWaalsContact C-N 3.35Å; Q88-V90 PolarHBondContact O-N 3.12Å; V90-V92 HydrophobicContact CG1-CG2 4.19Å; V90-V92 PolarHBondContact O-N 3.49Å; V90-V92 VanDerWaalsContact O-N 3.17Å | ||
| 91 | T | 23.2 | Very low | 26.9 | Very low | 115 Ų | 115 | 136.1 Ų | 136.1 | 71% | 0.706 | 70% | 0.698 | S | S | * | * | trans | -79.9 | 96.3 | 170 | -43.6 | 0 | 0 | 0 | 0 | 105.7 | K89 K93 | K89-T91 PolarHBondContact O-N 3.27Å; T91-K93 PolarHBondContact O-N 3.35Å | ||
| 92 | V | 24.2 | Very low | 27.3 | Very low | 100 Ų | 100 | 131.3 Ų | 131.3 | 61% | 0.606 | 67% | 0.668 | S | S | * | * | trans | -63.4 | 87.5 | 173.2 | -177.1 | 0 | 0 | 0 | 0 | 107.9 | V90 R94 | V90-V92 HydrophobicContact CG1-CG2 4.19Å; V90-V92 PolarHBondContact O-N 3.49Å; V90-V92 VanDerWaalsContact O-N 3.17Å; V92-R94 PolarHBondContact O-N 3.32Å | ||
| 93 | K | 24.3 | Very low | 27.6 | Very low | 186 Ų | 186 | 133 Ų | 133 | 81% | 0.809 | 66% | 0.658 | S | S | * | * | trans | -79.2 | 101.7 | 169.7 | -89.6 | -174.9 | 175.2 | 177.5 | 0 | 107.9 | T91 | T91-K93 PolarHBondContact O-N 3.35Š| ||
| 94 | R | 27.3 | Very low | 28.5 | Very low | 204 Ų | 204 | 128.3 Ų | 128.3 | 77% | 0.77 | 64% | 0.642 | S | S | * | * | S | Bend | trans | 62.1 | 67.3 | 134.9 | -156.4 | -173.2 | -100.4 | -171.4 | -6.6 | 116.3 | V92 | V92-R94 PolarHBondContact O-N 3.32Š|
| 95 | E | 27.4 | Very low | 29 | Very low | 158 Ų | 158 | 124.5 Ų | 124.5 | 74% | 0.738 | 63% | 0.625 | S | S | * | * | S | Bend | trans | -150.5 | -7.2 | 153.9 | -114.3 | 168.3 | -151.4 | 0 | 0 | 115.6 | Q97 | E95-Q97 PolarHBondContact O-N 2.95Š|
| 96 | V | 28.7 | Very low | 29.6 | Very low | 84 Ų | 84 | 121.4 Ų | 121.4 | 51% | 0.509 | 60% | 0.604 | S | S | . | * | trans | -100.7 | 56.2 | 171.2 | -167.1 | 0 | 0 | 0 | 0 | 110.4 | Y102 | V96-Y102 HydrophobicContact CG1-CD1 4.08Å; V96-Y102 HydrophobicContact CG1-CE1 4.32Å; V96-Y102 HydrophobicContact CG1-CG 4.46Å | ||
| 97 | Q | 26.8 | Very low | 30.4 | Very low | 104 Ų | 104 | 117.1 Ų | 117.1 | 49% | 0.486 | 59% | 0.59 | S | S | . | * | trans | -90.6 | -5.4 | -169.5 | -149.1 | 152.5 | -4.4 | 0 | 0 | 115.2 | E95 R103 | E95-Q97 PolarHBondContact O-N 2.95Å; Q97-R103 PolarHBondContact O-NH2 3.39Å; Q97-R103 VanDerWaalsContact O-NH2 3.12Å | ||
| 98 | N | 30.2 | Very low | 31.2 | Very low | 164 Ų | 164 | 113.3 Ų | 113.3 | 88% | 0.877 | 57% | 0.566 | S | S | * | * | S | Bend | trans | -122.2 | 8.5 | -171 | -79.3 | -3.4 | 0 | 0 | 0 | 117.8 | ||
| 99 | D | 34.9 | Very low | 31.7 | Very low | 64 Ų | 64 | 109.3 Ų | 109.3 | 34% | 0.342 | 55% | 0.546 | S | S | . | . | trans | -99.2 | 101.5 | 169.8 | -151 | -21 | 0 | 0 | 0 | 109.8 | N101 Y102 R103 R198 | D99-N101 PolarHBondContact O-N 2.94Å; D99-Y102 WeakPolarHBondContact O-CB 3.35Å; D99-Y102 PolarHBondContact O-N 3.2Å; D99-R103 PolarHBondContact O-N 3.45Å; D99-R198 IonicContact OD2-NH1 3.64Å; D99-R198 PolarHBondContact OD2-NH1 3.26Å; D99-R198 VanDerWaalsContact OD2-NH1 3.11Å | ||
| 100 | W | 33.3 | Very low | 32.3 | Very low | 149 Ų | 149 | 108.5 Ų | 108.5 | 56% | 0.564 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -62.3 | -30.3 | -177 | -172 | 84.3 | 0 | 0 | 0 | 111.8 | Y102 R103 S104 N144 | W100-Y102 VanDerWaalsContact C-N 3.26Å; W100-Y102 PolarHBondContact O-N 3Å; W100-R103 PolarHBondContact O-N 3.26Å; W100-S104 PolarHBondContact O-N 3.17Å; W100-N144 HydrophobicContact CH2-CB 4.48Å |
| 101 | N | 40.1 | Very low | 32.8 | Very low | 91 Ų | 91 | 104.6 Ų | 104.6 | 49% | 0.487 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -66.6 | -26.4 | 174.8 | -72.2 | -9.9 | 0 | 0 | 0 | 112.6 | D99 S104 | D99-N101 PolarHBondContact O-N 2.94Å; N101-S104 PolarHBondContact O-OG 2.86Å |
| 102 | Y | 36.8 | Very low | 33.3 | Very low | 76 Ų | 76 | 102.1 Ų | 102.1 | 30% | 0.298 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -75.4 | -34.5 | 175.1 | -174.5 | -105 | 0 | 0 | 0 | 112.2 | V96 D99 W100 L106 I202 | V96-Y102 HydrophobicContact CG1-CD1 4.08Å; V96-Y102 HydrophobicContact CG1-CE1 4.32Å; V96-Y102 HydrophobicContact CG1-CG 4.46Å; D99-Y102 WeakPolarHBondContact O-CB 3.35Å; D99-Y102 PolarHBondContact O-N 3.2Å; W100-Y102 VanDerWaalsContact C-N 3.26Å; W100-Y102 PolarHBondContact O-N 3Å; Y102-L106 HydrophobicContact CE1-CD1 4.04Å; Y102-L106 HydrophobicContact CE2-CD1 4.28Å; Y102-L106 WeakPolarHBondContact O-CB 3.16Å; Y102-L106 PolarHBondContact O-N 3.43Å; Y102-L106 VanDerWaalsContact O-N 3.12Å; Y102-I202 HydrophobicContact CE2-CD1 4.46Å |
| 103 | R | 33 | Very low | 33.6 | Very low | 143 Ų | 143 | 99.4 Ų | 99.4 | 54% | 0.54 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -68.6 | -37.8 | 178.4 | -74.4 | -170.8 | -175.3 | 179.5 | 10.5 | 112.7 | Q97 D99 W100 A107 | Q97-R103 PolarHBondContact O-NH2 3.39Å; Q97-R103 VanDerWaalsContact O-NH2 3.12Å; D99-R103 PolarHBondContact O-N 3.45Å; W100-R103 PolarHBondContact O-N 3.26Å; R103-A107 VanDerWaalsContact O-CB 3.24Å; R103-A107 WeakPolarHBondContact O-CB 3.29Å; R103-A107 PolarHBondContact O-N 3.06Å |
| 104 | S | 41.7 | Very low | 34 | Very low | 48 Ų | 48 | 100 Ų | 100 | 34% | 0.336 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -69 | -42.9 | 179.9 | 67.5 | 0 | 0 | 0 | 0 | 111.6 | W100 N101 A107 A108 | W100-S104 PolarHBondContact O-N 3.17Å; N101-S104 PolarHBondContact O-OG 2.86Å; S104-A107 PolarHBondContact O-N 3.48Å; S104-A108 WeakPolarHBondContact O-CB 3.46Å; S104-A108 PolarHBondContact O-N 3.21Å |
| 105 | A | 38.5 | Very low | 34.2 | Very low | 23 Ų | 23 | 94.3 Ų | 94.3 | 19% | 0.19 | 49% | 0.494 | C | S | . | . | H | α-helix | trans | -64.9 | -42.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | A108 F109 L155 | A105-A108 PolarHBondContact O-N 3.02Å; A105-F109 PolarHBondContact O-N 3Å; A105-F109 VanDerWaalsContact O-N 3.1Å; A105-L155 HydrophobicContact CB-CD2 3.76Å |
| 106 | L | 34.6 | Very low | 34.4 | Very low | 66 Ų | 66 | 90.4 Ų | 90.4 | 35% | 0.346 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -72.1 | -31.8 | 179.8 | -148 | 105.2 | 0 | 0 | 0 | 113 | Y102 R110 | Y102-L106 HydrophobicContact CE1-CD1 4.04Å; Y102-L106 HydrophobicContact CE2-CD1 4.28Å; Y102-L106 WeakPolarHBondContact O-CB 3.16Å; Y102-L106 PolarHBondContact O-N 3.43Å; Y102-L106 VanDerWaalsContact O-N 3.12Å; L106-R110 PolarHBondContact O-N 2.88Å |
| 107 | A | 39.5 | Very low | 34.5 | Very low | 64 Ų | 64 | 94.5 Ų | 94.5 | 53% | 0.529 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -71.8 | -39.9 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | R103 S104 F109 R110 G111 | R103-A107 VanDerWaalsContact O-CB 3.24Å; R103-A107 WeakPolarHBondContact O-CB 3.29Å; R103-A107 PolarHBondContact O-N 3.06Å; S104-A107 PolarHBondContact O-N 3.48Å; A107-F109 VanDerWaalsContact C-N 3.33Å; A107-F109 PolarHBondContact O-N 2.95Å; A107-R110 PolarHBondContact O-N 3.47Å; A107-G111 PolarHBondContact O-N 2.71Å |
| 108 | A | 39.3 | Very low | 34.6 | Very low | 34 Ų | 34 | 93.6 Ų | 93.6 | 28% | 0.281 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -62.1 | -39.6 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112 | S104 A105 R110 G111 A112 V152 | S104-A108 WeakPolarHBondContact O-CB 3.46Å; S104-A108 PolarHBondContact O-N 3.21Å; A105-A108 PolarHBondContact O-N 3.02Å; A108-R110 PolarHBondContact O-N 3.11Å; A108-G111 PolarHBondContact O-N 3.48Å; A108-A112 PolarHBondContact O-N 3.04Å; A108-A112 VanDerWaalsContact O-N 3.08Å; A108-V152 HydrophobicContact CB-CG1 3.67Å |
| 109 | F | 34.5 | Very low | 34.6 | Very low | 102 Ų | 102 | 90.9 Ų | 90.9 | 45% | 0.447 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -64.3 | -39.7 | 177.6 | -156.9 | -92.1 | 0 | 0 | 0 | 113.1 | A105 A107 G111 G113 V159 | A105-F109 PolarHBondContact O-N 3Å; A105-F109 VanDerWaalsContact O-N 3.1Å; A107-F109 VanDerWaalsContact C-N 3.33Å; A107-F109 PolarHBondContact O-N 2.95Å; F109-G111 VanDerWaalsContact C-N 3.3Å; F109-G111 PolarHBondContact O-N 3.34Å; F109-G113 PolarHBondContact O-N 3.42Å; F109-V159 HydrophobicContact CD2-CB 4.36Å; F109-V159 HydrophobicContact CD2-CG1 3.89Å; F109-V159 HydrophobicContact CE2-CB 4.17Å; F109-V159 HydrophobicContact CE2-CG1 3.54Å; F109-V159 HydrophobicContact CZ-CG1 4.39Å |
| 110 | R | 35.1 | Very low | 34.3 | Very low | 182 Ų | 182 | 92.2 Ų | 92.2 | 69% | 0.687 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -70.6 | -25 | 174.4 | -72.4 | -172.9 | -153.6 | 178.8 | 6.8 | 113.5 | L106 A107 A108 | L106-R110 PolarHBondContact O-N 2.88Å; A107-R110 PolarHBondContact O-N 3.47Å; A108-R110 PolarHBondContact O-N 3.11Å |
| 111 | G | 35.3 | Very low | 34 | Very low | 40 Ų | 40 | 92.7 Ų | 92.7 | 41% | 0.412 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -71.4 | -48.6 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112 | A107 A108 F109 G113 R114 S115 | A107-G111 PolarHBondContact O-N 2.71Å; A108-G111 PolarHBondContact O-N 3.48Å; F109-G111 VanDerWaalsContact C-N 3.3Å; F109-G111 PolarHBondContact O-N 3.34Å; G111-G113 PolarHBondContact O-N 3.49Å; G111-R114 PolarHBondContact O-N 3.48Å; G111-S115 PolarHBondContact O-OG 2.84Å |
| 112 | A | 34.6 | Very low | 33.5 | Very low | 63 Ų | 63 | 92.7 Ų | 92.7 | 52% | 0.521 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -68.2 | -34.5 | -177.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | A108 R114 S115 A116 | A108-A112 PolarHBondContact O-N 3.04Å; A108-A112 VanDerWaalsContact O-N 3.08Å; A112-R114 VanDerWaalsContact C-N 3.26Å; A112-R114 PolarHBondContact O-N 3.42Å; A112-S115 PolarHBondContact O-N 3.2Å; A112-S115 VanDerWaalsContact O-N 3.11Å; A112-A116 PolarHBondContact O-N 3.4Å |
| 113 | G | 30.7 | Very low | 33 | Very low | 42 Ų | 42 | 93.8 Ų | 93.8 | 43% | 0.433 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -65 | -24.4 | 176.2 | 0 | 0 | 0 | 0 | 0 | 114.4 | F109 G111 | F109-G113 PolarHBondContact O-N 3.42Å; G111-G113 PolarHBondContact O-N 3.49Å |
| 114 | R | 31.8 | Very low | 32.7 | Very low | 200 Ų | 200 | 91.8 Ų | 91.8 | 76% | 0.755 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -82.5 | -18.9 | 173.8 | -75.8 | -178.3 | 172.4 | -176 | -3.4 | 113.3 | G111 A112 S118 | G111-R114 PolarHBondContact O-N 3.48Å; A112-R114 VanDerWaalsContact C-N 3.26Å; A112-R114 PolarHBondContact O-N 3.42Å; R114-S118 PolarHBondContact O-OG 3.12Å |
| 115 | S | 32.5 | Very low | 32.1 | Very low | 84 Ų | 84 | 95.5 Ų | 95.5 | 59% | 0.587 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -84.3 | -29 | 179.7 | -47.8 | 0 | 0 | 0 | 0 | 112.5 | G111 A112 | G111-S115 PolarHBondContact O-OG 2.84Å; A112-S115 PolarHBondContact O-N 3.2Å; A112-S115 VanDerWaalsContact O-N 3.11Å |
| 116 | A | 31 | Very low | 31.7 | Very low | 76 Ų | 76 | 100 Ų | 100 | 63% | 0.628 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -82.5 | -22.8 | 179.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | A112 | A112-A116 PolarHBondContact O-N 3.4Å |
| 117 | E | 30.5 | Very low | 31.4 | Very low | 169 Ų | 169 | 103.6 Ų | 103.6 | 79% | 0.79 | 64% | 0.643 | S | S | * | * | S | Bend | trans | -88.8 | -3.1 | 173.7 | -72.4 | -179.4 | 161.1 | 0 | 0 | 113.5 | ||
| 118 | S | 28.8 | Very low | 30.8 | Very low | 86 Ų | 86 | 104.8 Ų | 104.8 | 60% | 0.601 | 65% | 0.653 | S | S | * | * | S | Bend | trans | -105.1 | 3.3 | -177.5 | -58.6 | 0 | 0 | 0 | 0 | 114.8 | R114 | R114-S118 PolarHBondContact O-OG 3.12Š|
| 119 | S | 29.8 | Very low | 30.5 | Very low | 106 Ų | 106 | 109.2 Ų | 109.2 | 74% | 0.741 | 68% | 0.679 | S | S | * | * | S | Bend | trans | -102.6 | 8.6 | -178.6 | 67 | 0 | 0 | 0 | 0 | 115.2 | ||
| 120 | S | 28.5 | Very low | 30 | Very low | 93 Ų | 93 | 113 Ų | 113 | 65% | 0.65 | 70% | 0.698 | S | S | * | * | S | Bend | trans | -114.5 | 0.4 | 178.6 | 57.9 | 0 | 0 | 0 | 0 | 115.5 | ||
| 121 | N | 27.4 | Very low | 29.8 | Very low | 159 Ų | 159 | 111.8 Ų | 111.8 | 85% | 0.85 | 71% | 0.705 | S | S | * | * | S | Bend | trans | -159.6 | 83.6 | 171.9 | -90 | -34.8 | 0 | 0 | 0 | 111.7 | ||
| 122 | A | 29.1 | Very low | 29.3 | Very low | 91 Ų | 91 | 115.5 Ų | 115.5 | 75% | 0.752 | 72% | 0.72 | S | S | * | * | trans | -145.2 | 82.3 | 160.9 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 123 | A | 26.1 | Very low | 29.1 | Very low | 99 Ų | 99 | 118.5 Ų | 118.5 | 82% | 0.818 | 73% | 0.734 | S | S | * | * | trans | -54.6 | 144.4 | 158.8 | 0 | 0 | 0 | 0 | 0 | 109.4 | N125 | A123-N125 PolarHBondContact O-N 3.17Š| ||
| 124 | A | 26.5 | Very low | 29 | Very low | 101 Ų | 101 | 123.6 Ų | 123.6 | 84% | 0.835 | 75% | 0.751 | S | S | * | * | trans | -41.6 | 127.1 | -179.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 125 | N | 29.6 | Very low | 28.8 | Very low | 126 Ų | 126 | 119.3 Ų | 119.3 | 67% | 0.674 | 75% | 0.752 | S | S | * | * | trans | -133 | 104.3 | 156.1 | -168.8 | 4.9 | 0 | 0 | 0 | 108.9 | A123 N127 | A123-N125 PolarHBondContact O-N 3.17Å; N125-N127 PolarHBondContact O-N 2.92Å | ||
| 126 | P | 31.1 | Very low | 28.5 | Very low | 118 Ų | 118 | 119.4 Ų | 119.4 | 77% | 0.766 | 76% | 0.758 | S | S | * | * | trans | -81.9 | 13.4 | -176.9 | 31.8 | -32.4 | 0 | 0 | 0 | 114.2 | ||||
| 127 | N | 27.1 | Very low | 28.2 | Very low | 140 Ų | 140 | 122.8 Ų | 122.8 | 75% | 0.749 | 77% | 0.766 | S | S | * | * | trans | -134 | 86.5 | 179.9 | -74.3 | -38.6 | 0 | 0 | 0 | 111.5 | N125 | N125-N127 PolarHBondContact O-N 2.92Š| ||
| 128 | A | 28.2 | Very low | 28.1 | Very low | 89 Ų | 89 | 122.7 Ų | 122.7 | 74% | 0.736 | 77% | 0.771 | S | S | * | * | trans | -147.8 | 129.6 | 157 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 129 | P | 31.3 | Very low | 27.9 | Very low | 127 Ų | 127 | 128.3 Ų | 128.3 | 83% | 0.825 | 79% | 0.788 | S | S | * | * | trans | -80.4 | 144.8 | -163.5 | 32.3 | -35.1 | 0 | 0 | 0 | 113.5 | N131 | P129-N131 PolarHBondContact O-N 2.94Š| ||
| 130 | E | 25.2 | Very low | 27.6 | Very low | 181 Ų | 181 | 126.4 Ų | 126.4 | 85% | 0.846 | 78% | 0.784 | S | S | * | * | trans | -60.7 | 120.4 | 174.9 | -152 | 171.3 | -159 | 0 | 0 | 110.8 | ||||
| 131 | N | 30.2 | Very low | 27.4 | Very low | 158 Ų | 158 | 129.5 Ų | 129.5 | 85% | 0.845 | 79% | 0.794 | S | S | * | * | trans | -124 | 92 | 168.7 | -103.4 | -12.8 | 0 | 0 | 0 | 109.2 | P129 | P129-N131 PolarHBondContact O-N 2.94Š| ||
| 132 | T | 26.1 | Very low | 27.3 | Very low | 117 Ų | 117 | 127.1 Ų | 127.1 | 72% | 0.718 | 79% | 0.785 | S | S | * | * | trans | -69.6 | 140 | 155.2 | 31.6 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 133 | P | 30.5 | Very low | 27.2 | Very low | 126 Ų | 126 | 130.8 Ų | 130.8 | 82% | 0.818 | 79% | 0.792 | S | S | * | * | trans | -112.7 | 112.6 | 148.7 | 24.3 | -8.3 | 0 | 0 | 0 | 110 | ||||
| 134 | N | 26.9 | Very low | 27.2 | Very low | 149 Ų | 149 | 130.3 Ų | 130.3 | 80% | 0.797 | 78% | 0.775 | S | S | * | * | trans | -78.3 | 130.2 | 165.6 | -106.7 | -17.7 | 0 | 0 | 0 | 110.1 | ||||
| 135 | S | 27.4 | Very low | 27.2 | Very low | 111 Ų | 111 | 131.8 Ų | 131.8 | 78% | 0.776 | 77% | 0.774 | S | S | * | * | trans | 43.1 | 126.1 | 140.1 | -55.6 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 136 | A | 26.5 | Very low | 27.2 | Very low | 86 Ų | 86 | 134 Ų | 134 | 71% | 0.711 | 78% | 0.78 | S | S | * | * | -172.3 | 132.6 | 120.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | |||||
| 137 | D | 24.8 | Very low | 27.3 | Very low | 146 Ų | 146 | 131.8 Ų | 131.8 | 78% | 0.781 | 76% | 0.761 | S | S | * | * | trans | 60.9 | 102.7 | 144.8 | -55.1 | -25.2 | 0 | 0 | 0 | 120.7 | ||||
| 138 | N | 28.9 | Very low | 27.6 | Very low | 167 Ų | 167 | 129 Ų | 129 | 89% | 0.893 | 75% | 0.75 | S | S | * | * | -153.9 | 107 | 126.8 | -99 | -32.2 | 0 | 0 | 0 | 111 | G140 | N138-G140 PolarHBondContact O-N 3.46Š| |||
| 139 | Q | 24.3 | Very low | 27.9 | Very low | 205 Ų | 205 | 129 Ų | 129 | 96% | 0.958 | 75% | 0.75 | S | S | * | * | trans | -59.3 | 118.5 | 156.6 | -78 | 177.1 | -18.2 | 0 | 0 | 108.4 | ||||
| 140 | G | 23.6 | Very low | 28.2 | Very low | 65 Ų | 65 | 125.4 Ų | 125.4 | 67% | 0.67 | 74% | 0.736 | S | S | * | * | trans | -168.3 | 82.1 | -178.2 | 0 | 0 | 0 | 0 | 0 | 111 | N138 T142 | N138-G140 PolarHBondContact O-N 3.46Å; G140-T142 PolarHBondContact O-N 2.98Å | ||
| 141 | N | 25 | Very low | 28.9 | Very low | 159 Ų | 159 | 119.5 Ų | 119.5 | 85% | 0.85 | 71% | 0.708 | S | S | * | * | trans | -15.5 | 116.6 | 160.6 | -164.5 | 18.1 | 0 | 0 | 0 | 115.2 | ||||
| 142 | T | 25.8 | Very low | 29.7 | Very low | 108 Ų | 108 | 114.6 Ų | 114.6 | 66% | 0.663 | 68% | 0.684 | S | S | * | * | trans | -171.1 | 134.1 | 147.8 | 17.9 | 0 | 0 | 0 | 0 | 109.2 | G140 N144 | G140-T142 PolarHBondContact O-N 2.98Å; T142-N144 VanDerWaalsContact C-N 3.26Å; T142-N144 PolarHBondContact O-N 3Å | ||
| 143 | N | 25.8 | Very low | 31 | Very low | 168 Ų | 168 | 115.2 Ų | 115.2 | 90% | 0.898 | 68% | 0.683 | S | S | * | * | trans | -60.5 | 83.9 | 171.7 | -70.3 | -34.5 | 0 | 0 | 0 | 110.2 | V145 | N143-V145 PolarHBondContact O-N 2.94Š| ||
| 144 | N | 25.6 | Very low | 32.4 | Very low | 89 Ų | 89 | 112 Ų | 112 | 48% | 0.476 | 66% | 0.661 | S | S | . | * | trans | -88 | 104.6 | 170.1 | -82 | -15.4 | 0 | 0 | 0 | 108.2 | W100 T142 Q146 | W100-N144 HydrophobicContact CH2-CB 4.48Å; T142-N144 VanDerWaalsContact C-N 3.26Å; T142-N144 PolarHBondContact O-N 3Å; N144-Q146 PolarHBondContact O-N 3.28Å | ||
| 145 | V | 27.6 | Very low | 34.2 | Very low | 132 Ų | 132 | 105.7 Ų | 105.7 | 80% | 0.8 | 63% | 0.627 | S | S | * | * | trans | -62.2 | 97.1 | 157.1 | 178.2 | 0 | 0 | 0 | 0 | 105.9 | N143 M147 | N143-V145 PolarHBondContact O-N 2.94Å; V145-M147 PolarHBondContact O-N 3.05Å | ||
| 146 | Q | 28.4 | Very low | 36.1 | Very low | 174 Ų | 174 | 101.9 Ų | 101.9 | 81% | 0.813 | 61% | 0.606 | S | S | * | * | trans | -69 | 103.2 | 176.8 | -162.9 | 158.9 | -9.4 | 0 | 0 | 106.7 | N144 | N144-Q146 PolarHBondContact O-N 3.28Š| ||
| 147 | M | 35 | Very low | 38 | Very low | 71 Ų | 71 | 100.2 Ų | 100.2 | 35% | 0.35 | 59% | 0.588 | S | S | . | * | trans | -51.3 | 126.4 | 171.5 | -85.4 | -161.6 | -49.4 | 0 | 0 | 107.9 | V145 A149 E151 V152 | V145-M147 PolarHBondContact O-N 3.05Å; M147-A149 PolarHBondContact O-N 3.38Å; M147-E151 HydrophobicContact CB-CB 4.34Å; M147-E151 HydrophobicContact SD-CB 4.29Å; M147-V152 HydrophobicContact CE-CG2 4.09Å | ||
| 148 | P | 31.6 | Very low | 40.2 | Very low | 82 Ų | 82 | 93.2 Ų | 93.2 | 53% | 0.532 | 55% | 0.551 | S | S | . | * | trans | -51 | 140.2 | 176 | -23.5 | 31.3 | 0 | 0 | 0 | 110 | G150 E151 | P148-G150 PolarHBondContact O-N 3.18Å; P148-E151 HydrophobicContact CB-CG 4.4Å; P148-E151 WeakPolarHBondContact CD-OE2 2.95Å; P148-E151 HydrophobicContact CG-CG 4.32Å; P148-E151 WeakPolarHBondContact O-CB 3.29Å; P148-E151 PolarHBondContact O-N 2.83Å | ||
| 149 | A | 36.1 | Very low | 42.3 | Very low | 89 Ų | 89 | 86.3 Ų | 86.3 | 74% | 0.736 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -54.7 | -21.2 | -177.4 | 0 | 0 | 0 | 0 | 0 | 114.1 | M147 | M147-A149 PolarHBondContact O-N 3.38Å |
| 150 | G | 36 | Very low | 44.7 | Very low | 50 Ų | 50 | 78.9 Ų | 78.9 | 52% | 0.515 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -70 | -28.2 | 171 | 0 | 0 | 0 | 0 | 0 | 114.6 | P148 T154 | P148-G150 PolarHBondContact O-N 3.18Å; G150-T154 PolarHBondContact O-N 3.37Å; G150-T154 PolarHBondContact O-OG1 3.02Å |
| 151 | E | 41.2 | Very low | 47.1 | Very low | 57 Ų | 57 | 77 Ų | 77 | 27% | 0.266 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -74.2 | -32.4 | -177.6 | -68.8 | -156 | 128.9 | 0 | 0 | 113.1 | M147 P148 N153 T154 L155 R192 | M147-E151 HydrophobicContact CB-CB 4.34Å; M147-E151 HydrophobicContact SD-CB 4.29Å; P148-E151 HydrophobicContact CB-CG 4.4Å; P148-E151 WeakPolarHBondContact CD-OE2 2.95Å; P148-E151 HydrophobicContact CG-CG 4.32Å; P148-E151 WeakPolarHBondContact O-CB 3.29Å; P148-E151 PolarHBondContact O-N 2.83Å; E151-N153 VanDerWaalsContact C-N 3.32Å; E151-N153 PolarHBondContact O-N 2.95Å; E151-T154 VanDerWaalsContact C-OG1 3.28Å; E151-T154 WeakPolarHBondContact CA-OG1 3.29Å; E151-T154 PolarHBondContact O-N 3.25Å; E151-T154 PolarHBondContact O-OG1 3.32Å; E151-L155 PolarHBondContact O-N 2.82Å; E151-R192 IonicContact OE1-CZ 2.68Å; E151-R192 IonicContact OE1-NE 3.86Å; E151-R192 IonicContact OE1-NH2 3.75Å; E151-R192 PolarHBondContact OE1-NH2 2.78Å |
| 152 | V | 45.9 | Very low | 49.6 | Very low | 55 Ų | 55 | 69.5 Ų | 69.5 | 33% | 0.333 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -64.4 | -38.6 | 177.1 | -177.9 | 0 | 0 | 0 | 0 | 111 | A108 M147 L155 G156 | A108-V152 HydrophobicContact CB-CG1 3.67Å; M147-V152 HydrophobicContact CE-CG2 4.09Å; V152-L155 PolarHBondContact O-N 3.39Å; V152-G156 PolarHBondContact O-N 3.04Å |
| 153 | N | 54 | Low | 52 | Low | 131 Ų | 131 | 68.1 Ų | 68.1 | 70% | 0.701 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -68.8 | -37.9 | 175.3 | -83.1 | -11.1 | 0 | 0 | 0 | 112.1 | E151 G156 S157 | E151-N153 VanDerWaalsContact C-N 3.32Å; E151-N153 PolarHBondContact O-N 2.95Å; N153-G156 PolarHBondContact O-N 3.17Å; N153-S157 PolarHBondContact O-N 3.2Å |
| 154 | T | 60.5 | Low | 54.2 | Low | 58 Ų | 58 | 61.5 Ų | 61.5 | 36% | 0.356 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -66.9 | -39.5 | 174.6 | 36.7 | 0 | 0 | 0 | 0 | 112.7 | G150 E151 S157 V158 | G150-T154 PolarHBondContact O-N 3.37Å; G150-T154 PolarHBondContact O-OG1 3.02Å; E151-T154 VanDerWaalsContact C-OG1 3.28Å; E151-T154 WeakPolarHBondContact CA-OG1 3.29Å; E151-T154 PolarHBondContact O-N 3.25Å; E151-T154 PolarHBondContact O-OG1 3.32Å; T154-S157 WeakPolarHBondContact O-CB 3.48Å; T154-S157 PolarHBondContact O-N 3.26Å; T154-V158 WeakPolarHBondContact O-CG2 3.26Å; T154-V158 PolarHBondContact O-N 3.43Å |
| 155 | L | 64.8 | Low | 56.5 | Low | 16 Ų | 16 | 57.2 Ų | 57.2 | 8% | 0.084 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -67.6 | -40.2 | 177.2 | -167.7 | 72.7 | 0 | 0 | 0 | 111.4 | A105 E151 V152 S157 V158 V159 Y182 I195 | A105-L155 HydrophobicContact CB-CD2 3.76Å; E151-L155 PolarHBondContact O-N 2.82Å; V152-L155 PolarHBondContact O-N 3.39Å; L155-S157 VanDerWaalsContact C-N 3.28Å; L155-S157 PolarHBondContact O-N 3.41Å; L155-V158 WeakPolarHBondContact O-CB 3.49Å; L155-V158 PolarHBondContact O-N 3.42Å; L155-V159 WeakPolarHBondContact O-CG2 3.46Å; L155-V159 PolarHBondContact O-N 3.01Å; L155-Y182 HydrophobicContact CD1-CE2 4.4Å; L155-I195 HydrophobicContact CD1-CG2 3.54Å |
| 156 | G | 66.2 | Low | 58.6 | Low | 32 Ų | 32 | 51.4 Ų | 51.4 | 33% | 0.33 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -57.5 | -40.9 | 172.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | V152 N153 V159 A160 | V152-G156 PolarHBondContact O-N 3.04Å; N153-G156 PolarHBondContact O-N 3.17Å; G156-V159 PolarHBondContact O-N 3.25Å; G156-A160 WeakPolarHBondContact O-CB 3.44Å; G156-A160 PolarHBondContact O-N 2.97Å |
| 157 | S | 67.1 | Low | 60.9 | Low | 50 Ų | 50 | 49.5 Ų | 49.5 | 35% | 0.35 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -64.6 | -40.8 | 174.7 | -174.9 | 0 | 0 | 0 | 0 | 112.7 | N153 T154 L155 A160 N161 | N153-S157 PolarHBondContact O-N 3.2Å; T154-S157 WeakPolarHBondContact O-CB 3.48Å; T154-S157 PolarHBondContact O-N 3.26Å; L155-S157 VanDerWaalsContact C-N 3.28Å; L155-S157 PolarHBondContact O-N 3.41Å; S157-A160 PolarHBondContact O-N 3.4Å; S157-N161 WeakPolarHBondContact O-CB 3.35Å; S157-N161 PolarHBondContact O-N 3.42Å; S157-N161 PolarHBondContact O-ND2 3.17Å; S157-N161 PolarHBondContact OG-ND2 3.04Å |
| 158 | V | 71.1 | Confident | 62.9 | Low | 0 Ų | 0 | 49.7 Ų | 49.7 | 0% | 0 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -59.1 | -51.2 | 175.5 | 169.3 | 0 | 0 | 0 | 0 | 110.6 | T154 L155 A160 N161 L162 V178 L179 Y182 | T154-V158 WeakPolarHBondContact O-CG2 3.26Å; T154-V158 PolarHBondContact O-N 3.43Å; L155-V158 WeakPolarHBondContact O-CB 3.49Å; L155-V158 PolarHBondContact O-N 3.42Å; V158-A160 PolarHBondContact O-N 2.94Å; V158-N161 PolarHBondContact O-N 3.35Å; V158-L162 HydrophobicContact CG1-CD1 4.02Å; V158-L162 HydrophobicContact CG1-CG 4.49Å; V158-L162 WeakPolarHBondContact O-CG 3.46Å; V158-L162 PolarHBondContact O-N 2.81Å; V158-V178 HydrophobicContact CG2-CG1 4.4Å; V158-L179 HydrophobicContact CG1-CD1 4.2Å; V158-L179 HydrophobicContact CG1-CD2 4.5Å; V158-L179 HydrophobicContact CG1-CG 4.07Å; V158-Y182 HydrophobicContact CG2-CD1 4.01Å; V158-Y182 HydrophobicContact CG2-CD2 4Å; V158-Y182 HydrophobicContact CG2-CG 3.61Å |
| 159 | V | 73.2 | Confident | 65.1 | Low | 21 Ų | 21 | 48.4 Ų | 48.4 | 13% | 0.127 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -64.5 | -41.4 | -178.5 | -179.4 | 0 | 0 | 0 | 0 | 111.5 | F109 L155 G156 N161 L162 H163 F203 | F109-V159 HydrophobicContact CD2-CB 4.36Å; F109-V159 HydrophobicContact CD2-CG1 3.89Å; F109-V159 HydrophobicContact CE2-CB 4.17Å; F109-V159 HydrophobicContact CE2-CG1 3.54Å; F109-V159 HydrophobicContact CZ-CG1 4.39Å; L155-V159 WeakPolarHBondContact O-CG2 3.46Å; L155-V159 PolarHBondContact O-N 3.01Å; G156-V159 PolarHBondContact O-N 3.25Å; V159-N161 PolarHBondContact O-N 3.4Å; V159-L162 PolarHBondContact O-N 3.11Å; V159-H163 PolarHBondContact O-N 3.02Å; V159-F203 HydrophobicContact CG1-CE2 4.22Å; V159-F203 HydrophobicContact CG1-CZ 4.25Å |
| 160 | A | 73.6 | Confident | 67.1 | Low | 49 Ų | 49 | 50.7 Ų | 50.7 | 41% | 0.405 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -62.7 | -41.8 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | G156 S157 V158 H163 A164 | G156-A160 WeakPolarHBondContact O-CB 3.44Å; G156-A160 PolarHBondContact O-N 2.97Å; S157-A160 PolarHBondContact O-N 3.4Å; V158-A160 PolarHBondContact O-N 2.94Å; A160-H163 WeakPolarHBondContact O-CB 3.5Å; A160-H163 PolarHBondContact O-N 3Å; A160-A164 PolarHBondContact O-N 2.89Å |
| 161 | N | 74.5 | Confident | 69.3 | Low | 27 Ų | 27 | 51.4 Ų | 51.4 | 14% | 0.144 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -73.4 | -32.1 | 178.7 | -78.9 | -82.8 | 0 | 0 | 0 | 112.7 | S157 V158 V159 H163 A164 A165 A175 V178 | S157-N161 WeakPolarHBondContact O-CB 3.35Å; S157-N161 PolarHBondContact O-N 3.42Å; S157-N161 PolarHBondContact O-ND2 3.17Å; S157-N161 PolarHBondContact OG-ND2 3.04Å; V158-N161 PolarHBondContact O-N 3.35Å; V159-N161 PolarHBondContact O-N 3.4Å; N161-H163 VanDerWaalsContact C-N 3.33Å; N161-A164 PolarHBondContact O-N 2.81Å; N161-A165 WeakPolarHBondContact O-CB 3.43Å; N161-A165 PolarHBondContact O-N 3.42Å; N161-A175 HydrophobicContact CB-CB 4.21Å; N161-V178 HydrophobicContact CB-CB 4.46Å; N161-V178 HydrophobicContact CB-CG1 4.5Å |
| 162 | L | 76.9 | Confident | 71.4 | Confident | 0 Ų | 0 | 49.8 Ų | 49.8 | 0% | 0 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -63 | -41.7 | 170 | -72.8 | 175 | 0 | 0 | 0 | 111.6 | V158 V159 A165 A166 L179 H199 L200 F203 M213 L216 | V158-L162 HydrophobicContact CG1-CD1 4.02Å; V158-L162 HydrophobicContact CG1-CG 4.49Å; V158-L162 WeakPolarHBondContact O-CG 3.46Å; V158-L162 PolarHBondContact O-N 2.81Å; V159-L162 PolarHBondContact O-N 3.11Å; L162-A165 PolarHBondContact O-N 3.38Å; L162-A166 WeakPolarHBondContact O-CB 3.38Å; L162-A166 PolarHBondContact O-N 2.97Å; L162-L179 HydrophobicContact CD2-CD1 3.84Å; L162-L179 HydrophobicContact CD2-CD2 4.01Å; L162-L179 HydrophobicContact CG-CD1 4.03Å; L162-H199 HydrophobicContact CD1-CB 3.54Å; L162-L200 HydrophobicContact CD2-CD2 3.72Å; L162-L200 HydrophobicContact CD2-CG 4.49Å; L162-F203 HydrophobicContact CB-CD2 3.83Å; L162-F203 HydrophobicContact CB-CE2 3.65Å; L162-F203 HydrophobicContact CB-CG 4.37Å; L162-F203 HydrophobicContact CB-CZ 4.05Å; L162-F203 HydrophobicContact CD1-CD2 4.12Å; L162-F203 HydrophobicContact CD1-CE2 4.2Å; L162-M213 HydrophobicContact CD2-SD 4.28Å; L162-L216 HydrophobicContact CD2-CD2 3.39Å |
| 163 | H | 76.2 | Confident | 73.3 | Confident | 80 Ų | 80 | 51.9 Ų | 51.9 | 37% | 0.37 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -62.9 | -45.9 | 174.5 | -161.7 | -76.4 | 0 | 0 | 0 | 111.7 | V159 A160 N161 A165 A166 E167 F203 | V159-H163 PolarHBondContact O-N 3.02Å; A160-H163 WeakPolarHBondContact O-CB 3.5Å; A160-H163 PolarHBondContact O-N 3Å; N161-H163 VanDerWaalsContact C-N 3.33Å; H163-A165 VanDerWaalsContact C-N 3.31Å; H163-A165 PolarHBondContact O-N 3.26Å; H163-A166 WeakPolarHBondContact O-CB 3.42Å; H163-A166 PolarHBondContact O-N 3.41Å; H163-A166 VanDerWaalsContact O-N 3.14Å; H163-E167 IonicContact CE1-OE1 3.71Å; H163-E167 PolarHBondContact CE1-OE1 3.42Å; H163-E167 IonicContact CE1-OE2 3.11Å; H163-E167 PolarHBondContact CE1-OE2 3.37Å; H163-E167 VanDerWaalsContact ND1-CD 3.31Å; H163-E167 IonicContact ND1-OE1 2.83Å; H163-E167 IonicContact ND1-OE2 3.68Å; H163-E167 PolarHBondContact ND1-OE2 3.25Å; H163-E167 VanDerWaalsContact ND1-OE2 3.17Å; H163-E167 PolarHBondContact O-N 3.42Å; H163-F203 HydrophobicContact CB-CE1 3.88Å; H163-F203 HydrophobicContact CB-CZ 3.96Å; H163-F203 AromaticContact CD2-CE1 3.85Å |
| 164 | A | 73.4 | Confident | 74.8 | Confident | 28 Ų | 28 | 48.5 Ų | 48.5 | 23% | 0.231 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -60.3 | -40.4 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112 | A160 N161 E167 N168 M171 | A160-A164 PolarHBondContact O-N 2.89Å; N161-A164 PolarHBondContact O-N 2.81Å; A164-E167 PolarHBondContact O-N 3.33Å; A164-N168 PolarHBondContact O-N 3.21Å; A164-M171 HydrophobicContact CB-CB 4.38Å; A164-M171 HydrophobicContact CB-CE 4.31Å; A164-M171 HydrophobicContact CB-CG 4.43Å |
| 165 | A | 72.9 | Confident | 76 | Confident | 0 Ų | 0 | 45.7 Ų | 45.7 | 0% | 0 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -67.7 | -38.1 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | N161 L162 H163 E167 N168 I172 A175 T212 | N161-A165 WeakPolarHBondContact O-CB 3.43Å; N161-A165 PolarHBondContact O-N 3.42Å; L162-A165 PolarHBondContact O-N 3.38Å; H163-A165 VanDerWaalsContact C-N 3.31Å; H163-A165 PolarHBondContact O-N 3.26Å; A165-E167 VanDerWaalsContact C-N 3.35Å; A165-N168 WeakPolarHBondContact CA-O 3.42Å; A165-N168 CarbonylContact O-C 3.58Å; A165-N168 VanDerWaalsContact O-C 3.31Å; A165-I172 HydrophobicContact CB-CG1 4.39Å; A165-A175 HydrophobicContact CB-CB 3.79Å; A165-T212 WeakPolarHBondContact O-CG2 3.46Å |
| 166 | A | 73 | Confident | 77.1 | Confident | 9 Ų | 9 | 45 Ų | 45 | 7% | 0.074 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -61.4 | -43.7 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | L162 H163 F203 Y209 M213 | L162-A166 WeakPolarHBondContact O-CB 3.38Å; L162-A166 PolarHBondContact O-N 2.97Å; H163-A166 WeakPolarHBondContact O-CB 3.42Å; H163-A166 PolarHBondContact O-N 3.41Å; H163-A166 VanDerWaalsContact O-N 3.14Å; A166-F203 HydrophobicContact CB-CD1 4.01Å; A166-F203 HydrophobicContact CB-CE1 4.47Å; A166-Y209 HydrophobicContact CB-CD1 3.89Å; A166-Y209 HydrophobicContact CB-CD2 4.08Å; A166-Y209 HydrophobicContact CB-CE1 4.23Å; A166-Y209 HydrophobicContact CB-CE2 4.43Å; A166-Y209 HydrophobicContact CB-CG 3.82Å; A166-Y209 WeakPolarHBondContact O-CD1 3.49Å; A166-Y209 WeakPolarHBondContact O-CE1 3.42Å; A166-M213 HydrophobicContact CB-CE 3.93Å |
| 167 | E | 76.4 | Confident | 78 | Confident | 134 Ų | 134 | 49.8 Ų | 49.8 | 63% | 0.626 | 28% | 0.275 | S | S | * | . | H | α-helix | trans | -78.7 | -31.4 | -179.9 | -68 | -175.8 | 140.6 | 0 | 0 | 113.7 | H163 A164 A165 | H163-E167 IonicContact CE1-OE1 3.71Å; H163-E167 PolarHBondContact CE1-OE1 3.42Å; H163-E167 IonicContact CE1-OE2 3.11Å; H163-E167 PolarHBondContact CE1-OE2 3.37Å; H163-E167 VanDerWaalsContact ND1-CD 3.31Å; H163-E167 IonicContact ND1-OE1 2.83Å; H163-E167 IonicContact ND1-OE2 3.68Å; H163-E167 PolarHBondContact ND1-OE2 3.25Å; H163-E167 VanDerWaalsContact ND1-OE2 3.17Å; H163-E167 PolarHBondContact O-N 3.42Å; A164-E167 PolarHBondContact O-N 3.33Å; A165-E167 VanDerWaalsContact C-N 3.35Å |
| 168 | N | 77.3 | Confident | 78.9 | Confident | 75 Ų | 75 | 49.3 Ų | 49.3 | 40% | 0.401 | 27% | 0.27 | S | S | . | . | trans | -137.1 | 109.4 | 179 | -174.8 | -3.3 | 0 | 0 | 0 | 110.9 | A164 A165 D170 M171 | A164-N168 PolarHBondContact O-N 3.21Å; A165-N168 WeakPolarHBondContact CA-O 3.42Å; A165-N168 CarbonylContact O-C 3.58Å; A165-N168 VanDerWaalsContact O-C 3.31Å; N168-D170 PolarHBondContact O-N 3.03Å; N168-D170 VanDerWaalsContact O-N 3.09Å; N168-D170 WeakPolarHBondContact OD1-CB 3.34Å; N168-D170 PolarHBondContact OD1-N 3.45Å; N168-M171 HydrophobicContact CB-CG 4.13Å; N168-M171 WeakPolarHBondContact O-CB 3.45Å; N168-M171 PolarHBondContact O-N 3.45Å | ||
| 169 | A | 76.3 | Confident | 79.7 | Confident | 56 Ų | 56 | 49.3 Ų | 49.3 | 46% | 0.463 | 27% | 0.27 | S | S | . | . | G | 310 helix | trans | -58.5 | -24.8 | 180 | 0 | 0 | 0 | 0 | 0 | 113.5 | M171 I172 | A169-M171 PolarHBondContact O-N 2.98Å; A169-I172 VanDerWaalsContact O-CB 3.29Å; A169-I172 WeakPolarHBondContact O-CB 3.44Å; A169-I172 VanDerWaalsContact O-CG1 3.3Å; A169-I172 WeakPolarHBondContact O-CG1 3.32Å; A169-I172 PolarHBondContact O-N 3.44Å; A169-I172 VanDerWaalsContact O-N 3.12Å |
| 170 | D | 79.3 | Confident | 80.3 | Confident | 137 Ų | 137 | 49.9 Ų | 49.9 | 73% | 0.733 | 27% | 0.271 | S | S | * | . | G | 310 helix | trans | -64.9 | -23 | 176.3 | -64 | -25.9 | 0 | 0 | 0 | 112.2 | N168 I172 | N168-D170 PolarHBondContact O-N 3.03Å; N168-D170 VanDerWaalsContact O-N 3.09Å; N168-D170 WeakPolarHBondContact OD1-CB 3.34Å; N168-D170 PolarHBondContact OD1-N 3.45Å; D170-I172 VanDerWaalsContact C-N 3.25Å; D170-I172 PolarHBondContact O-N 2.78Å |
| 171 | M | 82.2 | Confident | 80.8 | Confident | 65 Ų | 65 | 49.8 Ų | 49.8 | 32% | 0.32 | 27% | 0.274 | S | S | . | . | G | 310 helix | trans | -79.9 | -2.4 | 177.7 | -63.3 | -65.5 | -74.5 | 0 | 0 | 113.3 | A164 N168 A169 Q173 T174 A175 | A164-M171 HydrophobicContact CB-CB 4.38Å; A164-M171 HydrophobicContact CB-CE 4.31Å; A164-M171 HydrophobicContact CB-CG 4.43Å; N168-M171 HydrophobicContact CB-CG 4.13Å; N168-M171 WeakPolarHBondContact O-CB 3.45Å; N168-M171 PolarHBondContact O-N 3.45Å; A169-M171 PolarHBondContact O-N 2.98Å; M171-Q173 VanDerWaalsContact C-N 3.26Å; M171-Q173 PolarHBondContact O-N 3Å; M171-T174 HydrophobicContact CE-CG2 4.24Å; M171-T174 PolarHBondContact O-N 3.23Å; M171-T174 VanDerWaalsContact O-N 3.11Å; M171-A175 PolarHBondContact O-N 3.02Å |
| 172 | I | 85.5 | Confident | 81.4 | Confident | 23 Ų | 23 | 49.3 Ų | 49.3 | 12% | 0.118 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -53.5 | -42.2 | 178.3 | -82.8 | 175.3 | 0 | 0 | 0 | 111.8 | A165 A169 D170 A175 A176 T212 N215 L219 | A165-I172 HydrophobicContact CB-CG1 4.39Å; A169-I172 VanDerWaalsContact O-CB 3.29Å; A169-I172 WeakPolarHBondContact O-CB 3.44Å; A169-I172 VanDerWaalsContact O-CG1 3.3Å; A169-I172 WeakPolarHBondContact O-CG1 3.32Å; A169-I172 PolarHBondContact O-N 3.44Å; A169-I172 VanDerWaalsContact O-N 3.12Å; D170-I172 VanDerWaalsContact C-N 3.25Å; D170-I172 PolarHBondContact O-N 2.78Å; I172-A175 PolarHBondContact O-N 2.79Å; I172-A176 WeakPolarHBondContact O-CB 3.32Å; I172-A176 PolarHBondContact O-N 2.74Å; I172-T212 HydrophobicContact CD1-CG2 3.69Å; I172-T212 HydrophobicContact CG1-CG2 3.83Å; I172-N215 HydrophobicContact CD1-CB 4.08Å; I172-L219 HydrophobicContact CG2-CD2 3.62Å |
| 173 | Q | 85.1 | Confident | 81.9 | Confident | 98 Ų | 98 | 49.3 Ų | 49.3 | 46% | 0.458 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -66.9 | -39.2 | -178.8 | -70.3 | -67.9 | -19.6 | 0 | 0 | 112.1 | M171 K177 | M171-Q173 VanDerWaalsContact C-N 3.26Å; M171-Q173 PolarHBondContact O-N 3Å; Q173-K177 WeakPolarHBondContact O-CG 3.47Å; Q173-K177 PolarHBondContact O-N 2.85Å; Q173-K177 VanDerWaalsContact O-N 3.13Å |
| 174 | T | 85.7 | Confident | 82.3 | Confident | 60 Ų | 60 | 47.1 Ų | 47.1 | 37% | 0.368 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -66.9 | -47.4 | 176.6 | -55.8 | 0 | 0 | 0 | 0 | 110.3 | M171 A176 K177 V178 | M171-T174 HydrophobicContact CE-CG2 4.24Å; M171-T174 PolarHBondContact O-N 3.23Å; M171-T174 VanDerWaalsContact O-N 3.11Å; T174-A176 VanDerWaalsContact C-N 3.32Å; T174-A176 PolarHBondContact O-N 3.28Å; T174-K177 PolarHBondContact O-N 3.44Å; T174-V178 WeakPolarHBondContact O-CG2 3.27Å; T174-V178 PolarHBondContact O-N 3.46Å; T174-V178 VanDerWaalsContact O-N 3.07Å |
| 175 | A | 85.9 | Confident | 82.5 | Confident | 0 Ų | 0 | 48.6 Ų | 48.6 | 0% | 0 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -58.6 | -44.3 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | N161 A165 M171 I172 K177 V178 L179 L216 | N161-A175 HydrophobicContact CB-CB 4.21Å; A165-A175 HydrophobicContact CB-CB 3.79Å; M171-A175 PolarHBondContact O-N 3.02Å; I172-A175 PolarHBondContact O-N 2.79Å; A175-K177 PolarHBondContact O-N 2.89Å; A175-V178 PolarHBondContact O-N 3.04Å; A175-L179 HydrophobicContact CB-CD1 4.44Å; A175-L179 WeakPolarHBondContact O-CD1 3.34Å; A175-L179 PolarHBondContact O-N 3.38Å; A175-L216 HydrophobicContact CB-CD1 4.32Å; A175-L216 HydrophobicContact CB-CD2 4.18Å |
| 176 | A | 87.2 | Confident | 82.6 | Confident | 0 Ų | 0 | 49.6 Ų | 49.6 | 0% | 0 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -59.4 | -44.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | I172 T174 V178 L179 E180 L216 L219 L220 | I172-A176 WeakPolarHBondContact O-CB 3.32Å; I172-A176 PolarHBondContact O-N 2.74Å; T174-A176 VanDerWaalsContact C-N 3.32Å; T174-A176 PolarHBondContact O-N 3.28Å; A176-V178 VanDerWaalsContact C-N 3.35Å; A176-V178 PolarHBondContact O-N 3.16Å; A176-L179 PolarHBondContact O-N 3.15Å; A176-E180 WeakPolarHBondContact O-CB 2.99Å; A176-E180 PolarHBondContact O-N 3.41Å; A176-L216 HydrophobicContact CB-CD1 3.71Å; A176-L219 HydrophobicContact CB-CB 4.49Å; A176-L219 HydrophobicContact CB-CD2 3.41Å; A176-L219 VanDerWaalsContact CB-CD2 3.41Å; A176-L219 HydrophobicContact CB-CG 3.75Å; A176-L220 HydrophobicContact CB-CD2 4.38Å |
| 177 | K | 85.6 | Confident | 82.6 | Confident | 133 Ų | 133 | 57 Ų | 57 | 58% | 0.578 | 33% | 0.327 | S | S | * | . | H | α-helix | trans | -62.2 | -40.8 | 176.5 | -75 | 179.4 | 179.3 | -178 | 0 | 112.5 | Q173 T174 A175 G181 | Q173-K177 WeakPolarHBondContact O-CG 3.47Å; Q173-K177 PolarHBondContact O-N 2.85Å; Q173-K177 VanDerWaalsContact O-N 3.13Å; T174-K177 PolarHBondContact O-N 3.44Å; A175-K177 PolarHBondContact O-N 2.89Å; K177-G181 PolarHBondContact O-N 3.44Å |
| 178 | V | 85.1 | Confident | 83 | Confident | 40 Ų | 40 | 54.5 Ų | 54.5 | 24% | 0.242 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -67.9 | -46.2 | 178.8 | 173.1 | 0 | 0 | 0 | 0 | 110.7 | V158 N161 T174 A175 A176 E180 G181 Y182 | V158-V178 HydrophobicContact CG2-CG1 4.4Å; N161-V178 HydrophobicContact CB-CB 4.46Å; N161-V178 HydrophobicContact CB-CG1 4.5Å; T174-V178 WeakPolarHBondContact O-CG2 3.27Å; T174-V178 PolarHBondContact O-N 3.46Å; T174-V178 VanDerWaalsContact O-N 3.07Å; A175-V178 PolarHBondContact O-N 3.04Å; A176-V178 VanDerWaalsContact C-N 3.35Å; A176-V178 PolarHBondContact O-N 3.16Å; V178-E180 VanDerWaalsContact C-N 3.34Å; V178-E180 PolarHBondContact O-N 2.87Å; V178-G181 PolarHBondContact O-N 3.31Å; V178-Y182 WeakPolarHBondContact O-CB 3.44Å; V178-Y182 PolarHBondContact O-N 3.03Å |
| 179 | L | 87.5 | Confident | 83.3 | Confident | 0 Ų | 0 | 52.8 Ų | 52.8 | 0% | 0 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -64.9 | -38 | 176.9 | -88 | 88.4 | 0 | 0 | 0 | 111.8 | V158 L162 A175 A176 Y182 C183 A196 L220 | V158-L179 HydrophobicContact CG1-CD1 4.2Å; V158-L179 HydrophobicContact CG1-CD2 4.5Å; V158-L179 HydrophobicContact CG1-CG 4.07Å; L162-L179 HydrophobicContact CD2-CD1 3.84Å; L162-L179 HydrophobicContact CD2-CD2 4.01Å; L162-L179 HydrophobicContact CG-CD1 4.03Å; A175-L179 HydrophobicContact CB-CD1 4.44Å; A175-L179 WeakPolarHBondContact O-CD1 3.34Å; A175-L179 PolarHBondContact O-N 3.38Å; A176-L179 PolarHBondContact O-N 3.15Å; L179-Y182 PolarHBondContact O-N 3.5Å; L179-C183 WeakPolarHBondContact O-CB 3.41Å; L179-C183 PolarHBondContact O-N 2.87Å; L179-C183 PolarHBondContact O-SG 3.07Å; L179-A196 HydrophobicContact CD2-CB 4.07Å; L179-L220 HydrophobicContact CB-CD1 4.23Å; L179-L220 HydrophobicContact CB-CD2 3.69Å; L179-L220 HydrophobicContact CD2-CD1 3.79Å |
| 180 | E | 86.4 | Confident | 83.7 | Confident | 34 Ų | 34 | 53.4 Ų | 53.4 | 16% | 0.159 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -58.4 | -52.8 | 172.9 | 179.2 | -176.2 | 177.2 | 0 | 0 | 111.1 | A176 V178 Y182 C183 L184 R223 I224 | A176-E180 WeakPolarHBondContact O-CB 2.99Å; A176-E180 PolarHBondContact O-N 3.41Å; V178-E180 VanDerWaalsContact C-N 3.34Å; V178-E180 PolarHBondContact O-N 2.87Å; E180-Y182 VanDerWaalsContact C-N 3.29Å; E180-Y182 PolarHBondContact O-N 3.28Å; E180-C183 PolarHBondContact O-N 3.04Å; E180-L184 HydrophobicContact CG-CD1 4Å; E180-L184 WeakPolarHBondContact O-CB 3.47Å; E180-L184 WeakPolarHBondContact O-CG 3.37Å; E180-L184 PolarHBondContact O-N 3.18Å; E180-R223 HydrophobicContact CG-CB 4.33Å; E180-R223 WeakPolarHBondContact OE2-CD 3.47Å; E180-R223 IonicContact OE2-CZ 3.13Å; E180-R223 IonicContact OE2-NH1 3.66Å; E180-R223 PolarHBondContact OE2-NH1 3.43Å; E180-I224 HydrophobicContact CB-CG1 4.38Å; E180-I224 HydrophobicContact CG-CG1 4.25Å |
| 181 | G | 84.9 | Confident | 84 | Confident | 46 Ų | 46 | 51.5 Ų | 51.5 | 47% | 0.474 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -59.9 | -37.9 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | K177 V178 G185 | K177-G181 PolarHBondContact O-N 3.44Å; V178-G181 PolarHBondContact O-N 3.31Å; G181-G185 WeakPolarHBondContact O-CA 3.24Å; G181-G185 PolarHBondContact O-N 3.21Å |
| 182 | Y | 87.2 | Confident | 84.2 | Confident | 18 Ų | 18 | 49.5 Ų | 49.5 | 7% | 0.071 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -65.7 | -51.3 | 174.2 | 175.8 | -102.7 | 0 | 0 | 0 | 112 | L155 V158 V178 L179 E180 L184 G185 R192 I195 | L155-Y182 HydrophobicContact CD1-CE2 4.4Å; V158-Y182 HydrophobicContact CG2-CD1 4.01Å; V158-Y182 HydrophobicContact CG2-CD2 4Å; V158-Y182 HydrophobicContact CG2-CG 3.61Å; V178-Y182 WeakPolarHBondContact O-CB 3.44Å; V178-Y182 PolarHBondContact O-N 3.03Å; L179-Y182 PolarHBondContact O-N 3.5Å; E180-Y182 VanDerWaalsContact C-N 3.29Å; E180-Y182 PolarHBondContact O-N 3.28Å; Y182-L184 VanDerWaalsContact C-N 3.28Å; Y182-L184 PolarHBondContact O-N 3.21Å; Y182-G185 PolarHBondContact O-N 3.46Å; Y182-R192 HydrophobicContact CD1-CB 4.46Å; Y182-R192 HydrophobicContact CE1-CB 3.95Å; Y182-R192 HydrophobicContact CE1-CG 4.25Å; Y182-R192 WeakPolarHBondContact CE1-O 3.41Å; Y182-R192 WeakPolarHBondContact O-CD 3.45Å; Y182-R192 PolarHBondContact O-NH1 3.4Å; Y182-I195 HydrophobicContact CE1-CB 4.49Å; Y182-I195 HydrophobicContact CE1-CG2 4.36Å |
| 183 | C | 87.3 | Confident | 84.4 | Confident | 0 Ų | 0 | 48.4 Ų | 48.4 | 0% | 0 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -62.5 | -37.2 | -176.8 | -66.4 | 0 | 0 | 0 | 0 | 112.3 | L179 E180 H189 I193 I224 | L179-C183 WeakPolarHBondContact O-CB 3.41Å; L179-C183 PolarHBondContact O-N 2.87Å; L179-C183 PolarHBondContact O-SG 3.07Å; E180-C183 PolarHBondContact O-N 3.04Å; C183-H189 PolarHBondContact O-ND1 3.39Å; C183-I193 HydrophobicContact CB-CG1 3.79Å; C183-I224 HydrophobicContact CB-CD1 3.81Å |
| 184 | L | 84.2 | Confident | 84.6 | Confident | 34 Ų | 34 | 43.8 Ų | 43.8 | 18% | 0.178 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -90.4 | -17 | -176.1 | -60.6 | 179.3 | 0 | 0 | 0 | 114 | E180 Y182 G186 I224 I226 | E180-L184 HydrophobicContact CG-CD1 4Å; E180-L184 WeakPolarHBondContact O-CB 3.47Å; E180-L184 WeakPolarHBondContact O-CG 3.37Å; E180-L184 PolarHBondContact O-N 3.18Å; Y182-L184 VanDerWaalsContact C-N 3.28Å; Y182-L184 PolarHBondContact O-N 3.21Å; L184-G186 VanDerWaalsContact C-N 3.3Å; L184-G186 PolarHBondContact O-N 2.84Å; L184-I224 HydrophobicContact CD2-CG2 4.17Å; L184-I226 HydrophobicContact CD2-CD1 3.69Å |
| 185 | G | 78.4 | Confident | 84.6 | Confident | 59 Ų | 59 | 42.7 Ų | 42.7 | 61% | 0.608 | 24% | 0.243 | S | C | * | . | S | Bend | trans | -81 | 8.7 | -170.9 | 0 | 0 | 0 | 0 | 0 | 116.8 | G181 Y182 R192 | G181-G185 WeakPolarHBondContact O-CA 3.24Å; G181-G185 PolarHBondContact O-N 3.21Å; Y182-G185 PolarHBondContact O-N 3.46Å; G185-R192 PolarHBondContact O-NH1 3.31Å |
| 186 | G | 74 | Confident | 84.6 | Confident | 20 Ų | 20 | 42.7 Ų | 42.7 | 21% | 0.206 | 24% | 0.243 | C | C | . | . | S | Bend | trans | -137 | 168.3 | -175.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | L184 H189 | L184-G186 VanDerWaalsContact C-N 3.3Å; L184-G186 PolarHBondContact O-N 2.84Å; G186-H189 PolarHBondContact O-CE1 2.94Å; G186-H189 PolarHBondContact O-ND1 2.93Å |
| 187 | L | 72.8 | Confident | 84.9 | Confident | 165 Ų | 165 | 42.7 Ų | 42.7 | 86% | 0.864 | 24% | 0.243 | S | C | * | . | S | Bend | trans | -77.9 | -24.7 | -179.8 | -67.3 | 172 | 0 | 0 | 0 | 113.3 | ||
| 188 | N | 84.3 | Confident | 84.9 | Confident | 81 Ų | 81 | 41.1 Ų | 41.1 | 43% | 0.433 | 23% | 0.233 | S | C | . | . | trans | -103.4 | 81.4 | -179.4 | -161.6 | -0.5 | 0 | 0 | 0 | 110.8 | E191 R192 | N188-E191 HydrophobicContact CB-CB 4.24Å; N188-E191 VanDerWaalsContact ND2-CB 3.34Å; N188-E191 WeakPolarHBondContact ND2-CB 3.02Å; N188-E191 PolarHBondContact ND2-OE2 3.4Å; N188-R192 PolarHBondContact O-N 3.49Å | ||
| 189 | H | 84.8 | Confident | 84.8 | Confident | 39 Ų | 39 | 40.4 Ų | 40.4 | 18% | 0.181 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -63.8 | -43.6 | -176.6 | -63.9 | -52.2 | 0 | 0 | 0 | 112.4 | C183 G186 E191 R192 I193 I226 | C183-H189 PolarHBondContact O-ND1 3.39Å; G186-H189 PolarHBondContact O-CE1 2.94Å; G186-H189 PolarHBondContact O-ND1 2.93Å; H189-E191 PolarHBondContact O-N 3.4Å; H189-R192 PolarHBondContact O-N 3.49Å; H189-I193 HydrophobicContact CB-CD1 4.31Å; H189-I193 VanDerWaalsContact O-CB 3.31Å; H189-I193 WeakPolarHBondContact O-CB 3.42Å; H189-I193 WeakPolarHBondContact O-CG1 3.31Å; H189-I193 PolarHBondContact O-N 2.92Å; H189-I226 HydrophobicContact CB-CD1 3.95Å; H189-I226 HydrophobicContact CB-CG1 4.2Å |
| 190 | D | 85.2 | Confident | 84.8 | Confident | 69 Ų | 69 | 40.5 Ų | 40.5 | 37% | 0.369 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -58.4 | -46.9 | -179.6 | -176.3 | 47.8 | 0 | 0 | 0 | 112 | G194 Y236 | D190-G194 PolarHBondContact O-N 3.38Å; D190-Y236 HydrophobicContact CB-CE1 4.21Å; D190-Y236 WeakPolarHBondContact OD1-CD1 3.25Å; D190-Y236 WeakPolarHBondContact OD1-CE1 3.48Å |
| 191 | E | 85.6 | Confident | 84.8 | Confident | 97 Ų | 97 | 39.3 Ų | 39.3 | 45% | 0.453 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -63.9 | -45.1 | 177.8 | -177.5 | 174.8 | -164 | 0 | 0 | 112.1 | N188 H189 G194 I195 | N188-E191 HydrophobicContact CB-CB 4.24Å; N188-E191 VanDerWaalsContact ND2-CB 3.34Å; N188-E191 WeakPolarHBondContact ND2-CB 3.02Å; N188-E191 PolarHBondContact ND2-OE2 3.4Å; H189-E191 PolarHBondContact O-N 3.4Å; E191-G194 PolarHBondContact O-N 3.29Å; E191-I195 HydrophobicContact CG-CD1 4.05Å; E191-I195 VanDerWaalsContact O-CG1 3.27Å; E191-I195 WeakPolarHBondContact O-CG1 3.32Å; E191-I195 PolarHBondContact O-N 3.47Å |
| 192 | R | 85.1 | Confident | 84.6 | Confident | 24 Ų | 24 | 40.5 Ų | 40.5 | 9% | 0.091 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -67 | -44.2 | -179.9 | -75.1 | -176.1 | 147.1 | -150.1 | 2.2 | 112.4 | E151 Y182 G185 N188 H189 G194 I195 A196 | E151-R192 IonicContact OE1-CZ 2.68Å; E151-R192 IonicContact OE1-NE 3.86Å; E151-R192 IonicContact OE1-NH2 3.75Å; E151-R192 PolarHBondContact OE1-NH2 2.78Å; Y182-R192 HydrophobicContact CD1-CB 4.46Å; Y182-R192 HydrophobicContact CE1-CB 3.95Å; Y182-R192 HydrophobicContact CE1-CG 4.25Å; Y182-R192 WeakPolarHBondContact CE1-O 3.41Å; Y182-R192 WeakPolarHBondContact O-CD 3.45Å; Y182-R192 PolarHBondContact O-NH1 3.4Å; G185-R192 PolarHBondContact O-NH1 3.31Å; N188-R192 PolarHBondContact O-N 3.49Å; H189-R192 PolarHBondContact O-N 3.49Å; R192-G194 VanDerWaalsContact C-N 3.3Å; R192-G194 PolarHBondContact O-N 3.4Å; R192-I195 PolarHBondContact O-N 3.42Å; R192-A196 PolarHBondContact O-N 3.37Å |
| 193 | I | 90 | Very high | 84.2 | Confident | 0 Ų | 0 | 41.1 Ų | 41.1 | 0% | 0 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -62.8 | -42.8 | 175.5 | -68 | 167.9 | 0 | 0 | 0 | 109.5 | C183 H189 I195 A196 I197 I224 I226 F233 Y236 | C183-I193 HydrophobicContact CB-CG1 3.79Å; H189-I193 HydrophobicContact CB-CD1 4.31Å; H189-I193 VanDerWaalsContact O-CB 3.31Å; H189-I193 WeakPolarHBondContact O-CB 3.42Å; H189-I193 WeakPolarHBondContact O-CG1 3.31Å; H189-I193 PolarHBondContact O-N 2.92Å; I193-I195 PolarHBondContact O-N 3.24Å; I193-A196 WeakPolarHBondContact O-CB 3.46Å; I193-A196 PolarHBondContact O-N 3.4Å; I193-I197 HydrophobicContact CG2-CD1 3.6Å; I193-I197 HydrophobicContact CG2-CG1 4.28Å; I193-I197 VanDerWaalsContact O-CG1 3.27Å; I193-I197 WeakPolarHBondContact O-CG1 3.1Å; I193-I197 PolarHBondContact O-N 2.89Å; I193-I224 HydrophobicContact CD1-CG2 4.15Å; I193-I226 HydrophobicContact CD1-CD1 4.07Å; I193-I226 HydrophobicContact CD1-CG1 3.82Å; I193-F233 HydrophobicContact CG2-CD2 3.96Å; I193-F233 HydrophobicContact CG2-CE2 3.96Å; I193-Y236 HydrophobicContact CB-CG 4.44Å; I193-Y236 HydrophobicContact CD1-CD2 3.87Å; I193-Y236 HydrophobicContact CD1-CE2 3.67Å; I193-Y236 HydrophobicContact CD1-CG 4.43Å; I193-Y236 HydrophobicContact CG2-CD1 4.35Å; I193-Y236 HydrophobicContact CG2-CD2 3.9Å; I193-Y236 HydrophobicContact CG2-CG 3.68Å |
| 194 | G | 88.7 | Confident | 83.9 | Confident | 0 Ų | 0 | 41.3 Ų | 41.3 | 0% | 0 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -59 | -44 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | D190 E191 R192 I197 R198 W240 | D190-G194 PolarHBondContact O-N 3.38Å; E191-G194 PolarHBondContact O-N 3.29Å; R192-G194 VanDerWaalsContact C-N 3.3Å; R192-G194 PolarHBondContact O-N 3.4Å; G194-I197 PolarHBondContact O-N 2.98Å; G194-R198 VanDerWaalsContact O-CG 3.32Å; G194-R198 WeakPolarHBondContact O-CG 3.49Å; G194-R198 PolarHBondContact O-N 2.94Å; G194-W240 VanDerWaalsContact CA-NE1 3.35Å |
| 195 | I | 85.3 | Confident | 83.8 | Confident | 37 Ų | 37 | 42.9 Ų | 42.9 | 19% | 0.19 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -61.1 | -45.6 | 174.3 | -70.6 | 164.6 | 0 | 0 | 0 | 110.8 | L155 Y182 E191 R192 I193 I197 R198 H199 | L155-I195 HydrophobicContact CD1-CG2 3.54Å; Y182-I195 HydrophobicContact CE1-CB 4.49Å; Y182-I195 HydrophobicContact CE1-CG2 4.36Å; E191-I195 HydrophobicContact CG-CD1 4.05Å; E191-I195 VanDerWaalsContact O-CG1 3.27Å; E191-I195 WeakPolarHBondContact O-CG1 3.32Å; E191-I195 PolarHBondContact O-N 3.47Å; R192-I195 PolarHBondContact O-N 3.42Å; I193-I195 PolarHBondContact O-N 3.24Å; I195-I197 PolarHBondContact O-N 3.2Å; I195-R198 PolarHBondContact O-N 2.97Å; I195-H199 PolarHBondContact O-CD2 2.88Å; I195-H199 PolarHBondContact O-N 2.96Å |
| 196 | A | 87.8 | Confident | 83.6 | Confident | 0 Ų | 0 | 42.3 Ų | 42.3 | 0% | 0 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -60.4 | -44.2 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112 | L179 R192 I193 H199 L200 | L179-A196 HydrophobicContact CD2-CB 4.07Å; R192-A196 PolarHBondContact O-N 3.37Å; I193-A196 WeakPolarHBondContact O-CB 3.46Å; I193-A196 PolarHBondContact O-N 3.4Å; A196-H199 PolarHBondContact O-N 3.35Å; A196-L200 WeakPolarHBondContact O-CG 3.44Å; A196-L200 PolarHBondContact O-N 3.47Å |
| 197 | I | 91.7 | Very high | 83.2 | Confident | 0 Ų | 0 | 45.4 Ų | 45.4 | 0% | 0 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -63.7 | -44.3 | 177.1 | -65.9 | 161.6 | 0 | 0 | 0 | 111.2 | I193 G194 I195 H199 L200 F201 F233 F237 W240 | I193-I197 HydrophobicContact CG2-CD1 3.6Å; I193-I197 HydrophobicContact CG2-CG1 4.28Å; I193-I197 VanDerWaalsContact O-CG1 3.27Å; I193-I197 WeakPolarHBondContact O-CG1 3.1Å; I193-I197 PolarHBondContact O-N 2.89Å; G194-I197 PolarHBondContact O-N 2.98Å; I195-I197 PolarHBondContact O-N 3.2Å; I197-H199 VanDerWaalsContact C-N 3.27Å; I197-H199 PolarHBondContact O-N 3.42Å; I197-L200 WeakPolarHBondContact O-CB 3.35Å; I197-L200 PolarHBondContact O-N 2.68Å; I197-L200 VanDerWaalsContact O-N 3.14Å; I197-F201 HydrophobicContact CG2-CD2 4.15Å; I197-F201 HydrophobicContact CG2-CE1 4.22Å; I197-F201 HydrophobicContact CG2-CE2 3.7Å; I197-F201 HydrophobicContact CG2-CZ 3.73Å; I197-F201 PolarHBondContact O-N 3.34Å; I197-F233 HydrophobicContact CD1-CZ 4.47Å; I197-F233 HydrophobicContact CG1-CE1 4.3Å; I197-F233 HydrophobicContact CG1-CE2 4.09Å; I197-F233 HydrophobicContact CG1-CZ 3.67Å; I197-F237 HydrophobicContact CD1-CB 4.35Å; I197-F237 HydrophobicContact CG1-CD2 4.07Å; I197-F237 HydrophobicContact CG2-CD2 3.98Å; I197-F237 HydrophobicContact CG2-CE2 4.29Å; I197-W240 HydrophobicContact CB-CG 4.41Å; I197-W240 HydrophobicContact CD1-CB 4.44Å; I197-W240 HydrophobicContact CD1-CG 4.13Å; I197-W240 HydrophobicContact CG2-CB 3.7Å; I197-W240 HydrophobicContact CG2-CG 4.09Å |
| 198 | R | 85.5 | Confident | 83.3 | Confident | 100 Ų | 100 | 43.4 Ų | 43.4 | 38% | 0.377 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -56.7 | -43.3 | 175.4 | -74.8 | 177.2 | -176 | -144.9 | -2.7 | 111.4 | D99 G194 I195 F201 I202 W240 | D99-R198 IonicContact OD2-NH1 3.64Å; D99-R198 PolarHBondContact OD2-NH1 3.26Å; D99-R198 VanDerWaalsContact OD2-NH1 3.11Å; G194-R198 VanDerWaalsContact O-CG 3.32Å; G194-R198 WeakPolarHBondContact O-CG 3.49Å; G194-R198 PolarHBondContact O-N 2.94Å; I195-R198 PolarHBondContact O-N 2.97Å; R198-F201 PolarHBondContact O-N 3.26Å; R198-I202 VanDerWaalsContact O-CG1 3.31Å; R198-I202 WeakPolarHBondContact O-CG1 3.25Å; R198-I202 PolarHBondContact O-N 3.37Å; R198-W240 HydrophobicContact CG-CE3 4.07Å; R198-W240 HydrophobicContact CG-CH2 4.37Å; R198-W240 HydrophobicContact CG-CZ3 3.81Å; R198-W240 VanDerWaalsContact NH2-CZ3 3.29Å |
| 199 | H | 83.9 | Confident | 83.1 | Confident | 25 Ų | 25 | 42.2 Ų | 42.2 | 12% | 0.116 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -66.9 | -40.8 | 176.5 | -77.5 | -67.5 | 0 | 0 | 0 | 112.4 | L162 I195 A196 I197 F201 I202 F203 | L162-H199 HydrophobicContact CD1-CB 3.54Å; I195-H199 PolarHBondContact O-CD2 2.88Å; I195-H199 PolarHBondContact O-N 2.96Å; A196-H199 PolarHBondContact O-N 3.35Å; I197-H199 VanDerWaalsContact C-N 3.27Å; I197-H199 PolarHBondContact O-N 3.42Å; H199-F201 VanDerWaalsContact C-N 3.3Å; H199-F201 PolarHBondContact O-N 3.27Å; H199-I202 PolarHBondContact O-N 2.93Å; H199-I202 VanDerWaalsContact O-N 3.15Å; H199-F203 WeakPolarHBondContact O-CD2 3.31Å; H199-F203 PolarHBondContact O-N 3.27Å |
| 200 | L | 88.4 | Confident | 83.1 | Confident | 2 Ų | 2 | 40.5 Ų | 40.5 | 1% | 0.01 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -56.8 | -44.3 | 172.4 | -73.9 | 169 | 0 | 0 | 0 | 111.6 | L162 A196 I197 I202 F203 A204 M213 L216 A217 L220 F233 F237 | L162-L200 HydrophobicContact CD2-CD2 3.72Å; L162-L200 HydrophobicContact CD2-CG 4.49Å; A196-L200 WeakPolarHBondContact O-CG 3.44Å; A196-L200 PolarHBondContact O-N 3.47Å; I197-L200 WeakPolarHBondContact O-CB 3.35Å; I197-L200 PolarHBondContact O-N 2.68Å; I197-L200 VanDerWaalsContact O-N 3.14Å; L200-I202 PolarHBondContact O-N 2.9Å; L200-F203 PolarHBondContact O-N 2.87Å; L200-A204 VanDerWaalsContact O-CB 3.25Å; L200-A204 WeakPolarHBondContact O-CB 3.45Å; L200-A204 PolarHBondContact O-N 3.47Å; L200-M213 HydrophobicContact CD2-CB 4.44Å; L200-M213 HydrophobicContact CD2-SD 3.73Å; L200-L216 HydrophobicContact CD2-CB 4.37Å; L200-L216 HydrophobicContact CD2-CD2 3.64Å; L200-L216 HydrophobicContact CD2-CG 4Å; L200-A217 HydrophobicContact CD1-CB 4.48Å; L200-L220 HydrophobicContact CD1-CD1 4.02Å; L200-F233 HydrophobicContact CD1-CE1 4.08Å; L200-F233 HydrophobicContact CD1-CZ 3.74Å; L200-F237 HydrophobicContact CD1-CE2 4.36Å |
| 201 | F | 86 | Confident | 83.3 | Confident | 10 Ų | 10 | 40.8 Ų | 40.8 | 4% | 0.044 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -62.3 | -41.3 | 175.9 | -70.7 | -20.1 | 0 | 0 | 0 | 112.5 | I197 R198 H199 A204 M205 F237 W240 T241 E244 L264 L267 | I197-F201 HydrophobicContact CG2-CD2 4.15Å; I197-F201 HydrophobicContact CG2-CE1 4.22Å; I197-F201 HydrophobicContact CG2-CE2 3.7Å; I197-F201 HydrophobicContact CG2-CZ 3.73Å; I197-F201 PolarHBondContact O-N 3.34Å; R198-F201 PolarHBondContact O-N 3.26Å; H199-F201 VanDerWaalsContact C-N 3.3Å; H199-F201 PolarHBondContact O-N 3.27Å; F201-A204 PolarHBondContact O-N 2.84Å; F201-M205 VanDerWaalsContact O-CG 3.26Å; F201-M205 WeakPolarHBondContact O-CG 3.2Å; F201-M205 PolarHBondContact O-N 3Å; F201-F237 HydrophobicContact CD1-CE2 4.5Å; F201-F237 HydrophobicContact CD1-CZ 4.23Å; F201-F237 AromaticContact CE1-CE1 3.81Å; F201-F237 HydrophobicContact CE1-CE1 3.81Å; F201-F237 AromaticContact CE1-CE2 3.84Å; F201-F237 HydrophobicContact CE1-CE2 3.84Å; F201-F237 AromaticContact CE1-CZ 3.41Å; F201-F237 HydrophobicContact CE1-CZ 3.41Å; F201-F237 VanDerWaalsContact CE1-CZ 3.41Å; F201-F237 HydrophobicContact CZ-CE1 4.27Å; F201-F237 HydrophobicContact CZ-CE2 4.47Å; F201-F237 HydrophobicContact CZ-CZ 4.19Å; F201-W240 HydrophobicContact CE2-CB 4.2Å; F201-T241 WeakPolarHBondContact CZ-OG1 3.25Å; F201-E244 HydrophobicContact CD2-CG 4.05Å; F201-E244 HydrophobicContact CE2-CG 3.86Å; F201-L264 HydrophobicContact CD1-CD1 4.12Å; F201-L264 HydrophobicContact CE1-CD1 3.81Å; F201-L264 HydrophobicContact CZ-CD1 4.23Å; F201-L267 HydrophobicContact CD1-CD2 3.8Å; F201-L267 HydrophobicContact CE1-CD2 3.84Å |
| 202 | I | 81.1 | Confident | 83.4 | Confident | 70 Ų | 70 | 37 Ų | 37 | 36% | 0.359 | 16% | 0.162 | S | C | . | . | H | α-helix | trans | -60.4 | -48.7 | 177.2 | -69.1 | 164 | 0 | 0 | 0 | 111.1 | Y102 R198 H199 L200 A204 M205 | Y102-I202 HydrophobicContact CE2-CD1 4.46Å; R198-I202 VanDerWaalsContact O-CG1 3.31Å; R198-I202 WeakPolarHBondContact O-CG1 3.25Å; R198-I202 PolarHBondContact O-N 3.37Å; H199-I202 PolarHBondContact O-N 2.93Å; H199-I202 VanDerWaalsContact O-N 3.15Å; L200-I202 PolarHBondContact O-N 2.9Å; I202-A204 VanDerWaalsContact C-N 3.28Å; I202-A204 PolarHBondContact O-N 2.8Å; I202-M205 HydrophobicContact CB-CE 4.38Å; I202-M205 HydrophobicContact CG1-CE 3.97Å; I202-M205 WeakPolarHBondContact O-CB 3.34Å; I202-M205 PolarHBondContact O-N 3.35Å; I202-M205 VanDerWaalsContact O-N 3.16Å |
| 203 | F | 77.9 | Confident | 83.6 | Confident | 32 Ų | 32 | 36 Ų | 36 | 14% | 0.14 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -67.7 | -29.6 | 177.4 | -82.9 | -86 | 0 | 0 | 0 | 112.6 | V159 L162 H163 A166 H199 L200 M205 M213 | V159-F203 HydrophobicContact CG1-CE2 4.22Å; V159-F203 HydrophobicContact CG1-CZ 4.25Å; L162-F203 HydrophobicContact CB-CD2 3.83Å; L162-F203 HydrophobicContact CB-CE2 3.65Å; L162-F203 HydrophobicContact CB-CG 4.37Å; L162-F203 HydrophobicContact CB-CZ 4.05Å; L162-F203 HydrophobicContact CD1-CD2 4.12Å; L162-F203 HydrophobicContact CD1-CE2 4.2Å; H163-F203 HydrophobicContact CB-CE1 3.88Å; H163-F203 HydrophobicContact CB-CZ 3.96Å; H163-F203 AromaticContact CD2-CE1 3.85Å; A166-F203 HydrophobicContact CB-CD1 4.01Å; A166-F203 HydrophobicContact CB-CE1 4.47Å; H199-F203 WeakPolarHBondContact O-CD2 3.31Å; H199-F203 PolarHBondContact O-N 3.27Å; L200-F203 PolarHBondContact O-N 2.87Å; F203-M205 PolarHBondContact O-N 2.89Å; F203-M213 HydrophobicContact CB-CE 4.28Å; F203-M213 HydrophobicContact CB-CG 3.91Å; F203-M213 HydrophobicContact CB-SD 3.65Å; F203-M213 HydrophobicContact CG-SD 4.49Å |
| 204 | A | 81.8 | Confident | 83.7 | Confident | 3 Ų | 3 | 36 Ų | 36 | 3% | 0.025 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -71.8 | -9.6 | 174.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | L200 F201 I202 D206 M213 L267 | L200-A204 VanDerWaalsContact O-CB 3.25Å; L200-A204 WeakPolarHBondContact O-CB 3.45Å; L200-A204 PolarHBondContact O-N 3.47Å; F201-A204 PolarHBondContact O-N 2.84Å; I202-A204 VanDerWaalsContact C-N 3.28Å; I202-A204 PolarHBondContact O-N 2.8Å; A204-D206 PolarHBondContact O-N 3.27Å; A204-M213 HydrophobicContact CB-CB 4.05Å; A204-M213 HydrophobicContact CB-CG 4.21Å; A204-L267 HydrophobicContact CB-CD1 4.09Å; A204-L267 HydrophobicContact CB-CD2 4.12Å |
| 205 | M | 80.6 | Confident | 83.7 | Confident | 67 Ų | 67 | 38.7 Ų | 38.7 | 33% | 0.33 | 17% | 0.173 | S | C | . | . | S | Bend | trans | -73.9 | 25.8 | 173.2 | -57.3 | -164.6 | -125.3 | 0 | 0 | 113.7 | F201 I202 F203 K260 F263 | F201-M205 VanDerWaalsContact O-CG 3.26Å; F201-M205 WeakPolarHBondContact O-CG 3.2Å; F201-M205 PolarHBondContact O-N 3Å; I202-M205 HydrophobicContact CB-CE 4.38Å; I202-M205 HydrophobicContact CG1-CE 3.97Å; I202-M205 WeakPolarHBondContact O-CB 3.34Å; I202-M205 PolarHBondContact O-N 3.35Å; I202-M205 VanDerWaalsContact O-N 3.16Å; F203-M205 PolarHBondContact O-N 2.89Å; M205-K260 HydrophobicContact CE-CD 4.21Å; M205-K260 HydrophobicContact CE-CG 4.26Å; M205-K260 HydrophobicContact SD-CB 4Å; M205-K260 HydrophobicContact SD-CD 4.24Å; M205-K260 HydrophobicContact SD-CG 3.76Å; M205-F263 HydrophobicContact CB-CD2 3.85Å; M205-F263 HydrophobicContact CB-CE2 4.32Å; M205-F263 HydrophobicContact CB-CG 4.31Å; M205-F263 HydrophobicContact CG-CD2 4.44Å; M205-F263 WeakPolarHBondContact O-CD2 3.37Å; M205-F263 WeakPolarHBondContact O-CE2 3.46Å; M205-F263 WeakPolarHBondContact O-CZ 3.17Å |
| 206 | D | 74.3 | Confident | 84 | Confident | 47 Ų | 47 | 37 Ų | 37 | 25% | 0.251 | 16% | 0.164 | S | C | . | . | S | Bend | trans | -134.1 | 132.7 | 168.8 | -169.4 | -35.4 | 0 | 0 | 0 | 109.2 | A204 R208 Y209 Y210 | A204-D206 PolarHBondContact O-N 3.27Å; D206-R208 PolarHBondContact O-N 3.47Å; D206-R208 VanDerWaalsContact O-N 3.15Å; D206-R208 WeakPolarHBondContact OD1-CB 3.33Å; D206-R208 PolarHBondContact OD1-N 3.42Å; D206-R208 IonicContact OD1-NE 3.17Å; D206-R208 IonicContact OD2-NE 3.46Å; D206-Y209 HydrophobicContact CB-CD2 3.55Å; D206-Y209 HydrophobicContact CB-CE2 4.06Å; D206-Y209 HydrophobicContact CB-CG 4.29Å; D206-Y209 PolarHBondContact O-N 3.13Å; D206-Y210 PolarHBondContact O-N 3.36Å; D206-Y210 VanDerWaalsContact O-N 3.08Å |
| 207 | Y | 66.7 | Low | 84.2 | Confident | 85 Ų | 85 | 37 Ų | 37 | 33% | 0.333 | 16% | 0.164 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -63.3 | -21.7 | -179.4 | -80 | -66.6 | 0 | 0 | 0 | 112 | Y209 Y210 F263 A266 A307 H310 | Y207-Y209 VanDerWaalsContact C-N 3.33Å; Y207-Y210 HydrophobicContact CD1-CD1 4.36Å; Y207-Y210 HydrophobicContact CD1-CE1 4.23Å; Y207-Y210 WeakPolarHBondContact O-CD1 3.39Å; Y207-Y210 WeakPolarHBondContact O-CE1 3.37Å; Y207-F263 HydrophobicContact CD1-CD1 4.23Å; Y207-F263 AromaticContact CD1-CE1 3.92Å; Y207-F263 HydrophobicContact CD1-CE1 3.92Å; Y207-F263 HydrophobicContact CD2-CD1 4.29Å; Y207-F263 AromaticContact CD2-CE1 3.28Å; Y207-F263 HydrophobicContact CD2-CE1 3.28Å; Y207-F263 AromaticContact CD2-CZ 3.78Å; Y207-F263 HydrophobicContact CD2-CZ 3.78Å; Y207-F263 HydrophobicContact CE1-CD1 4.19Å; Y207-F263 HydrophobicContact CE1-CE1 4.07Å; Y207-F263 HydrophobicContact CE2-CD1 4.23Å; Y207-F263 AromaticContact CE2-CE1 3.43Å; Y207-F263 HydrophobicContact CE2-CE1 3.43Å; Y207-F263 VanDerWaalsContact CE2-CE1 3.43Å; Y207-F263 AromaticContact CE2-CZ 3.8Å; Y207-F263 HydrophobicContact CE2-CZ 3.8Å; Y207-F263 HydrophobicContact CG-CD1 4.27Å; Y207-F263 AromaticContact CG-CE1 3.52Å; Y207-F263 HydrophobicContact CG-CE1 3.52Å; Y207-F263 HydrophobicContact CG-CZ 4.43Å; Y207-F263 AromaticContact CZ-CE1 3.83Å; Y207-A266 HydrophobicContact CE1-CB 4.21Å; Y207-A307 VanDerWaalsContact OH-CB 3.26Å; Y207-A307 WeakPolarHBondContact OH-CB 3.48Å; Y207-H310 AromaticContact CE1-CD2 3.83Å |
| 208 | R | 73.9 | Confident | 84.2 | Confident | 124 Ų | 124 | 39.1 Ų | 39.1 | 47% | 0.468 | 17% | 0.174 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -71.9 | -27.7 | 174 | -71.7 | -175.9 | -92.5 | -159.8 | -7.7 | 112.9 | D206 | D206-R208 PolarHBondContact O-N 3.47Å; D206-R208 VanDerWaalsContact O-N 3.15Å; D206-R208 WeakPolarHBondContact OD1-CB 3.33Å; D206-R208 PolarHBondContact OD1-N 3.42Å; D206-R208 IonicContact OD1-NE 3.17Å; D206-R208 IonicContact OD2-NE 3.46Å |
| 209 | Y | 80.5 | Confident | 84.4 | Confident | 56 Ų | 56 | 35.7 Ų | 35.7 | 22% | 0.22 | 16% | 0.164 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -116 | -15.8 | -166 | -51.1 | -41.5 | 0 | 0 | 0 | 114.2 | A166 D206 Y207 K211 T212 M213 | A166-Y209 HydrophobicContact CB-CD1 3.89Å; A166-Y209 HydrophobicContact CB-CD2 4.08Å; A166-Y209 HydrophobicContact CB-CE1 4.23Å; A166-Y209 HydrophobicContact CB-CE2 4.43Å; A166-Y209 HydrophobicContact CB-CG 3.82Å; A166-Y209 WeakPolarHBondContact O-CD1 3.49Å; A166-Y209 WeakPolarHBondContact O-CE1 3.42Å; D206-Y209 HydrophobicContact CB-CD2 3.55Å; D206-Y209 HydrophobicContact CB-CE2 4.06Å; D206-Y209 HydrophobicContact CB-CG 4.29Å; D206-Y209 PolarHBondContact O-N 3.13Å; Y207-Y209 VanDerWaalsContact C-N 3.33Å; Y209-K211 VanDerWaalsContact C-N 3.26Å; Y209-K211 PolarHBondContact O-N 3.36Å; Y209-K211 VanDerWaalsContact O-N 3.17Å; Y209-T212 WeakPolarHBondContact O-CB 3.33Å; Y209-T212 PolarHBondContact O-N 2.98Å; Y209-M213 WeakPolarHBondContact O-CG 3.25Å; Y209-M213 PolarHBondContact O-N 3.29Å |
| 210 | Y | 85.3 | Confident | 84.6 | Confident | 3 Ų | 3 | 34.5 Ų | 34.5 | 1% | 0.012 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -56.3 | -37.8 | -176.4 | 83 | -89.3 | 0 | 0 | 0 | 113.3 | D206 Y207 M213 A214 A266 L267 H270 E314 Y315 | D206-Y210 PolarHBondContact O-N 3.36Å; D206-Y210 VanDerWaalsContact O-N 3.08Å; Y207-Y210 HydrophobicContact CD1-CD1 4.36Å; Y207-Y210 HydrophobicContact CD1-CE1 4.23Å; Y207-Y210 WeakPolarHBondContact O-CD1 3.39Å; Y207-Y210 WeakPolarHBondContact O-CE1 3.37Å; Y210-M213 PolarHBondContact O-N 2.82Å; Y210-A214 WeakPolarHBondContact O-CB 3.38Å; Y210-A214 PolarHBondContact O-N 3.01Å; Y210-A266 HydrophobicContact CD2-CB 4.05Å; Y210-A266 HydrophobicContact CE1-CB 4.47Å; Y210-A266 HydrophobicContact CE2-CB 3.96Å; Y210-A266 VanDerWaalsContact CE2-O 3.31Å; Y210-A266 WeakPolarHBondContact CE2-O 3.42Å; Y210-A266 HydrophobicContact CG-CB 4.32Å; Y210-L267 VanDerWaalsContact O-CD1 3.24Å; Y210-L267 WeakPolarHBondContact O-CD1 3.42Å; Y210-H270 HydrophobicContact CD2-CB 4.29Å; Y210-H270 HydrophobicContact CE2-CB 3.93Å; Y210-E314 PolarHBondContact OH-OE2 2.96Å; Y210-Y315 WeakPolarHBondContact CE2-OH 3.25Å; Y210-Y315 PolarHBondContact OH-OH 3.11Å |
| 211 | K | 89.7 | Confident | 84.8 | Confident | 74 Ų | 74 | 34.9 Ų | 34.9 | 32% | 0.322 | 16% | 0.16 | S | C | . | . | H | α-helix | trans | -66.6 | -43.7 | 176.3 | -62.8 | -178.6 | -178.7 | 169.8 | 0 | 112 | Y209 M213 A214 N215 E314 Y315 | Y209-K211 VanDerWaalsContact C-N 3.26Å; Y209-K211 PolarHBondContact O-N 3.36Å; Y209-K211 VanDerWaalsContact O-N 3.17Å; K211-M213 VanDerWaalsContact C-N 3.33Å; K211-A214 PolarHBondContact O-N 3.47Å; K211-N215 WeakPolarHBondContact O-CB 3.48Å; K211-N215 VanDerWaalsContact O-CG 3.26Å; K211-N215 PolarHBondContact O-N 3.25Å; K211-N215 PolarHBondContact O-ND2 3.45Å; K211-E314 WeakPolarHBondContact CE-OE1 3.19Å; K211-E314 IonicContact NZ-OE1 3.85Å; K211-E314 PolarHBondContact NZ-OE1 2.84Å; K211-E314 IonicContact NZ-OE2 2.7Å; K211-Y315 WeakPolarHBondContact CE-OH 3.42Å |
| 212 | T | 87.8 | Confident | 84.7 | Confident | 18 Ų | 18 | 37.1 Ų | 37.1 | 11% | 0.11 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -60.3 | -45.3 | 175.7 | -56 | 0 | 0 | 0 | 0 | 110.4 | A165 I172 Y209 N215 L216 | A165-T212 WeakPolarHBondContact O-CG2 3.46Å; I172-T212 HydrophobicContact CD1-CG2 3.69Å; I172-T212 HydrophobicContact CG1-CG2 3.83Å; Y209-T212 WeakPolarHBondContact O-CB 3.33Å; Y209-T212 PolarHBondContact O-N 2.98Å; T212-N215 PolarHBondContact O-N 3.07Å; T212-L216 WeakPolarHBondContact O-CB 3.42Å; T212-L216 PolarHBondContact O-N 2.98Å |
| 213 | M | 89.6 | Confident | 84.9 | Confident | 2 Ų | 2 | 36.7 Ų | 36.7 | 1% | 0.01 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -66.6 | -37.1 | 177.3 | -64.1 | -56.6 | 118.7 | 0 | 0 | 112.3 | L162 A166 L200 F203 A204 Y209 Y210 K211 L216 A217 | L162-M213 HydrophobicContact CD2-SD 4.28Å; A166-M213 HydrophobicContact CB-CE 3.93Å; L200-M213 HydrophobicContact CD2-CB 4.44Å; L200-M213 HydrophobicContact CD2-SD 3.73Å; F203-M213 HydrophobicContact CB-CE 4.28Å; F203-M213 HydrophobicContact CB-CG 3.91Å; F203-M213 HydrophobicContact CB-SD 3.65Å; F203-M213 HydrophobicContact CG-SD 4.49Å; A204-M213 HydrophobicContact CB-CB 4.05Å; A204-M213 HydrophobicContact CB-CG 4.21Å; Y209-M213 WeakPolarHBondContact O-CG 3.25Å; Y209-M213 PolarHBondContact O-N 3.29Å; Y210-M213 PolarHBondContact O-N 2.82Å; K211-M213 VanDerWaalsContact C-N 3.33Å; M213-L216 PolarHBondContact O-N 2.98Å; M213-L216 HydrophobicContact SD-CD2 4.47Å; M213-A217 WeakPolarHBondContact O-CB 3.49Å; M213-A217 PolarHBondContact O-N 3.34Å |
| 214 | A | 91.5 | Very high | 85.3 | Confident | 0 Ų | 0 | 35.2 Ų | 35.2 | 0% | 0 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -62.9 | -45.8 | 172.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | Y210 K211 L216 A217 M218 L267 H270 L271 | Y210-A214 WeakPolarHBondContact O-CB 3.38Å; Y210-A214 PolarHBondContact O-N 3.01Å; K211-A214 PolarHBondContact O-N 3.47Å; A214-L216 VanDerWaalsContact C-N 3.29Å; A214-L216 PolarHBondContact O-N 3.36Å; A214-A217 PolarHBondContact O-N 2.91Å; A214-M218 WeakPolarHBondContact O-CG 3.3Å; A214-M218 PolarHBondContact O-N 3.4Å; A214-L267 HydrophobicContact CB-CD1 3.76Å; A214-H270 HydrophobicContact CB-CB 4.32Å; A214-L271 HydrophobicContact CB-CD2 3.85Å; A214-L271 HydrophobicContact CB-CG 4.05Å |
| 215 | N | 89.4 | Confident | 85.6 | Confident | 58 Ų | 58 | 37.8 Ų | 37.8 | 31% | 0.31 | 17% | 0.174 | S | C | . | . | H | α-helix | trans | -62.9 | -37.5 | 176.3 | -69.7 | -31.2 | 0 | 0 | 0 | 111.6 | I172 K211 T212 M218 L219 K274 | I172-N215 HydrophobicContact CD1-CB 4.08Å; K211-N215 WeakPolarHBondContact O-CB 3.48Å; K211-N215 VanDerWaalsContact O-CG 3.26Å; K211-N215 PolarHBondContact O-N 3.25Å; K211-N215 PolarHBondContact O-ND2 3.45Å; T212-N215 PolarHBondContact O-N 3.07Å; N215-M218 PolarHBondContact O-N 2.85Å; N215-L219 WeakPolarHBondContact O-CB 3.44Å; N215-L219 PolarHBondContact O-N 2.93Å; N215-K274 WeakPolarHBondContact OD1-CE 3.49Å |
| 216 | L | 91.4 | Very high | 85.8 | Confident | 0 Ų | 0 | 35 Ų | 35 | 0% | 0 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -65.5 | -42.9 | 174 | -179.7 | 55.7 | 0 | 0 | 0 | 111.5 | L162 A175 A176 L200 T212 M213 A214 M218 L219 L220 | L162-L216 HydrophobicContact CD2-CD2 3.39Å; A175-L216 HydrophobicContact CB-CD1 4.32Å; A175-L216 HydrophobicContact CB-CD2 4.18Å; A176-L216 HydrophobicContact CB-CD1 3.71Å; L200-L216 HydrophobicContact CD2-CB 4.37Å; L200-L216 HydrophobicContact CD2-CD2 3.64Å; L200-L216 HydrophobicContact CD2-CG 4Å; T212-L216 WeakPolarHBondContact O-CB 3.42Å; T212-L216 PolarHBondContact O-N 2.98Å; M213-L216 PolarHBondContact O-N 2.98Å; M213-L216 HydrophobicContact SD-CD2 4.47Å; A214-L216 VanDerWaalsContact C-N 3.29Å; A214-L216 PolarHBondContact O-N 3.36Å; L216-M218 VanDerWaalsContact C-N 3.35Å; L216-M218 PolarHBondContact O-N 3.42Å; L216-L219 PolarHBondContact O-N 3.11Å; L216-L220 HydrophobicContact CD1-CD1 4.28Å; L216-L220 HydrophobicContact CD1-CG 4.25Å; L216-L220 HydrophobicContact CG-CD1 4.11Å; L216-L220 WeakPolarHBondContact O-CB 3.37Å; L216-L220 VanDerWaalsContact O-CG 3.29Å; L216-L220 WeakPolarHBondContact O-CG 3.29Å; L216-L220 PolarHBondContact O-N 3.27Å |
| 217 | A | 92.5 | Very high | 86.2 | Confident | 0 Ų | 0 | 36.2 Ų | 36.2 | 0% | 0 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -61.1 | -42.2 | 175 | 0 | 0 | 0 | 0 | 0 | 112 | L200 M213 A214 L219 L220 D221 F233 M234 F237 | L200-A217 HydrophobicContact CD1-CB 4.48Å; M213-A217 WeakPolarHBondContact O-CB 3.49Å; M213-A217 PolarHBondContact O-N 3.34Å; A214-A217 PolarHBondContact O-N 2.91Å; A217-L219 VanDerWaalsContact C-N 3.34Å; A217-L219 PolarHBondContact O-N 3.19Å; A217-L220 PolarHBondContact O-N 3.06Å; A217-D221 PolarHBondContact O-N 2.82Å; A217-F233 HydrophobicContact CB-CE1 4.25Å; A217-M234 HydrophobicContact CB-CE 4.38Å; A217-F237 HydrophobicContact CB-CD2 4.15Å; A217-F237 HydrophobicContact CB-CE2 3.76Å; A217-F237 HydrophobicContact CB-CZ 4.22Å |
| 218 | M | 91.1 | Very high | 87 | Confident | 45 Ų | 45 | 37 Ų | 37 | 22% | 0.222 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -60.6 | -42.8 | 173.4 | -71.4 | -63.5 | -57.3 | 0 | 0 | 112 | A214 N215 L216 D221 S222 M234 L271 K274 F275 | A214-M218 WeakPolarHBondContact O-CG 3.3Å; A214-M218 PolarHBondContact O-N 3.4Å; N215-M218 PolarHBondContact O-N 2.85Å; L216-M218 VanDerWaalsContact C-N 3.35Å; L216-M218 PolarHBondContact O-N 3.42Å; M218-D221 PolarHBondContact O-N 3Å; M218-S222 PolarHBondContact O-N 3.19Å; M218-M234 HydrophobicContact SD-CE 4.21Å; M218-L271 HydrophobicContact CG-CD2 3.94Å; M218-L271 HydrophobicContact SD-CD2 4.02Å; M218-K274 HydrophobicContact CE-CB 4.38Å; M218-K274 HydrophobicContact CG-CB 4.44Å; M218-K274 HydrophobicContact SD-CB 4.25Å; M218-F275 HydrophobicContact CE-CD1 4.29Å; M218-F275 HydrophobicContact CE-CE1 3.77Å; M218-F275 HydrophobicContact CE-CE2 4.34Å; M218-F275 HydrophobicContact CE-CZ 3.8Å; M218-F275 HydrophobicContact SD-CD2 4.22Å; M218-F275 HydrophobicContact SD-CE1 3.88Å; M218-F275 HydrophobicContact SD-CE2 3.44Å; M218-F275 WeakPolarHBondContact SD-CE2 3.44Å; M218-F275 HydrophobicContact SD-CZ 3.24Å; M218-F275 WeakPolarHBondContact SD-CZ 3.39Å |
| 219 | L | 88.7 | Confident | 87.6 | Confident | 29 Ų | 29 | 35 Ų | 35 | 15% | 0.152 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -67 | -38.9 | 178.3 | -176 | 58.1 | 0 | 0 | 0 | 111.5 | I172 A176 N215 L216 A217 D221 S222 R223 | I172-L219 HydrophobicContact CG2-CD2 3.62Å; A176-L219 HydrophobicContact CB-CB 4.49Å; A176-L219 HydrophobicContact CB-CD2 3.41Å; A176-L219 VanDerWaalsContact CB-CD2 3.41Å; A176-L219 HydrophobicContact CB-CG 3.75Å; N215-L219 WeakPolarHBondContact O-CB 3.44Å; N215-L219 PolarHBondContact O-N 2.93Å; L216-L219 PolarHBondContact O-N 3.11Å; A217-L219 VanDerWaalsContact C-N 3.34Å; A217-L219 PolarHBondContact O-N 3.19Å; L219-D221 VanDerWaalsContact C-N 3.34Å; L219-S222 PolarHBondContact O-N 3.11Å; L219-S222 PolarHBondContact O-OG 3.39Å; L219-R223 WeakPolarHBondContact O-CD 3.34Å; L219-R223 WeakPolarHBondContact O-CG 3.25Å; L219-R223 PolarHBondContact O-N 3.07Å |
| 220 | L | 89.2 | Confident | 87.9 | Confident | 0 Ų | 0 | 41.8 Ų | 41.8 | 0% | 0 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -65.4 | -36.8 | 175.1 | -71.5 | 167.8 | 0 | 0 | 0 | 112 | A176 L179 L200 L216 A217 S222 R223 I224 F233 | A176-L220 HydrophobicContact CB-CD2 4.38Å; L179-L220 HydrophobicContact CB-CD1 4.23Å; L179-L220 HydrophobicContact CB-CD2 3.69Å; L179-L220 HydrophobicContact CD2-CD1 3.79Å; L200-L220 HydrophobicContact CD1-CD1 4.02Å; L216-L220 HydrophobicContact CD1-CD1 4.28Å; L216-L220 HydrophobicContact CD1-CG 4.25Å; L216-L220 HydrophobicContact CG-CD1 4.11Å; L216-L220 WeakPolarHBondContact O-CB 3.37Å; L216-L220 VanDerWaalsContact O-CG 3.29Å; L216-L220 WeakPolarHBondContact O-CG 3.29Å; L216-L220 PolarHBondContact O-N 3.27Å; A217-L220 PolarHBondContact O-N 3.06Å; L220-S222 VanDerWaalsContact C-N 3.28Å; L220-S222 PolarHBondContact O-N 2.55Å; L220-R223 PolarHBondContact O-N 3.18Å; L220-I224 HydrophobicContact CB-CD1 4.24Å; L220-I224 HydrophobicContact CD2-CD1 3.7Å; L220-I224 PolarHBondContact O-N 2.82Å; L220-F233 HydrophobicContact CB-CD1 3.73Å; L220-F233 HydrophobicContact CB-CD2 4.09Å; L220-F233 HydrophobicContact CB-CE1 3.88Å; L220-F233 HydrophobicContact CB-CE2 4.22Å; L220-F233 HydrophobicContact CB-CG 3.85Å; L220-F233 HydrophobicContact CB-CZ 4.13Å; L220-F233 HydrophobicContact CD1-CE1 4.01Å; L220-F233 HydrophobicContact CD1-CE2 4.08Å; L220-F233 HydrophobicContact CD1-CZ 3.67Å |
| 221 | D | 91.2 | Very high | 88 | Confident | 10 Ų | 10 | 44.1 Ų | 44.1 | 5% | 0.053 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -61.2 | -35.9 | 173.8 | -169.5 | 55.3 | 0 | 0 | 0 | 113.3 | A217 M218 L219 R223 S232 F233 M234 | A217-D221 PolarHBondContact O-N 2.82Å; M218-D221 PolarHBondContact O-N 3Å; L219-D221 VanDerWaalsContact C-N 3.34Å; D221-R223 PolarHBondContact O-N 3.5Å; D221-S232 WeakPolarHBondContact OD1-CB 3.21Å; D221-S232 PolarHBondContact OD1-OG 2.98Å; D221-F233 HydrophobicContact CB-CB 4.3Å; D221-M234 HydrophobicContact CB-CB 4.13Å; D221-M234 HydrophobicContact CB-CE 3.92Å; D221-M234 VanDerWaalsContact CG-CB 3.42Å; D221-M234 WeakPolarHBondContact OD1-CB 3.39Å; D221-M234 PolarHBondContact OD1-N 3.43Å |
| 222 | S | 85.7 | Confident | 88 | Confident | 57 Ų | 57 | 40.8 Ų | 40.8 | 40% | 0.399 | 21% | 0.205 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -71.5 | -13.2 | 173.9 | 73.9 | 0 | 0 | 0 | 0 | 114.4 | M218 L219 L220 | M218-S222 PolarHBondContact O-N 3.19Å; L219-S222 PolarHBondContact O-N 3.11Å; L219-S222 PolarHBondContact O-OG 3.39Å; L220-S222 VanDerWaalsContact C-N 3.28Å; L220-S222 PolarHBondContact O-N 2.55Å |
| 223 | R | 84.5 | Confident | 88.2 | Confident | 61 Ų | 61 | 40 Ų | 40 | 23% | 0.23 | 20% | 0.2 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -113.2 | -33.9 | -170.9 | -71.7 | 168.2 | 174.3 | -105.1 | 3.8 | 113.8 | E180 L219 L220 D221 | E180-R223 HydrophobicContact CG-CB 4.33Å; E180-R223 WeakPolarHBondContact OE2-CD 3.47Å; E180-R223 IonicContact OE2-CZ 3.13Å; E180-R223 IonicContact OE2-NH1 3.66Å; E180-R223 PolarHBondContact OE2-NH1 3.43Å; L219-R223 WeakPolarHBondContact O-CD 3.34Å; L219-R223 WeakPolarHBondContact O-CG 3.25Å; L219-R223 PolarHBondContact O-N 3.07Å; L220-R223 PolarHBondContact O-N 3.18Å; D221-R223 PolarHBondContact O-N 3.5Å |
| 224 | I | 86.6 | Confident | 88.4 | Confident | 1 Ų | 1 | 39.9 Ų | 39.9 | 1% | 0.005 | 20% | 0.199 | C | C | . | . | trans | -110.2 | 115.1 | -171.6 | -60.4 | 168.4 | 0 | 0 | 0 | 109.1 | E180 C183 L184 I193 L220 I226 F233 | E180-I224 HydrophobicContact CB-CG1 4.38Å; E180-I224 HydrophobicContact CG-CG1 4.25Å; C183-I224 HydrophobicContact CB-CD1 3.81Å; L184-I224 HydrophobicContact CD2-CG2 4.17Å; I193-I224 HydrophobicContact CD1-CG2 4.15Å; L220-I224 HydrophobicContact CB-CD1 4.24Å; L220-I224 HydrophobicContact CD2-CD1 3.7Å; L220-I224 PolarHBondContact O-N 2.82Å; I224-I226 HydrophobicContact CG2-CD1 4.4Å; I224-F233 HydrophobicContact CB-CB 4.15Å; I224-F233 HydrophobicContact CB-CD2 4.45Å; I224-F233 HydrophobicContact CD1-CD2 3.82Å; I224-F233 HydrophobicContact CD1-CE2 4.31Å; I224-F233 HydrophobicContact CG2-CB 4.49Å; I224-F233 HydrophobicContact CG2-CD2 4.47Å; I224-F233 PolarHBondContact O-N 2.76Å | ||
| 225 | Y | 87 | Confident | 88.4 | Confident | 56 Ų | 56 | 41.3 Ų | 41.3 | 22% | 0.22 | 21% | 0.207 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -136.3 | 125 | 170.8 | -172.3 | -97.7 | 0 | 0 | 0 | 109.8 | F227 R230 | Y225-F227 AromaticContact CD1-CD1 3.91Å; Y225-F227 HydrophobicContact CD1-CD1 3.91Å; Y225-F227 AromaticContact CD1-CD2 3.83Å; Y225-F227 HydrophobicContact CD1-CD2 3.83Å; Y225-F227 AromaticContact CD1-CE1 3.94Å; Y225-F227 HydrophobicContact CD1-CE1 3.94Å; Y225-F227 AromaticContact CD1-CE2 3.84Å; Y225-F227 HydrophobicContact CD1-CE2 3.84Å; Y225-F227 AromaticContact CD1-CG 3.86Å; Y225-F227 HydrophobicContact CD1-CG 3.86Å; Y225-F227 AromaticContact CD1-CZ 3.91Å; Y225-F227 HydrophobicContact CD1-CZ 3.91Å; Y225-F227 AromaticContact CE1-CD1 3.8Å; Y225-F227 HydrophobicContact CE1-CD1 3.8Å; Y225-F227 HydrophobicContact CE1-CD2 4.49Å; Y225-F227 HydrophobicContact CE1-CE1 4.01Å; Y225-F227 HydrophobicContact CE1-CG 4.06Å; Y225-F227 HydrophobicContact CE1-CZ 4.44Å; Y225-F227 PolarHBondContact O-N 2.94Å; Y225-R230 VanDerWaalsContact OH-C 3.3Å; Y225-R230 WeakPolarHBondContact OH-CA 2.99Å; Y225-R230 WeakPolarHBondContact OH-CB 3.5Å; Y225-R230 PolarHBondContact OH-O 3.16Å |
| 226 | I | 86.2 | Confident | 88.5 | Confident | 8 Ų | 8 | 38.6 Ų | 38.6 | 4% | 0.041 | 19% | 0.192 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -95.1 | 94.7 | 179.4 | -53.4 | -54.8 | 0 | 0 | 0 | 108.5 | L184 H189 I193 I224 A228 E229 R230 K231 Y236 | L184-I226 HydrophobicContact CD2-CD1 3.69Å; H189-I226 HydrophobicContact CB-CD1 3.95Å; H189-I226 HydrophobicContact CB-CG1 4.2Å; I193-I226 HydrophobicContact CD1-CD1 4.07Å; I193-I226 HydrophobicContact CD1-CG1 3.82Å; I224-I226 HydrophobicContact CG2-CD1 4.4Å; I226-A228 VanDerWaalsContact C-N 3.26Å; I226-A228 PolarHBondContact O-N 2.7Å; I226-E229 HydrophobicContact CB-CB 4.4Å; I226-E229 HydrophobicContact CG2-CB 4.04Å; I226-E229 HydrophobicContact CG2-CG 3.96Å; I226-E229 CarbonylContact O-C 3.31Å; I226-E229 PolarHBondContact O-N 2.67Å; I226-R230 PolarHBondContact O-N 3.07Å; I226-K231 PolarHBondContact N-O 2.92Å; I226-K231 PolarHBondContact O-N 3.45Å; I226-Y236 HydrophobicContact CG1-CE2 3.99Å |
| 227 | F | 82 | Confident | 88.7 | Confident | 73 Ų | 73 | 38.7 Ų | 38.7 | 32% | 0.32 | 19% | 0.193 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -56.6 | -36.8 | -175.4 | -79.5 | -86.2 | 0 | 0 | 0 | 114.2 | R28 G30 P32 Y225 E229 R230 | R28-F227 HydrophobicContact CB-CE2 4.49Å; R28-F227 WeakPolarHBondContact O-CE2 3.49Å; G30-F227 WeakPolarHBondContact O-CZ 3.19Å; P32-F227 HydrophobicContact CG-CE1 4.17Å; Y225-F227 AromaticContact CD1-CD1 3.91Å; Y225-F227 HydrophobicContact CD1-CD1 3.91Å; Y225-F227 AromaticContact CD1-CD2 3.83Å; Y225-F227 HydrophobicContact CD1-CD2 3.83Å; Y225-F227 AromaticContact CD1-CE1 3.94Å; Y225-F227 HydrophobicContact CD1-CE1 3.94Å; Y225-F227 AromaticContact CD1-CE2 3.84Å; Y225-F227 HydrophobicContact CD1-CE2 3.84Å; Y225-F227 AromaticContact CD1-CG 3.86Å; Y225-F227 HydrophobicContact CD1-CG 3.86Å; Y225-F227 AromaticContact CD1-CZ 3.91Å; Y225-F227 HydrophobicContact CD1-CZ 3.91Å; Y225-F227 AromaticContact CE1-CD1 3.8Å; Y225-F227 HydrophobicContact CE1-CD1 3.8Å; Y225-F227 HydrophobicContact CE1-CD2 4.49Å; Y225-F227 HydrophobicContact CE1-CE1 4.01Å; Y225-F227 HydrophobicContact CE1-CG 4.06Å; Y225-F227 HydrophobicContact CE1-CZ 4.44Å; Y225-F227 PolarHBondContact O-N 2.94Å; F227-E229 VanDerWaalsContact C-N 3.25Å; F227-E229 PolarHBondContact O-N 3.12Å; F227-R230 PolarHBondContact O-N 3.19Å |
| 228 | A | 84.4 | Confident | 88.8 | Confident | 101 Ų | 101 | 40.8 Ų | 40.8 | 84% | 0.835 | 20% | 0.201 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -63.4 | -33.6 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | I226 | I226-A228 VanDerWaalsContact C-N 3.26Å; I226-A228 PolarHBondContact O-N 2.7Å |
| 229 | E | 84.9 | Confident | 88.8 | Confident | 83 Ų | 83 | 42.2 Ų | 42.2 | 39% | 0.388 | 21% | 0.207 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -99.3 | -12.2 | -177.7 | -64.4 | -179 | -138 | 0 | 0 | 112.7 | I226 F227 K231 Y236 | I226-E229 HydrophobicContact CB-CB 4.4Å; I226-E229 HydrophobicContact CG2-CB 4.04Å; I226-E229 HydrophobicContact CG2-CG 3.96Å; I226-E229 CarbonylContact O-C 3.31Å; I226-E229 PolarHBondContact O-N 2.67Å; F227-E229 VanDerWaalsContact C-N 3.25Å; F227-E229 PolarHBondContact O-N 3.12Å; E229-K231 HydrophobicContact CB-CB 4.32Å; E229-K231 HydrophobicContact CB-CD 4.45Å; E229-K231 HydrophobicContact CB-CG 4.22Å; E229-K231 PolarHBondContact O-N 3.42Å; E229-Y236 PolarHBondContact OE1-OH 2.93Å; E229-Y236 PolarHBondContact OE2-OH 3.31Å |
| 230 | R | 86.7 | Confident | 88.9 | Confident | 198 Ų | 198 | 42.2 Ų | 42.2 | 75% | 0.747 | 21% | 0.205 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 56.6 | 30.9 | -171.3 | -56.9 | -177.2 | 176 | -167.8 | -2.2 | 113.6 | Y225 I226 F227 | Y225-R230 VanDerWaalsContact OH-C 3.3Å; Y225-R230 WeakPolarHBondContact OH-CA 2.99Å; Y225-R230 WeakPolarHBondContact OH-CB 3.5Å; Y225-R230 PolarHBondContact OH-O 3.16Å; I226-R230 PolarHBondContact O-N 3.07Å; F227-R230 PolarHBondContact O-N 3.19Å |
| 231 | K | 88.1 | Confident | 88.9 | Confident | 52 Ų | 52 | 42.2 Ų | 42.2 | 23% | 0.226 | 21% | 0.205 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -110.2 | 133.5 | -178.7 | -71.3 | -173.2 | -179.2 | -172.7 | 0 | 111.6 | I226 E229 D235 Y236 E239 | I226-K231 PolarHBondContact N-O 2.92Å; I226-K231 PolarHBondContact O-N 3.45Å; E229-K231 HydrophobicContact CB-CB 4.32Å; E229-K231 HydrophobicContact CB-CD 4.45Å; E229-K231 HydrophobicContact CB-CG 4.22Å; E229-K231 PolarHBondContact O-N 3.42Å; K231-D235 VanDerWaalsContact CA-OD2 3.29Å; K231-D235 WeakPolarHBondContact CA-OD2 3.16Å; K231-D235 HydrophobicContact CB-CB 3.97Å; K231-D235 HydrophobicContact CD-CB 4.44Å; K231-D235 HydrophobicContact CG-CB 4.13Å; K231-Y236 HydrophobicContact CB-CD2 4.25Å; K231-Y236 HydrophobicContact CB-CE2 3.55Å; K231-Y236 HydrophobicContact CD-CD1 4.49Å; K231-Y236 HydrophobicContact CD-CE1 3.97Å; K231-Y236 HydrophobicContact CD-CE2 4.19Å; K231-E239 WeakPolarHBondContact CE-OE1 3.31Å; K231-E239 VanDerWaalsContact NZ-CD 3.25Å; K231-E239 IonicContact NZ-OE1 2.83Å; K231-E239 PolarHBondContact NZ-OE1 3.43Å; K231-E239 IonicContact NZ-OE2 3.86Å; K231-E239 PolarHBondContact NZ-OE2 3.17Å |
| 232 | S | 89.9 | Confident | 88.8 | Confident | 5 Ų | 5 | 43.2 Ų | 43.2 | 4% | 0.035 | 21% | 0.214 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -82.7 | 168.9 | 166.4 | 83.6 | 0 | 0 | 0 | 0 | 111 | D221 M234 D235 Y236 | D221-S232 WeakPolarHBondContact OD1-CB 3.21Å; D221-S232 PolarHBondContact OD1-OG 2.98Å; S232-M234 PolarHBondContact O-N 2.84Å; S232-M234 PolarHBondContact OG-N 3.4Å; S232-D235 PolarHBondContact N-OD2 2.87Å; S232-D235 WeakPolarHBondContact O-CB 3.47Å; S232-D235 PolarHBondContact O-N 2.85Å; S232-D235 VanDerWaalsContact O-N 3.09Å; S232-D235 PolarHBondContact OG-N 3.33Å; S232-Y236 WeakPolarHBondContact O-CD2 3.19Å; S232-Y236 PolarHBondContact O-N 2.88Å |
| 233 | F | 91.5 | Very high | 88.8 | Confident | 0 Ų | 0 | 44.7 Ų | 44.7 | 0% | 0 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -53.4 | -41 | 172 | -171.9 | -99.8 | 0 | 0 | 0 | 112.4 | I193 I197 L200 A217 L220 D221 I224 D235 Y236 F237 | I193-F233 HydrophobicContact CG2-CD2 3.96Å; I193-F233 HydrophobicContact CG2-CE2 3.96Å; I197-F233 HydrophobicContact CD1-CZ 4.47Å; I197-F233 HydrophobicContact CG1-CE1 4.3Å; I197-F233 HydrophobicContact CG1-CE2 4.09Å; I197-F233 HydrophobicContact CG1-CZ 3.67Å; L200-F233 HydrophobicContact CD1-CE1 4.08Å; L200-F233 HydrophobicContact CD1-CZ 3.74Å; A217-F233 HydrophobicContact CB-CE1 4.25Å; L220-F233 HydrophobicContact CB-CD1 3.73Å; L220-F233 HydrophobicContact CB-CD2 4.09Å; L220-F233 HydrophobicContact CB-CE1 3.88Å; L220-F233 HydrophobicContact CB-CE2 4.22Å; L220-F233 HydrophobicContact CB-CG 3.85Å; L220-F233 HydrophobicContact CB-CZ 4.13Å; L220-F233 HydrophobicContact CD1-CE1 4.01Å; L220-F233 HydrophobicContact CD1-CE2 4.08Å; L220-F233 HydrophobicContact CD1-CZ 3.67Å; D221-F233 HydrophobicContact CB-CB 4.3Å; I224-F233 HydrophobicContact CB-CB 4.15Å; I224-F233 HydrophobicContact CB-CD2 4.45Å; I224-F233 HydrophobicContact CD1-CD2 3.82Å; I224-F233 HydrophobicContact CD1-CE2 4.31Å; I224-F233 HydrophobicContact CG2-CB 4.49Å; I224-F233 HydrophobicContact CG2-CD2 4.47Å; I224-F233 PolarHBondContact O-N 2.76Å; F233-D235 VanDerWaalsContact C-N 3.26Å; F233-D235 PolarHBondContact O-N 2.85Å; F233-Y236 PolarHBondContact O-N 3.47Å; F233-F237 AromaticContact CE1-CD2 3.83Å; F233-F237 HydrophobicContact CE1-CD2 3.83Å; F233-F237 HydrophobicContact CZ-CD2 4.49Å; F233-F237 WeakPolarHBondContact O-CB 3.38Å; F233-F237 PolarHBondContact O-N 2.79Å |
| 234 | M | 93.6 | Very high | 88.6 | Confident | 0 Ų | 0 | 43.5 Ų | 43.5 | 0% | 0 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -68 | -25.7 | -178.9 | -160.2 | 62.9 | 53 | 0 | 0 | 112.4 | A217 M218 D221 S232 F237 R238 F275 F285 | A217-M234 HydrophobicContact CB-CE 4.38Å; M218-M234 HydrophobicContact SD-CE 4.21Å; D221-M234 HydrophobicContact CB-CB 4.13Å; D221-M234 HydrophobicContact CB-CE 3.92Å; D221-M234 VanDerWaalsContact CG-CB 3.42Å; D221-M234 WeakPolarHBondContact OD1-CB 3.39Å; D221-M234 PolarHBondContact OD1-N 3.43Å; S232-M234 PolarHBondContact O-N 2.84Å; S232-M234 PolarHBondContact OG-N 3.4Å; M234-F237 PolarHBondContact O-N 2.9Å; M234-F237 HydrophobicContact SD-CB 3.92Å; M234-F237 HydrophobicContact SD-CD1 3.94Å; M234-F237 HydrophobicContact SD-CG 4.05Å; M234-R238 WeakPolarHBondContact O-CB 3.49Å; M234-R238 VanDerWaalsContact O-CG 3.26Å; M234-R238 WeakPolarHBondContact O-CG 3.44Å; M234-R238 PolarHBondContact O-N 3.39Å; M234-F275 HydrophobicContact CE-CE2 4.37Å; M234-F275 HydrophobicContact CE-CZ 3.93Å; M234-F275 HydrophobicContact CG-CE2 4.46Å; M234-F275 HydrophobicContact CG-CZ 3.93Å; M234-F275 HydrophobicContact SD-CE2 4.26Å; M234-F275 HydrophobicContact SD-CZ 4.11Å; M234-F285 HydrophobicContact CG-CE2 4.23Å; M234-F285 HydrophobicContact CG-CZ 4.3Å; M234-F285 HydrophobicContact SD-CE2 3.72Å; M234-F285 HydrophobicContact SD-CZ 3.52Å; M234-F285 VanDerWaalsContact SD-CZ 3.52Å |
| 235 | D | 91.3 | Very high | 88.3 | Confident | 31 Ų | 31 | 44.3 Ų | 44.3 | 17% | 0.166 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -62.9 | -49.4 | 171.8 | -65.4 | -38.6 | 0 | 0 | 0 | 111 | K231 S232 F233 F237 R238 E239 | K231-D235 VanDerWaalsContact CA-OD2 3.29Å; K231-D235 WeakPolarHBondContact CA-OD2 3.16Å; K231-D235 HydrophobicContact CB-CB 3.97Å; K231-D235 HydrophobicContact CD-CB 4.44Å; K231-D235 HydrophobicContact CG-CB 4.13Å; S232-D235 PolarHBondContact N-OD2 2.87Å; S232-D235 WeakPolarHBondContact O-CB 3.47Å; S232-D235 PolarHBondContact O-N 2.85Å; S232-D235 VanDerWaalsContact O-N 3.09Å; S232-D235 PolarHBondContact OG-N 3.33Å; F233-D235 VanDerWaalsContact C-N 3.26Å; F233-D235 PolarHBondContact O-N 2.85Å; D235-F237 VanDerWaalsContact C-N 3.33Å; D235-F237 PolarHBondContact O-N 3.32Å; D235-R238 PolarHBondContact O-N 2.88Å; D235-R238 IonicContact OD1-CZ 3.5Å; D235-R238 IonicContact OD1-NE 3.63Å; D235-R238 IonicContact OD1-NH2 3.19Å; D235-R238 PolarHBondContact OD1-NH2 3.3Å; D235-E239 WeakPolarHBondContact O-CG 3.46Å; D235-E239 PolarHBondContact O-N 3.12Å; D235-E239 VanDerWaalsContact O-N 3.07Å |
| 236 | Y | 92.7 | Very high | 87.8 | Confident | 0 Ų | 0 | 48.3 Ų | 48.3 | 0% | 0 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -62.2 | -43.4 | 172.5 | -61.5 | -84.5 | 0 | 0 | 0 | 110.8 | D190 I193 I226 E229 K231 S232 F233 R238 E239 W240 | D190-Y236 HydrophobicContact CB-CE1 4.21Å; D190-Y236 WeakPolarHBondContact OD1-CD1 3.25Å; D190-Y236 WeakPolarHBondContact OD1-CE1 3.48Å; I193-Y236 HydrophobicContact CB-CG 4.44Å; I193-Y236 HydrophobicContact CD1-CD2 3.87Å; I193-Y236 HydrophobicContact CD1-CE2 3.67Å; I193-Y236 HydrophobicContact CD1-CG 4.43Å; I193-Y236 HydrophobicContact CG2-CD1 4.35Å; I193-Y236 HydrophobicContact CG2-CD2 3.9Å; I193-Y236 HydrophobicContact CG2-CG 3.68Å; I226-Y236 HydrophobicContact CG1-CE2 3.99Å; E229-Y236 PolarHBondContact OE1-OH 2.93Å; E229-Y236 PolarHBondContact OE2-OH 3.31Å; K231-Y236 HydrophobicContact CB-CD2 4.25Å; K231-Y236 HydrophobicContact CB-CE2 3.55Å; K231-Y236 HydrophobicContact CD-CD1 4.49Å; K231-Y236 HydrophobicContact CD-CE1 3.97Å; K231-Y236 HydrophobicContact CD-CE2 4.19Å; S232-Y236 WeakPolarHBondContact O-CD2 3.19Å; S232-Y236 PolarHBondContact O-N 2.88Å; F233-Y236 PolarHBondContact O-N 3.47Å; Y236-R238 VanDerWaalsContact C-N 3.27Å; Y236-R238 PolarHBondContact O-N 3.44Å; Y236-E239 PolarHBondContact O-N 3.17Å; Y236-E239 VanDerWaalsContact O-N 3.1Å; Y236-W240 PolarHBondContact O-N 3.08Å |
| 237 | F | 94.6 | Very high | 86.6 | Confident | 2 Ų | 2 | 53.9 Ų | 53.9 | 1% | 0.009 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -57.5 | -41.2 | 179.5 | -163.9 | -83.3 | 0 | 0 | 0 | 112.1 | I197 L200 F201 A217 F233 M234 D235 T241 L267 L271 F285 | I197-F237 HydrophobicContact CD1-CB 4.35Å; I197-F237 HydrophobicContact CG1-CD2 4.07Å; I197-F237 HydrophobicContact CG2-CD2 3.98Å; I197-F237 HydrophobicContact CG2-CE2 4.29Å; L200-F237 HydrophobicContact CD1-CE2 4.36Å; F201-F237 HydrophobicContact CD1-CE2 4.5Å; F201-F237 HydrophobicContact CD1-CZ 4.23Å; F201-F237 AromaticContact CE1-CE1 3.81Å; F201-F237 HydrophobicContact CE1-CE1 3.81Å; F201-F237 AromaticContact CE1-CE2 3.84Å; F201-F237 HydrophobicContact CE1-CE2 3.84Å; F201-F237 AromaticContact CE1-CZ 3.41Å; F201-F237 HydrophobicContact CE1-CZ 3.41Å; F201-F237 VanDerWaalsContact CE1-CZ 3.41Å; F201-F237 HydrophobicContact CZ-CE1 4.27Å; F201-F237 HydrophobicContact CZ-CE2 4.47Å; F201-F237 HydrophobicContact CZ-CZ 4.19Å; A217-F237 HydrophobicContact CB-CD2 4.15Å; A217-F237 HydrophobicContact CB-CE2 3.76Å; A217-F237 HydrophobicContact CB-CZ 4.22Å; F233-F237 AromaticContact CE1-CD2 3.83Å; F233-F237 HydrophobicContact CE1-CD2 3.83Å; F233-F237 HydrophobicContact CZ-CD2 4.49Å; F233-F237 WeakPolarHBondContact O-CB 3.38Å; F233-F237 PolarHBondContact O-N 2.79Å; M234-F237 PolarHBondContact O-N 2.9Å; M234-F237 HydrophobicContact SD-CB 3.92Å; M234-F237 HydrophobicContact SD-CD1 3.94Å; M234-F237 HydrophobicContact SD-CG 4.05Å; D235-F237 VanDerWaalsContact C-N 3.33Å; D235-F237 PolarHBondContact O-N 3.32Å; F237-T241 VanDerWaalsContact O-CB 3.31Å; F237-T241 WeakPolarHBondContact O-CB 3.42Å; F237-T241 PolarHBondContact O-N 3.23Å; F237-T241 PolarHBondContact O-OG1 2.89Å; F237-L267 HydrophobicContact CE1-CD2 4.5Å; F237-L267 HydrophobicContact CZ-CD2 3.91Å; F237-L271 HydrophobicContact CD1-CD1 4.41Å; F237-L271 HydrophobicContact CE1-CD1 3.58Å; F237-L271 HydrophobicContact CZ-CD1 4.05Å; F237-F285 HydrophobicContact CD1-CE1 4.02Å; F237-F285 AromaticContact CD1-CZ 3.88Å; F237-F285 HydrophobicContact CD1-CZ 3.88Å; F237-F285 HydrophobicContact CE1-CE1 4.1Å; F237-F285 HydrophobicContact CE1-CZ 4.23Å |
| 238 | R | 94.2 | Very high | 85.5 | Confident | 45 Ų | 45 | 50.8 Ų | 50.8 | 17% | 0.17 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -64.3 | -46.2 | 174 | -73 | -170.3 | -66.1 | 167.3 | -4.1 | 111.7 | M234 D235 Y236 W240 T241 A242 E280 N281 F284 F285 | M234-R238 WeakPolarHBondContact O-CB 3.49Å; M234-R238 VanDerWaalsContact O-CG 3.26Å; M234-R238 WeakPolarHBondContact O-CG 3.44Å; M234-R238 PolarHBondContact O-N 3.39Å; D235-R238 PolarHBondContact O-N 2.88Å; D235-R238 IonicContact OD1-CZ 3.5Å; D235-R238 IonicContact OD1-NE 3.63Å; D235-R238 IonicContact OD1-NH2 3.19Å; D235-R238 PolarHBondContact OD1-NH2 3.3Å; Y236-R238 VanDerWaalsContact C-N 3.27Å; Y236-R238 PolarHBondContact O-N 3.44Å; R238-W240 VanDerWaalsContact C-N 3.35Å; R238-W240 PolarHBondContact O-N 3.07Å; R238-T241 WeakPolarHBondContact O-CB 3.44Å; R238-T241 PolarHBondContact O-N 3.22Å; R238-A242 WeakPolarHBondContact O-CB 3.2Å; R238-A242 PolarHBondContact O-N 3.42Å; R238-E280 IonicContact NH1-OE2 2.61Å; R238-E280 PolarHBondContact NH1-OE2 2.96Å; R238-E280 IonicContact NH2-OE2 3.02Å; R238-N281 VanDerWaalsContact CD-OD1 3.27Å; R238-N281 WeakPolarHBondContact CD-OD1 3.34Å; R238-N281 PolarHBondContact NE-OD1 2.86Å; R238-N281 VanDerWaalsContact NE-OD1 3.12Å; R238-F284 HydrophobicContact CB-CD1 4.11Å; R238-F284 HydrophobicContact CB-CE1 3.82Å; R238-F284 HydrophobicContact CB-CE2 4.41Å; R238-F284 HydrophobicContact CB-CZ 3.98Å; R238-F284 HydrophobicContact CG-CD1 3.55Å; R238-F284 HydrophobicContact CG-CE1 3.71Å; R238-F284 HydrophobicContact CG-CG 4.05Å; R238-F284 HydrophobicContact CG-CZ 4.33Å; R238-F284 VanDerWaalsContact O-CZ 3.3Å; R238-F284 WeakPolarHBondContact O-CZ 3.47Å; R238-F285 HydrophobicContact CG-CZ 4.04Å |
| 239 | E | 91.6 | Very high | 84 | Confident | 74 Ų | 74 | 50.5 Ų | 50.5 | 35% | 0.346 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -58.4 | -46.6 | 177.8 | -72.7 | 174.9 | -176.2 | 0 | 0 | 111.6 | K231 D235 Y236 A242 Q243 | K231-E239 WeakPolarHBondContact CE-OE1 3.31Å; K231-E239 VanDerWaalsContact NZ-CD 3.25Å; K231-E239 IonicContact NZ-OE1 2.83Å; K231-E239 PolarHBondContact NZ-OE1 3.43Å; K231-E239 IonicContact NZ-OE2 3.86Å; K231-E239 PolarHBondContact NZ-OE2 3.17Å; D235-E239 WeakPolarHBondContact O-CG 3.46Å; D235-E239 PolarHBondContact O-N 3.12Å; D235-E239 VanDerWaalsContact O-N 3.07Å; Y236-E239 PolarHBondContact O-N 3.17Å; Y236-E239 VanDerWaalsContact O-N 3.1Å; E239-A242 PolarHBondContact O-N 3.07Å; E239-Q243 WeakPolarHBondContact O-CG 3.41Å; E239-Q243 PolarHBondContact O-N 3.33Å |
| 240 | W | 90.1 | Very high | 82.4 | Confident | 29 Ų | 29 | 55 Ų | 55 | 11% | 0.11 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -67.2 | -37.3 | 176.3 | -79.4 | 89.6 | 0 | 0 | 0 | 112.6 | G194 I197 R198 F201 Y236 R238 E244 | G194-W240 VanDerWaalsContact CA-NE1 3.35Å; I197-W240 HydrophobicContact CB-CG 4.41Å; I197-W240 HydrophobicContact CD1-CB 4.44Å; I197-W240 HydrophobicContact CD1-CG 4.13Å; I197-W240 HydrophobicContact CG2-CB 3.7Å; I197-W240 HydrophobicContact CG2-CG 4.09Å; R198-W240 HydrophobicContact CG-CE3 4.07Å; R198-W240 HydrophobicContact CG-CH2 4.37Å; R198-W240 HydrophobicContact CG-CZ3 3.81Å; R198-W240 VanDerWaalsContact NH2-CZ3 3.29Å; F201-W240 HydrophobicContact CE2-CB 4.2Å; Y236-W240 PolarHBondContact O-N 3.08Å; R238-W240 VanDerWaalsContact C-N 3.35Å; R238-W240 PolarHBondContact O-N 3.07Å; W240-E244 WeakPolarHBondContact O-CB 3.49Å; W240-E244 VanDerWaalsContact O-CG 3.26Å; W240-E244 WeakPolarHBondContact O-CG 3.26Å; W240-E244 PolarHBondContact O-N 3.23Å |
| 241 | T | 90.9 | Very high | 80.8 | Confident | 0 Ų | 0 | 48.2 Ų | 48.2 | 0% | 0 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -61.7 | -44.8 | 173.1 | -59.5 | 0 | 0 | 0 | 0 | 110.7 | F201 F237 R238 E244 V245 L264 F284 V288 | F201-T241 WeakPolarHBondContact CZ-OG1 3.25Å; F237-T241 VanDerWaalsContact O-CB 3.31Å; F237-T241 WeakPolarHBondContact O-CB 3.42Å; F237-T241 PolarHBondContact O-N 3.23Å; F237-T241 PolarHBondContact O-OG1 2.89Å; R238-T241 WeakPolarHBondContact O-CB 3.44Å; R238-T241 PolarHBondContact O-N 3.22Å; T241-E244 WeakPolarHBondContact O-CB 3.44Å; T241-E244 PolarHBondContact O-N 3.03Å; T241-V245 VanDerWaalsContact O-CG2 3.29Å; T241-V245 WeakPolarHBondContact O-CG2 3.29Å; T241-V245 PolarHBondContact O-N 2.86Å; T241-L264 HydrophobicContact CG2-CD1 4.49Å; T241-L264 HydrophobicContact CG2-CD2 4.13Å; T241-F284 HydrophobicContact CG2-CE1 3.92Å; T241-F284 HydrophobicContact CG2-CZ 4.18Å; T241-V288 HydrophobicContact CG2-CG1 4.16Å; T241-V288 HydrophobicContact CG2-CG2 4.23Å |
| 242 | A | 88.8 | Confident | 79.2 | Confident | 31 Ų | 31 | 46.6 Ų | 46.6 | 26% | 0.256 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -63.8 | -47.4 | 179 | 0 | 0 | 0 | 0 | 0 | 111.5 | R238 E239 E244 V245 E246 F284 | R238-A242 WeakPolarHBondContact O-CB 3.2Å; R238-A242 PolarHBondContact O-N 3.42Å; E239-A242 PolarHBondContact O-N 3.07Å; A242-E244 VanDerWaalsContact C-N 3.28Å; A242-E244 PolarHBondContact O-N 2.99Å; A242-V245 CarbonylContact O-C 3.6Å; A242-V245 PolarHBondContact O-N 2.68Å; A242-E246 PolarHBondContact O-N 3.22Å; A242-F284 HydrophobicContact CB-CE2 4.31Å; A242-F284 HydrophobicContact CB-CZ 4.17Å |
| 243 | Q | 84.8 | Confident | 77.6 | Confident | 88 Ų | 88 | 50.5 Ų | 50.5 | 41% | 0.411 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -56.6 | -45.2 | 174.5 | -73.3 | 175.7 | 20.5 | 0 | 0 | 111.5 | E239 V245 E246 I247 | E239-Q243 WeakPolarHBondContact O-CG 3.41Å; E239-Q243 PolarHBondContact O-N 3.33Å; Q243-V245 VanDerWaalsContact C-N 3.28Å; Q243-V245 PolarHBondContact O-N 2.96Å; Q243-E246 PolarHBondContact O-N 2.79Å; Q243-I247 WeakPolarHBondContact O-CD1 3.28Å; Q243-I247 VanDerWaalsContact O-CG1 3.3Å; Q243-I247 WeakPolarHBondContact O-CG1 2.95Å; Q243-I247 PolarHBondContact O-N 3.41Å |
| 244 | E | 80.5 | Confident | 76.3 | Confident | 36 Ų | 36 | 53.3 Ų | 53.3 | 17% | 0.168 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -57.9 | -45.6 | 175.7 | -78.1 | -73 | -179.5 | 0 | 0 | 109.6 | F201 W240 T241 A242 R248 K260 | F201-E244 HydrophobicContact CD2-CG 4.05Å; F201-E244 HydrophobicContact CE2-CG 3.86Å; W240-E244 WeakPolarHBondContact O-CB 3.49Å; W240-E244 VanDerWaalsContact O-CG 3.26Å; W240-E244 WeakPolarHBondContact O-CG 3.26Å; W240-E244 PolarHBondContact O-N 3.23Å; T241-E244 WeakPolarHBondContact O-CB 3.44Å; T241-E244 PolarHBondContact O-N 3.03Å; A242-E244 VanDerWaalsContact C-N 3.28Å; A242-E244 PolarHBondContact O-N 2.99Å; E244-R248 VanDerWaalsContact C-NE 3.29Å; E244-R248 WeakPolarHBondContact O-CD 3.41Å; E244-R248 WeakPolarHBondContact O-CG 3.07Å; E244-R248 PolarHBondContact O-NE 3.07Å; E244-R248 PolarHBondContact O-NH2 3.44Å; E244-K260 IonicContact OE1-NZ 2.88Å; E244-K260 PolarHBondContact OE1-NZ 2.66Å; E244-K260 WeakPolarHBondContact OE2-CE 3.29Å; E244-K260 IonicContact OE2-NZ 2.87Å; E244-K260 PolarHBondContact OE2-NZ 3.39Å |
| 245 | V | 80.9 | Confident | 74.5 | Confident | 18 Ų | 18 | 57.5 Ų | 57.5 | 11% | 0.109 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -69.6 | -40.5 | -176.9 | 173.8 | 0 | 0 | 0 | 0 | 112.3 | T241 A242 Q243 I247 R248 L264 V288 T291 L292 | T241-V245 VanDerWaalsContact O-CG2 3.29Å; T241-V245 WeakPolarHBondContact O-CG2 3.29Å; T241-V245 PolarHBondContact O-N 2.86Å; A242-V245 CarbonylContact O-C 3.6Å; A242-V245 PolarHBondContact O-N 2.68Å; Q243-V245 VanDerWaalsContact C-N 3.28Å; Q243-V245 PolarHBondContact O-N 2.96Å; V245-I247 VanDerWaalsContact C-N 3.33Å; V245-I247 PolarHBondContact O-N 3.49Å; V245-R248 VanDerWaalsContact CA-NH2 3.27Å; V245-R248 VanDerWaalsContact O-CB 3.25Å; V245-R248 WeakPolarHBondContact O-CB 3.45Å; V245-R248 VanDerWaalsContact O-CG 3.28Å; V245-R248 WeakPolarHBondContact O-CG 3.5Å; V245-R248 PolarHBondContact O-N 2.84Å; V245-R248 VanDerWaalsContact O-N 3.07Å; V245-L264 HydrophobicContact CG2-CD2 4.13Å; V245-V288 HydrophobicContact CG2-CG1 3.91Å; V245-T291 HydrophobicContact CG1-CG2 4.43Å; V245-L292 HydrophobicContact CG1-CD2 4.21Å; V245-L292 HydrophobicContact CG2-CD2 4.08Å |
| 246 | E | 75.4 | Confident | 73.1 | Confident | 141 Ų | 141 | 58 Ų | 58 | 66% | 0.659 | 31% | 0.314 | S | S | * | . | H | α-helix | trans | -62.3 | -37.9 | -179.3 | -78.4 | -175.5 | 169.9 | 0 | 0 | 112.8 | A242 Q243 R248 T249 | A242-E246 PolarHBondContact O-N 3.22Å; Q243-E246 PolarHBondContact O-N 2.79Å; E246-R248 PolarHBondContact O-N 3.36Å; E246-T249 PolarHBondContact O-OG1 2.89Å |
| 247 | I | 61.7 | Low | 71.9 | Confident | 124 Ų | 124 | 60.3 Ų | 60.3 | 64% | 0.636 | 33% | 0.326 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.3 | -11.4 | 178.9 | -64.5 | 166.2 | 0 | 0 | 0 | 111.5 | Q243 V245 | Q243-I247 WeakPolarHBondContact O-CD1 3.28Å; Q243-I247 VanDerWaalsContact O-CG1 3.3Å; Q243-I247 WeakPolarHBondContact O-CG1 2.95Å; Q243-I247 PolarHBondContact O-N 3.41Å; V245-I247 VanDerWaalsContact C-N 3.33Å; V245-I247 PolarHBondContact O-N 3.49Å |
| 248 | R | 59.4 | Low | 70.8 | Confident | 9 Ų | 9 | 60.5 Ų | 60.5 | 3% | 0.034 | 33% | 0.327 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -98 | -13.6 | -167.2 | -45.3 | -172.4 | -170.5 | 156.9 | 61.3 | 115.5 | E244 V245 E246 F250 L251 L261 L264 | E244-R248 VanDerWaalsContact C-NE 3.29Å; E244-R248 WeakPolarHBondContact O-CD 3.41Å; E244-R248 WeakPolarHBondContact O-CG 3.07Å; E244-R248 PolarHBondContact O-NE 3.07Å; E244-R248 PolarHBondContact O-NH2 3.44Å; V245-R248 VanDerWaalsContact CA-NH2 3.27Å; V245-R248 VanDerWaalsContact O-CB 3.25Å; V245-R248 WeakPolarHBondContact O-CB 3.45Å; V245-R248 VanDerWaalsContact O-CG 3.28Å; V245-R248 WeakPolarHBondContact O-CG 3.5Å; V245-R248 PolarHBondContact O-N 2.84Å; V245-R248 VanDerWaalsContact O-N 3.07Å; E246-R248 PolarHBondContact O-N 3.36Å; R248-F250 PolarHBondContact O-N 3.35Å; R248-L251 PolarHBondContact O-N 3.47Å; R248-L261 HydrophobicContact CB-CD2 4.27Å; R248-L261 HydrophobicContact CG-CD2 4.23Å; R248-L264 VanDerWaalsContact CZ-CD2 3.43Å |
| 249 | T | 51.9 | Low | 70.1 | Confident | 95 Ų | 95 | 61.9 Ų | 61.9 | 58% | 0.583 | 34% | 0.338 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.4 | 0.6 | -171.2 | 35.4 | 0 | 0 | 0 | 0 | 115.7 | E246 | E246-T249 PolarHBondContact O-OG1 2.89Š|
| 250 | F | 51.5 | Low | 69.5 | Low | 176 Ų | 176 | 61.2 Ų | 61.2 | 77% | 0.772 | 33% | 0.334 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -131.8 | 1.2 | 173.8 | -69.5 | -82 | 0 | 0 | 0 | 115.7 | R248 | R248-F250 PolarHBondContact O-N 3.35Š|
| 251 | L | 52.6 | Low | 69.2 | Low | 56 Ų | 56 | 59.9 Ų | 59.9 | 29% | 0.293 | 33% | 0.329 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -124.8 | 9.3 | -162.6 | -53.2 | 175.4 | 0 | 0 | 0 | 115.3 | R248 S253 I254 I257 | R248-L251 PolarHBondContact O-N 3.47Å; L251-S253 PolarHBondContact O-N 2.83Å; L251-I254 HydrophobicContact CB-CD1 4.08Å; L251-I254 HydrophobicContact CB-CG1 4.31Å; L251-I254 HydrophobicContact CD2-CD1 3.39Å; L251-I254 HydrophobicContact CD2-CG1 4.32Å; L251-I254 HydrophobicContact CG-CD1 4.21Å; L251-I254 WeakPolarHBondContact O-CB 3.25Å; L251-I254 PolarHBondContact O-N 3.1Å; L251-I257 HydrophobicContact CB-CD1 3.67Å; L251-I257 HydrophobicContact CB-CG2 4.02Å; L251-I257 HydrophobicContact CD1-CD1 3.65Å; L251-I257 HydrophobicContact CG-CD1 4.21Å |
| 252 | S | 55.5 | Low | 69 | Low | 19 Ų | 19 | 60.5 Ų | 60.5 | 13% | 0.133 | 33% | 0.331 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -61.6 | -18.1 | -180 | 56.2 | 0 | 0 | 0 | 0 | 113.9 | C299 | S252-C299 VanDerWaalsContact C-SG 3.59Š|
| 253 | S | 55.9 | Low | 69 | Low | 87 Ų | 87 | 59.7 Ų | 59.7 | 61% | 0.608 | 32% | 0.322 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85 | -8.2 | 174.3 | 62.4 | 0 | 0 | 0 | 0 | 114.5 | L251 P255 | L251-S253 PolarHBondContact O-N 2.83Å; S253-P255 WeakPolarHBondContact O-CD 3.3Å |
| 254 | I | 64.2 | Low | 69.2 | Low | 58 Ų | 58 | 56 Ų | 56 | 30% | 0.297 | 31% | 0.305 | S | S | . | . | S | Bend | trans | -83.6 | 122.7 | -179.1 | -59.1 | -171.5 | 0 | 0 | 0 | 109.5 | L251 G256 I257 S258 | L251-I254 HydrophobicContact CB-CD1 4.08Å; L251-I254 HydrophobicContact CB-CG1 4.31Å; L251-I254 HydrophobicContact CD2-CD1 3.39Å; L251-I254 HydrophobicContact CD2-CG1 4.32Å; L251-I254 HydrophobicContact CG-CD1 4.21Å; L251-I254 WeakPolarHBondContact O-CB 3.25Å; L251-I254 PolarHBondContact O-N 3.1Å; I254-G256 PolarHBondContact O-N 3.2Å; I254-I257 HydrophobicContact CB-CB 4.32Å; I254-I257 HydrophobicContact CB-CD1 3.99Å; I254-I257 HydrophobicContact CB-CG1 4.31Å; I254-I257 HydrophobicContact CD1-CD1 4.17Å; I254-I257 HydrophobicContact CG2-CD1 4.05Å; I254-I257 HydrophobicContact CG2-CG1 4.26Å; I254-I257 PolarHBondContact O-N 2.95Å; I254-S258 PolarHBondContact O-N 2.95Å |
| 255 | P | 55 | Low | 69.8 | Low | 88 Ų | 88 | 54.3 Ų | 54.3 | 57% | 0.571 | 30% | 0.297 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.8 | 130.3 | 174.3 | -23.3 | 33.1 | 0 | 0 | 0 | 110.8 | S253 I257 | S253-P255 WeakPolarHBondContact O-CD 3.3Å; P255-I257 PolarHBondContact O-N 2.98Å |
| 256 | G | 63.4 | Low | 70.3 | Confident | 42 Ų | 42 | 53.4 Ų | 53.4 | 43% | 0.433 | 29% | 0.292 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 95.6 | -40.3 | -177.1 | 0 | 0 | 0 | 0 | 0 | 114.6 | I254 L259 K260 | I254-G256 PolarHBondContact O-N 3.2Å; G256-L259 WeakPolarHBondContact O-CB 3.27Å; G256-L259 PolarHBondContact O-N 2.88Å; G256-K260 PolarHBondContact O-N 3.28Å; G256-K260 VanDerWaalsContact O-N 3.11Å |
| 257 | I | 68.1 | Low | 71.2 | Confident | 49 Ų | 49 | 46.9 Ų | 46.9 | 25% | 0.251 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -70 | -42.5 | 170.6 | -64 | 179.7 | 0 | 0 | 0 | 109.7 | L251 I254 P255 L259 K260 L261 | L251-I257 HydrophobicContact CB-CD1 3.67Å; L251-I257 HydrophobicContact CB-CG2 4.02Å; L251-I257 HydrophobicContact CD1-CD1 3.65Å; L251-I257 HydrophobicContact CG-CD1 4.21Å; I254-I257 HydrophobicContact CB-CB 4.32Å; I254-I257 HydrophobicContact CB-CD1 3.99Å; I254-I257 HydrophobicContact CB-CG1 4.31Å; I254-I257 HydrophobicContact CD1-CD1 4.17Å; I254-I257 HydrophobicContact CG2-CD1 4.05Å; I254-I257 HydrophobicContact CG2-CG1 4.26Å; I254-I257 PolarHBondContact O-N 2.95Å; P255-I257 PolarHBondContact O-N 2.98Å; I257-L259 PolarHBondContact O-N 3.35Å; I257-K260 PolarHBondContact O-N 3.31Å; I257-L261 HydrophobicContact CG2-CD1 4.01Å; I257-L261 WeakPolarHBondContact O-CB 3.35Å; I257-L261 WeakPolarHBondContact O-CG 3.26Å; I257-L261 PolarHBondContact O-N 2.95Å |
| 258 | S | 70.5 | Confident | 72.8 | Confident | 5 Ų | 5 | 41 Ų | 41 | 4% | 0.035 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -53.6 | -39.7 | 170.5 | 64.7 | 0 | 0 | 0 | 0 | 111.8 | I254 L261 R262 | I254-S258 PolarHBondContact O-N 2.95Å; S258-L261 WeakPolarHBondContact O-CB 3.07Å; S258-L261 PolarHBondContact O-N 3.33Å; S258-R262 WeakPolarHBondContact O-CG 3.45Å; S258-R262 PolarHBondContact O-N 3.26Å |
| 259 | L | 79.6 | Confident | 74.5 | Confident | 75 Ų | 75 | 40.6 Ų | 40.6 | 39% | 0.393 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -65.9 | -50.3 | 178.7 | -173.8 | 65.1 | 0 | 0 | 0 | 111.5 | G256 I257 L261 R262 F263 | G256-L259 WeakPolarHBondContact O-CB 3.27Å; G256-L259 PolarHBondContact O-N 2.88Å; I257-L259 PolarHBondContact O-N 3.35Å; L259-L261 VanDerWaalsContact C-N 3.26Å; L259-L261 PolarHBondContact O-N 2.63Å; L259-R262 WeakPolarHBondContact O-CB 3.37Å; L259-R262 PolarHBondContact O-N 3.5Å; L259-F263 HydrophobicContact CD1-CD2 4.05Å; L259-F263 HydrophobicContact CD1-CE2 3.34Å; L259-F263 HydrophobicContact CD1-CZ 4.03Å; L259-F263 HydrophobicContact CD2-CE2 4.15Å; L259-F263 HydrophobicContact CG-CD2 3.91Å; L259-F263 HydrophobicContact CG-CE2 3.49Å; L259-F263 VanDerWaalsContact CG-CE2 3.49Å; L259-F263 WeakPolarHBondContact O-CD2 3.34Å; L259-F263 PolarHBondContact O-N 2.84Å; L259-F263 VanDerWaalsContact O-N 3.12Å |
| 260 | K | 79.5 | Confident | 76.6 | Confident | 60 Ų | 60 | 36.9 Ų | 36.9 | 26% | 0.261 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -58 | -40.2 | 175.8 | -173.5 | 177.1 | -172.3 | -171.2 | 0 | 111.9 | M205 E244 G256 I257 F263 L264 | M205-K260 HydrophobicContact CE-CD 4.21Å; M205-K260 HydrophobicContact CE-CG 4.26Å; M205-K260 HydrophobicContact SD-CB 4Å; M205-K260 HydrophobicContact SD-CD 4.24Å; M205-K260 HydrophobicContact SD-CG 3.76Å; E244-K260 IonicContact OE1-NZ 2.88Å; E244-K260 PolarHBondContact OE1-NZ 2.66Å; E244-K260 WeakPolarHBondContact OE2-CE 3.29Å; E244-K260 IonicContact OE2-NZ 2.87Å; E244-K260 PolarHBondContact OE2-NZ 3.39Å; G256-K260 PolarHBondContact O-N 3.28Å; G256-K260 VanDerWaalsContact O-N 3.11Å; I257-K260 PolarHBondContact O-N 3.31Å; K260-F263 PolarHBondContact O-N 2.95Å; K260-L264 PolarHBondContact O-N 3.21Å |
| 261 | L | 83.1 | Confident | 78.6 | Confident | 1 Ų | 1 | 28.5 Ų | 28.5 | 1% | 0.005 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -58.1 | -49.7 | 173.7 | -84.7 | 165.5 | 0 | 0 | 0 | 112.9 | R248 I257 S258 L259 F263 L264 M265 L292 L296 | R248-L261 HydrophobicContact CB-CD2 4.27Å; R248-L261 HydrophobicContact CG-CD2 4.23Å; I257-L261 HydrophobicContact CG2-CD1 4.01Å; I257-L261 WeakPolarHBondContact O-CB 3.35Å; I257-L261 WeakPolarHBondContact O-CG 3.26Å; I257-L261 PolarHBondContact O-N 2.95Å; S258-L261 WeakPolarHBondContact O-CB 3.07Å; S258-L261 PolarHBondContact O-N 3.33Å; L259-L261 VanDerWaalsContact C-N 3.26Å; L259-L261 PolarHBondContact O-N 2.63Å; L261-F263 VanDerWaalsContact C-N 3.31Å; L261-F263 PolarHBondContact O-N 3.48Å; L261-L264 PolarHBondContact O-N 3.25Å; L261-M265 WeakPolarHBondContact O-CB 3.5Å; L261-M265 PolarHBondContact O-N 3.32Å; L261-L292 HydrophobicContact CD2-CD2 3.3Å; L261-L292 HydrophobicContact CD2-CG 4.34Å; L261-L296 HydrophobicContact CB-CD1 4.47Å; L261-L296 HydrophobicContact CB-CD2 3.9Å; L261-L296 HydrophobicContact CB-CG 4.42Å; L261-L296 HydrophobicContact CD1-CD2 4.36Å |
| 262 | R | 85.9 | Confident | 80.6 | Confident | 12 Ų | 12 | 25.9 Ų | 25.9 | 5% | 0.045 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -57.9 | -44.4 | 178.2 | -67.6 | 164.5 | -161.4 | 171.9 | 2.8 | 111.3 | E77 S258 L259 M265 A266 L296 S301 N304 A307 | E77-R262 IonicContact OE1-NH1 3.65Å; E77-R262 IonicContact OE1-NH2 3.36Å; E77-R262 IonicContact OE2-CZ 2.55Å; E77-R262 IonicContact OE2-NH1 2.67Å; E77-R262 PolarHBondContact OE2-NH1 3.37Å; E77-R262 IonicContact OE2-NH2 3.86Å; E77-R262 PolarHBondContact OE2-NH2 3.09Å; S258-R262 WeakPolarHBondContact O-CG 3.45Å; S258-R262 PolarHBondContact O-N 3.26Å; L259-R262 WeakPolarHBondContact O-CB 3.37Å; L259-R262 PolarHBondContact O-N 3.5Å; R262-M265 WeakPolarHBondContact O-CB 3.24Å; R262-M265 PolarHBondContact O-N 3.27Å; R262-A266 PolarHBondContact O-N 3.05Å; R262-L296 HydrophobicContact CG-CD1 4.07Å; R262-L296 HydrophobicContact CG-CD2 4.2Å; R262-S301 PolarHBondContact NH2-OG 2.81Å; R262-N304 PolarHBondContact NE-OD1 2.87Å; R262-N304 PolarHBondContact NH2-OD1 3.4Å; R262-A307 HydrophobicContact CB-CB 3.74Å; R262-A307 HydrophobicContact CG-CB 3.55Å |
| 263 | F | 88.7 | Confident | 82.4 | Confident | 14 Ų | 14 | 26.5 Ų | 26.5 | 6% | 0.061 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -69.5 | -40.9 | 179.7 | -73 | -60.3 | 0 | 0 | 0 | 113.2 | M205 Y207 L259 K260 L261 M265 A266 L267 | M205-F263 HydrophobicContact CB-CD2 3.85Å; M205-F263 HydrophobicContact CB-CE2 4.32Å; M205-F263 HydrophobicContact CB-CG 4.31Å; M205-F263 HydrophobicContact CG-CD2 4.44Å; M205-F263 WeakPolarHBondContact O-CD2 3.37Å; M205-F263 WeakPolarHBondContact O-CE2 3.46Å; M205-F263 WeakPolarHBondContact O-CZ 3.17Å; Y207-F263 HydrophobicContact CD1-CD1 4.23Å; Y207-F263 AromaticContact CD1-CE1 3.92Å; Y207-F263 HydrophobicContact CD1-CE1 3.92Å; Y207-F263 HydrophobicContact CD2-CD1 4.29Å; Y207-F263 AromaticContact CD2-CE1 3.28Å; Y207-F263 HydrophobicContact CD2-CE1 3.28Å; Y207-F263 AromaticContact CD2-CZ 3.78Å; Y207-F263 HydrophobicContact CD2-CZ 3.78Å; Y207-F263 HydrophobicContact CE1-CD1 4.19Å; Y207-F263 HydrophobicContact CE1-CE1 4.07Å; Y207-F263 HydrophobicContact CE2-CD1 4.23Å; Y207-F263 AromaticContact CE2-CE1 3.43Å; Y207-F263 HydrophobicContact CE2-CE1 3.43Å; Y207-F263 VanDerWaalsContact CE2-CE1 3.43Å; Y207-F263 AromaticContact CE2-CZ 3.8Å; Y207-F263 HydrophobicContact CE2-CZ 3.8Å; Y207-F263 HydrophobicContact CG-CD1 4.27Å; Y207-F263 AromaticContact CG-CE1 3.52Å; Y207-F263 HydrophobicContact CG-CE1 3.52Å; Y207-F263 HydrophobicContact CG-CZ 4.43Å; Y207-F263 AromaticContact CZ-CE1 3.83Å; L259-F263 HydrophobicContact CD1-CD2 4.05Å; L259-F263 HydrophobicContact CD1-CE2 3.34Å; L259-F263 HydrophobicContact CD1-CZ 4.03Å; L259-F263 HydrophobicContact CD2-CE2 4.15Å; L259-F263 HydrophobicContact CG-CD2 3.91Å; L259-F263 HydrophobicContact CG-CE2 3.49Å; L259-F263 VanDerWaalsContact CG-CE2 3.49Å; L259-F263 WeakPolarHBondContact O-CD2 3.34Å; L259-F263 PolarHBondContact O-N 2.84Å; L259-F263 VanDerWaalsContact O-N 3.12Å; K260-F263 PolarHBondContact O-N 2.95Å; L261-F263 VanDerWaalsContact C-N 3.31Å; L261-F263 PolarHBondContact O-N 3.48Å; F263-M265 VanDerWaalsContact C-N 3.3Å; F263-M265 PolarHBondContact O-N 2.88Å; F263-A266 PolarHBondContact O-N 2.68Å; F263-L267 WeakPolarHBondContact O-CB 3.24Å; F263-L267 PolarHBondContact O-N 2.92Å |
| 264 | L | 89.9 | Confident | 84 | Confident | 11 Ų | 11 | 27.3 Ų | 27.3 | 6% | 0.058 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -65.8 | -37 | 175.7 | -170 | 71.3 | 0 | 0 | 0 | 111.8 | F201 T241 V245 R248 K260 L261 A266 L267 C268 L292 | F201-L264 HydrophobicContact CD1-CD1 4.12Å; F201-L264 HydrophobicContact CE1-CD1 3.81Å; F201-L264 HydrophobicContact CZ-CD1 4.23Å; T241-L264 HydrophobicContact CG2-CD1 4.49Å; T241-L264 HydrophobicContact CG2-CD2 4.13Å; V245-L264 HydrophobicContact CG2-CD2 4.13Å; R248-L264 VanDerWaalsContact CZ-CD2 3.43Å; K260-L264 PolarHBondContact O-N 3.21Å; L261-L264 PolarHBondContact O-N 3.25Å; L264-A266 VanDerWaalsContact C-N 3.35Å; L264-L267 HydrophobicContact CD1-CD2 3.88Å; L264-L267 PolarHBondContact O-N 3.34Å; L264-C268 WeakPolarHBondContact O-CB 3.48Å; L264-C268 PolarHBondContact O-N 3.43Å; L264-C268 PolarHBondContact O-SG 2.95Å; L264-L292 HydrophobicContact CB-CD1 4.17Å; L264-L292 HydrophobicContact CD2-CD1 4.19Å; L264-L292 HydrophobicContact CG-CD1 4.27Å |
| 265 | M | 92.7 | Very high | 85.2 | Confident | 0 Ų | 0 | 25 Ų | 25 | 0% | 0 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -58.8 | -46.5 | 173 | 178.4 | -174.1 | 69.9 | 0 | 0 | 111 | L261 R262 F263 C268 A269 V289 L292 M293 L296 A307 I308 V311 | L261-M265 WeakPolarHBondContact O-CB 3.5Å; L261-M265 PolarHBondContact O-N 3.32Å; R262-M265 WeakPolarHBondContact O-CB 3.24Å; R262-M265 PolarHBondContact O-N 3.27Å; F263-M265 VanDerWaalsContact C-N 3.3Å; F263-M265 PolarHBondContact O-N 2.88Å; M265-C268 PolarHBondContact O-N 2.85Å; M265-A269 WeakPolarHBondContact O-CB 3.35Å; M265-A269 PolarHBondContact O-N 3.25Å; M265-V289 HydrophobicContact CG-CG1 4.4Å; M265-L292 HydrophobicContact CB-CB 4Å; M265-L292 HydrophobicContact CB-CD1 3.91Å; M265-L292 HydrophobicContact CG-CB 4.26Å; M265-M293 HydrophobicContact CG-CG 4.24Å; M265-M293 HydrophobicContact SD-CB 4.29Å; M265-M293 HydrophobicContact SD-CE 4.19Å; M265-M293 HydrophobicContact SD-CG 3.34Å; M265-M293 WeakPolarHBondContact SD-CG 3.29Å; M265-L296 HydrophobicContact CE-CD1 4.04Å; M265-L296 HydrophobicContact SD-CD1 3.84Å; M265-A307 HydrophobicContact CE-CB 3.8Å; M265-I308 HydrophobicContact CE-CG1 3.92Å; M265-I308 HydrophobicContact SD-CG1 4.01Å; M265-V311 HydrophobicContact CE-CB 4.37Å; M265-V311 HydrophobicContact CE-CG2 3.79Å; M265-V311 HydrophobicContact CG-CG2 4.36Å |
| 266 | A | 93 | Very high | 86.7 | Confident | 0 Ų | 0 | 25.5 Ų | 25.5 | 0% | 0 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -63.3 | -42.6 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | Y207 Y210 R262 F263 L264 A269 H270 V311 | Y207-A266 HydrophobicContact CE1-CB 4.21Å; Y210-A266 HydrophobicContact CD2-CB 4.05Å; Y210-A266 HydrophobicContact CE1-CB 4.47Å; Y210-A266 HydrophobicContact CE2-CB 3.96Å; Y210-A266 VanDerWaalsContact CE2-O 3.31Å; Y210-A266 WeakPolarHBondContact CE2-O 3.42Å; Y210-A266 HydrophobicContact CG-CB 4.32Å; R262-A266 PolarHBondContact O-N 3.05Å; F263-A266 PolarHBondContact O-N 2.68Å; L264-A266 VanDerWaalsContact C-N 3.35Å; A266-A269 PolarHBondContact O-N 3.28Å; A266-H270 PolarHBondContact O-N 3.25Å; A266-V311 HydrophobicContact CB-CG2 4.04Å |
| 267 | L | 93.9 | Very high | 87.8 | Confident | 4 Ų | 4 | 28 Ų | 28 | 2% | 0.021 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -58.8 | -50.1 | 175.5 | -175.1 | 71.6 | 0 | 0 | 0 | 111.8 | F201 A204 Y210 A214 F237 F263 L264 A269 H270 L271 | F201-L267 HydrophobicContact CD1-CD2 3.8Å; F201-L267 HydrophobicContact CE1-CD2 3.84Å; A204-L267 HydrophobicContact CB-CD1 4.09Å; A204-L267 HydrophobicContact CB-CD2 4.12Å; Y210-L267 VanDerWaalsContact O-CD1 3.24Å; Y210-L267 WeakPolarHBondContact O-CD1 3.42Å; A214-L267 HydrophobicContact CB-CD1 3.76Å; F237-L267 HydrophobicContact CE1-CD2 4.5Å; F237-L267 HydrophobicContact CZ-CD2 3.91Å; F263-L267 WeakPolarHBondContact O-CB 3.24Å; F263-L267 PolarHBondContact O-N 2.92Å; L264-L267 HydrophobicContact CD1-CD2 3.88Å; L264-L267 PolarHBondContact O-N 3.34Å; L267-A269 VanDerWaalsContact C-N 3.33Å; L267-A269 PolarHBondContact O-N 3.3Å; L267-H270 PolarHBondContact O-N 3.18Å; L267-L271 HydrophobicContact CG-CD1 4.32Å; L267-L271 WeakPolarHBondContact O-CG 3.39Å; L267-L271 PolarHBondContact O-N 3.47Å |
| 268 | C | 95.2 | Very high | 88.6 | Confident | 0 Ų | 0 | 29.9 Ų | 29.9 | 0% | 0 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -67.3 | -34.9 | -179.8 | -64.6 | 0 | 0 | 0 | 0 | 111.5 | L264 M265 L271 T272 F285 V288 V289 | L264-C268 WeakPolarHBondContact O-CB 3.48Å; L264-C268 PolarHBondContact O-N 3.43Å; L264-C268 PolarHBondContact O-SG 2.95Å; M265-C268 PolarHBondContact O-N 2.85Å; C268-L271 PolarHBondContact O-N 3.11Å; C268-T272 WeakPolarHBondContact O-CB 3.4Å; C268-T272 PolarHBondContact O-N 3.39Å; C268-T272 PolarHBondContact O-OG1 2.82Å; C268-F285 HydrophobicContact CB-CB 4.3Å; C268-F285 HydrophobicContact CB-CD1 4.14Å; C268-V288 HydrophobicContact CB-CG1 4.15Å; C268-V289 HydrophobicContact CB-CG2 3.65Å |
| 269 | A | 95.3 | Very high | 89.5 | Confident | 1 Ų | 1 | 30.1 Ų | 30.1 | 1% | 0.008 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -64.7 | -41.5 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | M265 A266 L267 T272 A273 V289 V311 Y315 | M265-A269 WeakPolarHBondContact O-CB 3.35Å; M265-A269 PolarHBondContact O-N 3.25Å; A266-A269 PolarHBondContact O-N 3.28Å; L267-A269 VanDerWaalsContact C-N 3.33Å; L267-A269 PolarHBondContact O-N 3.3Å; A269-T272 WeakPolarHBondContact O-CB 3.21Å; A269-T272 PolarHBondContact O-N 3.3Å; A269-A273 PolarHBondContact O-N 3Å; A269-A273 VanDerWaalsContact O-N 3.15Å; A269-V289 HydrophobicContact CB-CG1 4.42Å; A269-V289 HydrophobicContact CB-CG2 3.86Å; A269-V311 HydrophobicContact CB-CG1 3.42Å; A269-V311 VanDerWaalsContact CB-CG1 3.42Å; A269-Y315 HydrophobicContact CB-CD2 3.67Å; A269-Y315 HydrophobicContact CB-CE2 4.14Å; A269-Y315 HydrophobicContact CB-CG 4.15Å |
| 270 | H | 94.8 | Very high | 89.9 | Confident | 17 Ų | 17 | 31 Ų | 31 | 8% | 0.079 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -62.3 | -47.2 | 173.6 | -163 | 77.1 | 0 | 0 | 0 | 112 | Y210 A214 A266 L267 T272 A273 K274 Y315 | Y210-H270 HydrophobicContact CD2-CB 4.29Å; Y210-H270 HydrophobicContact CE2-CB 3.93Å; A214-H270 HydrophobicContact CB-CB 4.32Å; A266-H270 PolarHBondContact O-N 3.25Å; L267-H270 PolarHBondContact O-N 3.18Å; H270-T272 VanDerWaalsContact C-N 3.3Å; H270-T272 PolarHBondContact O-N 3.27Å; H270-A273 WeakPolarHBondContact O-CB 3.49Å; H270-A273 PolarHBondContact O-N 2.96Å; H270-A273 VanDerWaalsContact O-N 3.16Å; H270-K274 WeakPolarHBondContact NE2-CE 3.18Å; H270-K274 WeakPolarHBondContact O-CG 3.37Å; H270-K274 PolarHBondContact O-N 3.32Å; H270-Y315 HydrophobicContact CB-CE1 4.31Å; H270-Y315 AromaticContact ND1-CE1 3.61Å; H270-Y315 AromaticContact ND1-CZ 3.56Å; H270-Y315 PolarHBondContact ND1-OH 3.43Å |
| 271 | L | 94.3 | Very high | 90.4 | Very high | 0 Ų | 0 | 28.8 Ų | 28.8 | 0% | 0 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -61 | -41.1 | 177.6 | -71.1 | 170.8 | 0 | 0 | 0 | 111.3 | A214 M218 F237 L267 C268 A273 K274 F275 F285 | A214-L271 HydrophobicContact CB-CD2 3.85Å; A214-L271 HydrophobicContact CB-CG 4.05Å; M218-L271 HydrophobicContact CG-CD2 3.94Å; M218-L271 HydrophobicContact SD-CD2 4.02Å; F237-L271 HydrophobicContact CD1-CD1 4.41Å; F237-L271 HydrophobicContact CE1-CD1 3.58Å; F237-L271 HydrophobicContact CZ-CD1 4.05Å; L267-L271 HydrophobicContact CG-CD1 4.32Å; L267-L271 WeakPolarHBondContact O-CG 3.39Å; L267-L271 PolarHBondContact O-N 3.47Å; C268-L271 PolarHBondContact O-N 3.11Å; L271-A273 VanDerWaalsContact C-N 3.26Å; L271-A273 PolarHBondContact O-N 3.36Å; L271-K274 PolarHBondContact O-N 3.33Å; L271-F275 HydrophobicContact CB-CE2 4.46Å; L271-F275 HydrophobicContact CD2-CE2 4.49Å; L271-F275 WeakPolarHBondContact O-CD2 3.29Å; L271-F275 PolarHBondContact O-N 3.49Å; L271-F275 VanDerWaalsContact O-N 3.13Å; L271-F285 HydrophobicContact CB-CD1 4.5Å; L271-F285 HydrophobicContact CB-CD2 3.8Å; L271-F285 HydrophobicContact CB-CE2 4.12Å; L271-F285 HydrophobicContact CB-CG 4.04Å; L271-F285 HydrophobicContact CD1-CD1 4.27Å; L271-F285 HydrophobicContact CD1-CE1 3.9Å; L271-F285 HydrophobicContact CD1-CE2 4.18Å; L271-F285 HydrophobicContact CD1-CZ 3.87Å |
| 272 | T | 94.6 | Very high | 90.7 | Very high | 0 Ų | 0 | 28.7 Ų | 28.7 | 0% | 0 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -52.9 | -46 | 174.6 | -60.3 | 0 | 0 | 0 | 0 | 110.8 | C268 A269 H270 K274 F285 Q286 L319 R322 | C268-T272 WeakPolarHBondContact O-CB 3.4Å; C268-T272 PolarHBondContact O-N 3.39Å; C268-T272 PolarHBondContact O-OG1 2.82Å; A269-T272 WeakPolarHBondContact O-CB 3.21Å; A269-T272 PolarHBondContact O-N 3.3Å; H270-T272 VanDerWaalsContact C-N 3.3Å; H270-T272 PolarHBondContact O-N 3.27Å; T272-K274 VanDerWaalsContact C-N 3.3Å; T272-K274 PolarHBondContact O-N 3.29Å; T272-F285 VanDerWaalsContact OG1-C 3.27Å; T272-F285 WeakPolarHBondContact OG1-CB 3.21Å; T272-Q286 HydrophobicContact CG2-CB 3.93Å; T272-Q286 PolarHBondContact OG1-N 3.03Å; T272-L319 HydrophobicContact CG2-CD2 4Å; T272-R322 VanDerWaalsContact O-CZ 3.27Å; T272-R322 PolarHBondContact O-NH1 3.34Å; T272-R322 PolarHBondContact O-NH2 3.33Å |
| 273 | A | 92.2 | Very high | 91 | Very high | 33 Ų | 33 | 33.9 Ų | 33.9 | 27% | 0.273 | 17% | 0.165 | S | C | . | . | H | α-helix | trans | -69.1 | -23 | 178.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | A269 H270 L271 Y315 I318 | A269-A273 PolarHBondContact O-N 3Å; A269-A273 VanDerWaalsContact O-N 3.15Å; H270-A273 WeakPolarHBondContact O-CB 3.49Å; H270-A273 PolarHBondContact O-N 2.96Å; H270-A273 VanDerWaalsContact O-N 3.16Å; L271-A273 VanDerWaalsContact C-N 3.26Å; L271-A273 PolarHBondContact O-N 3.36Å; A273-Y315 HydrophobicContact CB-CD1 3.94Å; A273-Y315 HydrophobicContact CB-CE1 4.34Å; A273-I318 HydrophobicContact CB-CD1 3.5Å; A273-I318 VanDerWaalsContact CB-CD1 3.5Å |
| 274 | K | 91.3 | Very high | 91.3 | Very high | 104 Ų | 104 | 35.3 Ų | 35.3 | 45% | 0.452 | 17% | 0.171 | S | C | . | . | H | α-helix | trans | -82.5 | -30 | 178.8 | -66.2 | -64.4 | -177.8 | 177.6 | 0 | 113.3 | N215 M218 H270 L271 T272 | N215-K274 WeakPolarHBondContact OD1-CE 3.49Å; M218-K274 HydrophobicContact CE-CB 4.38Å; M218-K274 HydrophobicContact CG-CB 4.44Å; M218-K274 HydrophobicContact SD-CB 4.25Å; H270-K274 WeakPolarHBondContact NE2-CE 3.18Å; H270-K274 WeakPolarHBondContact O-CG 3.37Å; H270-K274 PolarHBondContact O-N 3.32Å; L271-K274 PolarHBondContact O-N 3.33Å; T272-K274 VanDerWaalsContact C-N 3.3Å; T272-K274 PolarHBondContact O-N 3.29Å |
| 275 | F | 88.8 | Confident | 91.6 | Very high | 10 Ų | 10 | 34.8 Ų | 34.8 | 4% | 0.044 | 17% | 0.168 | C | C | . | . | S | Bend | trans | -86 | 145.1 | 178.5 | -73.7 | -72.1 | 0 | 0 | 0 | 112.2 | M218 M234 L271 N281 A282 F285 R322 | M218-F275 HydrophobicContact CE-CD1 4.29Å; M218-F275 HydrophobicContact CE-CE1 3.77Å; M218-F275 HydrophobicContact CE-CE2 4.34Å; M218-F275 HydrophobicContact CE-CZ 3.8Å; M218-F275 HydrophobicContact SD-CD2 4.22Å; M218-F275 HydrophobicContact SD-CE1 3.88Å; M218-F275 HydrophobicContact SD-CE2 3.44Å; M218-F275 WeakPolarHBondContact SD-CE2 3.44Å; M218-F275 HydrophobicContact SD-CZ 3.24Å; M218-F275 WeakPolarHBondContact SD-CZ 3.39Å; M234-F275 HydrophobicContact CE-CE2 4.37Å; M234-F275 HydrophobicContact CE-CZ 3.93Å; M234-F275 HydrophobicContact CG-CE2 4.46Å; M234-F275 HydrophobicContact CG-CZ 3.93Å; M234-F275 HydrophobicContact SD-CE2 4.26Å; M234-F275 HydrophobicContact SD-CZ 4.11Å; L271-F275 HydrophobicContact CB-CE2 4.46Å; L271-F275 HydrophobicContact CD2-CE2 4.49Å; L271-F275 WeakPolarHBondContact O-CD2 3.29Å; L271-F275 PolarHBondContact O-N 3.49Å; L271-F275 VanDerWaalsContact O-N 3.13Å; F275-N281 HydrophobicContact CD1-CB 3.78Å; F275-N281 HydrophobicContact CD2-CB 3.78Å; F275-N281 HydrophobicContact CE1-CB 3.78Å; F275-N281 WeakPolarHBondContact CE1-ND2 3.36Å; F275-N281 HydrophobicContact CE2-CB 3.79Å; F275-N281 HydrophobicContact CG-CB 3.79Å; F275-N281 HydrophobicContact CZ-CB 3.78Å; F275-A282 HydrophobicContact CB-CB 3.65Å; F275-F285 AromaticContact CD2-CD2 3.98Å; F275-F285 HydrophobicContact CD2-CD2 3.98Å; F275-F285 HydrophobicContact CD2-CE2 4.11Å; F275-F285 AromaticContact CE2-CD2 3.95Å; F275-F285 HydrophobicContact CE2-CD2 3.95Å; F275-F285 AromaticContact CE2-CE2 3.6Å; F275-F285 HydrophobicContact CE2-CE2 3.6Å; F275-F285 HydrophobicContact CZ-CE2 4.47Å; F275-R322 PolarHBondContact O-NH2 3.22Å |
| 276 | H | 87.3 | Confident | 91.7 | Very high | 98 Ų | 98 | 35.9 Ų | 35.9 | 45% | 0.454 | 17% | 0.173 | S | C | . | . | trans | -62.8 | 137.3 | 170 | -170.6 | -82.9 | 0 | 0 | 0 | 109.8 | N278 T279 A282 | H276-N278 PolarHBondContact ND1-N 3.46Å; H276-N278 PolarHBondContact O-N 3.36Å; H276-T279 HydrophobicContact CB-CG2 4.09Å; H276-T279 WeakPolarHBondContact O-CB 3.46Å; H276-T279 WeakPolarHBondContact O-CG2 3.43Å; H276-T279 PolarHBondContact O-N 2.68Å; H276-T279 PolarHBondContact O-OG1 3.23Å; H276-A282 VanDerWaalsContact O-CB 3.25Å; H276-A282 WeakPolarHBondContact O-CB 3.36Å | ||
| 277 | E | 85.6 | Confident | 91.7 | Very high | 94 Ų | 94 | 42 Ų | 42 | 44% | 0.439 | 20% | 0.202 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -54.5 | -30.6 | -170 | 60 | -178.3 | -174.6 | 0 | 0 | 114.6 | T279 R322 | E277-T279 VanDerWaalsContact C-N 3.32Å; E277-T279 PolarHBondContact O-N 2.86Å; E277-R322 HydrophobicContact CB-CG 4.36Å |
| 278 | N | 85.5 | Confident | 91.7 | Very high | 88 Ų | 88 | 42.3 Ų | 42.3 | 47% | 0.471 | 20% | 0.204 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -82.5 | -5.4 | -177.9 | -66.2 | -32.7 | 0 | 0 | 0 | 114.5 | H276 | H276-N278 PolarHBondContact ND1-N 3.46Å; H276-N278 PolarHBondContact O-N 3.36Å |
| 279 | T | 87.9 | Confident | 91.7 | Very high | 10 Ų | 10 | 42.3 Ų | 42.3 | 6% | 0.061 | 20% | 0.204 | C | C | . | . | S | Bend | trans | -80.5 | 150 | -179.3 | 65.1 | 0 | 0 | 0 | 0 | 111.7 | Q42 H276 E277 N281 A282 K283 | Q42-T279 WeakPolarHBondContact O-CG2 3.47Å; H276-T279 HydrophobicContact CB-CG2 4.09Å; H276-T279 WeakPolarHBondContact O-CB 3.46Å; H276-T279 WeakPolarHBondContact O-CG2 3.43Å; H276-T279 PolarHBondContact O-N 2.68Å; H276-T279 PolarHBondContact O-OG1 3.23Å; E277-T279 VanDerWaalsContact C-N 3.32Å; E277-T279 PolarHBondContact O-N 2.86Å; T279-N281 VanDerWaalsContact C-N 3.25Å; T279-N281 PolarHBondContact O-N 3.2Å; T279-A282 PolarHBondContact O-N 2.95Å; T279-A282 WeakPolarHBondContact OG1-CB 3.03Å; T279-A282 PolarHBondContact OG1-N 3.15Å; T279-K283 PolarHBondContact O-N 2.87Å |
| 280 | E | 88 | Confident | 91.7 | Very high | 95 Ų | 95 | 43 Ų | 43 | 44% | 0.444 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -60.5 | -36.7 | 174.6 | -70 | -164.1 | 159.7 | 0 | 0 | 112.4 | R238 A282 K283 F284 | R238-E280 IonicContact NH1-OE2 2.61Å; R238-E280 PolarHBondContact NH1-OE2 2.96Å; R238-E280 IonicContact NH2-OE2 3.02Å; E280-A282 VanDerWaalsContact C-N 3.33Å; E280-A282 PolarHBondContact O-N 3.35Å; E280-K283 PolarHBondContact O-N 2.88Å; E280-F284 VanDerWaalsContact O-CB 3.3Å; E280-F284 WeakPolarHBondContact O-CB 3.26Å; E280-F284 PolarHBondContact O-N 2.88Å |
| 281 | N | 90.6 | Very high | 91.5 | Very high | 12 Ų | 12 | 44.8 Ų | 44.8 | 6% | 0.064 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -59.8 | -45.9 | 177.2 | -69.7 | -19.6 | 0 | 0 | 0 | 110.8 | R238 F275 T279 K283 F284 F285 | R238-N281 VanDerWaalsContact CD-OD1 3.27Å; R238-N281 WeakPolarHBondContact CD-OD1 3.34Å; R238-N281 PolarHBondContact NE-OD1 2.86Å; R238-N281 VanDerWaalsContact NE-OD1 3.12Å; F275-N281 HydrophobicContact CD1-CB 3.78Å; F275-N281 HydrophobicContact CD2-CB 3.78Å; F275-N281 HydrophobicContact CE1-CB 3.78Å; F275-N281 WeakPolarHBondContact CE1-ND2 3.36Å; F275-N281 HydrophobicContact CE2-CB 3.79Å; F275-N281 HydrophobicContact CG-CB 3.79Å; F275-N281 HydrophobicContact CZ-CB 3.78Å; T279-N281 VanDerWaalsContact C-N 3.25Å; T279-N281 PolarHBondContact O-N 3.2Å; N281-K283 VanDerWaalsContact C-N 3.35Å; N281-K283 PolarHBondContact O-N 3.16Å; N281-F284 PolarHBondContact O-N 3.24Å; N281-F285 HydrophobicContact CB-CD2 4.39Å; N281-F285 HydrophobicContact CB-CE2 4.15Å; N281-F285 WeakPolarHBondContact O-CD2 3.46Å; N281-F285 WeakPolarHBondContact O-CG 3.31Å; N281-F285 PolarHBondContact O-N 3.12Å |
| 282 | A | 89.1 | Confident | 91.3 | Very high | 0 Ų | 0 | 44.8 Ų | 44.8 | 0% | 0 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -61.7 | -43.8 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112 | F275 H276 T279 E280 Q286 | F275-A282 HydrophobicContact CB-CB 3.65Å; H276-A282 VanDerWaalsContact O-CB 3.25Å; H276-A282 WeakPolarHBondContact O-CB 3.36Å; T279-A282 PolarHBondContact O-N 2.95Å; T279-A282 WeakPolarHBondContact OG1-CB 3.03Å; T279-A282 PolarHBondContact OG1-N 3.15Å; E280-A282 VanDerWaalsContact C-N 3.33Å; E280-A282 PolarHBondContact O-N 3.35Å; A282-Q286 WeakPolarHBondContact O-CB 3.5Å; A282-Q286 PolarHBondContact O-N 3.32Å |
| 283 | K | 92.9 | Very high | 91.3 | Very high | 121 Ų | 121 | 44.8 Ų | 44.8 | 53% | 0.526 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -65.1 | -45.6 | 178.1 | -67.3 | 177.8 | -176.4 | 175.6 | 0 | 111.9 | T279 E280 N281 Q286 E287 | T279-K283 PolarHBondContact O-N 2.87Å; E280-K283 PolarHBondContact O-N 2.88Å; N281-K283 VanDerWaalsContact C-N 3.35Å; N281-K283 PolarHBondContact O-N 3.16Å; K283-Q286 PolarHBondContact O-N 2.97Å; K283-E287 WeakPolarHBondContact O-CB 3.48Å; K283-E287 PolarHBondContact O-N 3.43Å |
| 284 | F | 94.9 | Very high | 91.2 | Very high | 43 Ų | 43 | 46.9 Ų | 46.9 | 19% | 0.189 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -59.5 | -51.8 | 177.5 | 173.7 | -92.8 | 0 | 0 | 0 | 111.4 | R238 T241 A242 E280 N281 Q286 E287 V288 | R238-F284 HydrophobicContact CB-CD1 4.11Å; R238-F284 HydrophobicContact CB-CE1 3.82Å; R238-F284 HydrophobicContact CB-CE2 4.41Å; R238-F284 HydrophobicContact CB-CZ 3.98Å; R238-F284 HydrophobicContact CG-CD1 3.55Å; R238-F284 HydrophobicContact CG-CE1 3.71Å; R238-F284 HydrophobicContact CG-CG 4.05Å; R238-F284 HydrophobicContact CG-CZ 4.33Å; R238-F284 VanDerWaalsContact O-CZ 3.3Å; R238-F284 WeakPolarHBondContact O-CZ 3.47Å; T241-F284 HydrophobicContact CG2-CE1 3.92Å; T241-F284 HydrophobicContact CG2-CZ 4.18Å; A242-F284 HydrophobicContact CB-CE2 4.31Å; A242-F284 HydrophobicContact CB-CZ 4.17Å; E280-F284 VanDerWaalsContact O-CB 3.3Å; E280-F284 WeakPolarHBondContact O-CB 3.26Å; E280-F284 PolarHBondContact O-N 2.88Å; N281-F284 PolarHBondContact O-N 3.24Å; F284-Q286 VanDerWaalsContact C-N 3.31Å; F284-Q286 PolarHBondContact O-N 3.38Å; F284-E287 PolarHBondContact O-N 3.02Å; F284-V288 HydrophobicContact CD1-CG2 4.29Å; F284-V288 HydrophobicContact CE1-CG2 3.85Å; F284-V288 HydrophobicContact CE2-CG2 4.27Å; F284-V288 HydrophobicContact CZ-CG2 3.85Å; F284-V288 WeakPolarHBondContact O-CG2 3.17Å; F284-V288 PolarHBondContact O-N 3.23Å |
| 285 | F | 95.2 | Very high | 90.9 | Very high | 0 Ų | 0 | 43.6 Ų | 43.6 | 0% | 0 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -66.8 | -34.6 | -178.8 | -67.6 | -55.2 | 0 | 0 | 0 | 112.2 | M234 F237 R238 C268 L271 T272 F275 N281 V288 V289 | M234-F285 HydrophobicContact CG-CE2 4.23Å; M234-F285 HydrophobicContact CG-CZ 4.3Å; M234-F285 HydrophobicContact SD-CE2 3.72Å; M234-F285 HydrophobicContact SD-CZ 3.52Å; M234-F285 VanDerWaalsContact SD-CZ 3.52Å; F237-F285 HydrophobicContact CD1-CE1 4.02Å; F237-F285 AromaticContact CD1-CZ 3.88Å; F237-F285 HydrophobicContact CD1-CZ 3.88Å; F237-F285 HydrophobicContact CE1-CE1 4.1Å; F237-F285 HydrophobicContact CE1-CZ 4.23Å; R238-F285 HydrophobicContact CG-CZ 4.04Å; C268-F285 HydrophobicContact CB-CB 4.3Å; C268-F285 HydrophobicContact CB-CD1 4.14Å; L271-F285 HydrophobicContact CB-CD1 4.5Å; L271-F285 HydrophobicContact CB-CD2 3.8Å; L271-F285 HydrophobicContact CB-CE2 4.12Å; L271-F285 HydrophobicContact CB-CG 4.04Å; L271-F285 HydrophobicContact CD1-CD1 4.27Å; L271-F285 HydrophobicContact CD1-CE1 3.9Å; L271-F285 HydrophobicContact CD1-CE2 4.18Å; L271-F285 HydrophobicContact CD1-CZ 3.87Å; T272-F285 VanDerWaalsContact OG1-C 3.27Å; T272-F285 WeakPolarHBondContact OG1-CB 3.21Å; F275-F285 AromaticContact CD2-CD2 3.98Å; F275-F285 HydrophobicContact CD2-CD2 3.98Å; F275-F285 HydrophobicContact CD2-CE2 4.11Å; F275-F285 AromaticContact CE2-CD2 3.95Å; F275-F285 HydrophobicContact CE2-CD2 3.95Å; F275-F285 AromaticContact CE2-CE2 3.6Å; F275-F285 HydrophobicContact CE2-CE2 3.6Å; F275-F285 HydrophobicContact CZ-CE2 4.47Å; N281-F285 HydrophobicContact CB-CD2 4.39Å; N281-F285 HydrophobicContact CB-CE2 4.15Å; N281-F285 WeakPolarHBondContact O-CD2 3.46Å; N281-F285 WeakPolarHBondContact O-CG 3.31Å; N281-F285 PolarHBondContact O-N 3.12Å; F285-V288 PolarHBondContact O-N 2.57Å; F285-V289 WeakPolarHBondContact O-CG2 3.11Å; F285-V289 PolarHBondContact O-N 3.09Å |
| 286 | Q | 94.8 | Very high | 90.8 | Very high | 24 Ų | 24 | 43.1 Ų | 43.1 | 11% | 0.112 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -62.1 | -45.8 | 173 | 176.3 | 178.8 | -32 | 0 | 0 | 111.8 | T272 A282 K283 F284 V288 V289 F290 L319 R322 | T272-Q286 HydrophobicContact CG2-CB 3.93Å; T272-Q286 PolarHBondContact OG1-N 3.03Å; A282-Q286 WeakPolarHBondContact O-CB 3.5Å; A282-Q286 PolarHBondContact O-N 3.32Å; K283-Q286 PolarHBondContact O-N 2.97Å; F284-Q286 VanDerWaalsContact C-N 3.31Å; F284-Q286 PolarHBondContact O-N 3.38Å; Q286-V288 VanDerWaalsContact C-N 3.34Å; Q286-V288 PolarHBondContact O-N 3.4Å; Q286-V289 PolarHBondContact O-N 3.24Å; Q286-F290 HydrophobicContact CG-CD2 3.9Å; Q286-F290 HydrophobicContact CG-CE2 3.37Å; Q286-F290 HydrophobicContact CG-CZ 3.96Å; Q286-F290 WeakPolarHBondContact O-CD2 3.46Å; Q286-F290 PolarHBondContact O-N 2.94Å; Q286-L319 HydrophobicContact CG-CD2 4.48Å; Q286-R322 VanDerWaalsContact OE1-CB 3.23Å |
| 287 | E | 93.9 | Very high | 90.8 | Very high | 129 Ų | 129 | 38.9 Ų | 38.9 | 60% | 0.603 | 19% | 0.191 | S | C | * | . | H | α-helix | trans | -61.5 | -43.5 | 176.7 | -176.7 | 176.1 | -174.3 | 0 | 0 | 111.4 | K283 F284 V289 F290 T291 | K283-E287 WeakPolarHBondContact O-CB 3.48Å; K283-E287 PolarHBondContact O-N 3.43Å; F284-E287 PolarHBondContact O-N 3.02Å; E287-V289 PolarHBondContact O-N 3.42Å; E287-F290 PolarHBondContact O-N 2.86Å; E287-T291 WeakPolarHBondContact O-CB 3.42Å; E287-T291 PolarHBondContact O-N 3.39Å; E287-T291 PolarHBondContact O-OG1 3.04Å |
| 288 | V | 93.6 | Very high | 90.7 | Very high | 10 Ų | 10 | 40.2 Ų | 40.2 | 6% | 0.061 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -59 | -47.8 | 173.5 | 171 | 0 | 0 | 0 | 0 | 110.5 | T241 V245 C268 F284 F285 Q286 F290 T291 L292 | T241-V288 HydrophobicContact CG2-CG1 4.16Å; T241-V288 HydrophobicContact CG2-CG2 4.23Å; V245-V288 HydrophobicContact CG2-CG1 3.91Å; C268-V288 HydrophobicContact CB-CG1 4.15Å; F284-V288 HydrophobicContact CD1-CG2 4.29Å; F284-V288 HydrophobicContact CE1-CG2 3.85Å; F284-V288 HydrophobicContact CE2-CG2 4.27Å; F284-V288 HydrophobicContact CZ-CG2 3.85Å; F284-V288 WeakPolarHBondContact O-CG2 3.17Å; F284-V288 PolarHBondContact O-N 3.23Å; F285-V288 PolarHBondContact O-N 2.57Å; Q286-V288 VanDerWaalsContact C-N 3.34Å; Q286-V288 PolarHBondContact O-N 3.4Å; V288-F290 PolarHBondContact O-N 3.44Å; V288-T291 PolarHBondContact O-N 3.33Å; V288-L292 HydrophobicContact CG1-CD1 3.87Å; V288-L292 HydrophobicContact CG1-CG 4.12Å; V288-L292 WeakPolarHBondContact O-CB 3.47Å; V288-L292 VanDerWaalsContact O-CG 3.25Å; V288-L292 WeakPolarHBondContact O-CG 3.26Å; V288-L292 PolarHBondContact O-N 2.61Å |
| 289 | V | 95.4 | Very high | 90.2 | Very high | 0 Ų | 0 | 38.2 Ų | 38.2 | 0% | 0 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -56.7 | -49.3 | 179.4 | 169.7 | 0 | 0 | 0 | 0 | 111.4 | M265 C268 A269 F285 Q286 E287 L292 M293 V311 L319 | M265-V289 HydrophobicContact CG-CG1 4.4Å; C268-V289 HydrophobicContact CB-CG2 3.65Å; A269-V289 HydrophobicContact CB-CG1 4.42Å; A269-V289 HydrophobicContact CB-CG2 3.86Å; F285-V289 WeakPolarHBondContact O-CG2 3.11Å; F285-V289 PolarHBondContact O-N 3.09Å; Q286-V289 PolarHBondContact O-N 3.24Å; E287-V289 PolarHBondContact O-N 3.42Å; V289-L292 PolarHBondContact O-N 2.7Å; V289-M293 HydrophobicContact CG1-CE 3.76Å; V289-M293 HydrophobicContact CG1-CG 4.46Å; V289-M293 HydrophobicContact CG1-SD 4.16Å; V289-M293 WeakPolarHBondContact O-CB 3.36Å; V289-M293 WeakPolarHBondContact O-CG 3.43Å; V289-M293 PolarHBondContact O-N 2.86Å; V289-V311 HydrophobicContact CG1-CG1 4.44Å; V289-L319 HydrophobicContact CG1-CD1 4.13Å; V289-L319 HydrophobicContact CG1-CD2 4.45Å |
| 290 | F | 94.5 | Very high | 89.8 | Confident | 16 Ų | 16 | 41.3 Ų | 41.3 | 7% | 0.07 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -68.1 | -38.2 | -179.2 | -63.8 | -36 | 0 | 0 | 0 | 112.7 | Q286 E287 V288 M293 N294 L319 D323 A326 V327 I330 | Q286-F290 HydrophobicContact CG-CD2 3.9Å; Q286-F290 HydrophobicContact CG-CE2 3.37Å; Q286-F290 HydrophobicContact CG-CZ 3.96Å; Q286-F290 WeakPolarHBondContact O-CD2 3.46Å; Q286-F290 PolarHBondContact O-N 2.94Å; E287-F290 PolarHBondContact O-N 2.86Å; V288-F290 PolarHBondContact O-N 3.44Å; F290-M293 HydrophobicContact CD1-SD 4.47Å; F290-M293 PolarHBondContact O-N 3.45Å; F290-N294 PolarHBondContact O-N 3.19Å; F290-N294 PolarHBondContact O-ND2 2.88Å; F290-L319 HydrophobicContact CE1-CB 4.29Å; F290-L319 HydrophobicContact CE1-CD1 4.49Å; F290-L319 HydrophobicContact CE1-CD2 4.23Å; F290-L319 HydrophobicContact CZ-CB 4.28Å; F290-L319 HydrophobicContact CZ-CD2 4.2Å; F290-D323 HydrophobicContact CE2-CB 3.79Å; F290-D323 HydrophobicContact CZ-CB 4.18Å; F290-A326 HydrophobicContact CD1-CB 4.4Å; F290-A326 HydrophobicContact CD2-CB 3.81Å; F290-A326 HydrophobicContact CE1-CB 4.36Å; F290-A326 HydrophobicContact CE2-CB 3.73Å; F290-A326 HydrophobicContact CG-CB 4.15Å; F290-A326 HydrophobicContact CZ-CB 4.03Å; F290-V327 HydrophobicContact CE1-CG2 3.75Å; F290-V327 HydrophobicContact CZ-CG2 3.85Å; F290-I330 HydrophobicContact CD1-CD1 3.71Å; F290-I330 HydrophobicContact CE1-CD1 4.38Å; F290-I330 HydrophobicContact CG-CD1 4.47Å |
| 291 | T | 91.2 | Very high | 89.5 | Confident | 54 Ų | 54 | 38.4 Ų | 38.4 | 33% | 0.331 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -58.4 | -50.9 | 173.9 | -59 | 0 | 0 | 0 | 0 | 110.2 | V245 E287 V288 M293 N294 D295 | V245-T291 HydrophobicContact CG1-CG2 4.43Å; E287-T291 WeakPolarHBondContact O-CB 3.42Å; E287-T291 PolarHBondContact O-N 3.39Å; E287-T291 PolarHBondContact O-OG1 3.04Å; V288-T291 PolarHBondContact O-N 3.33Å; T291-M293 PolarHBondContact O-N 2.91Å; T291-N294 PolarHBondContact O-N 2.94Å; T291-D295 PolarHBondContact O-N 3.34Å |
| 292 | L | 91.2 | Very high | 89.1 | Confident | 0 Ų | 0 | 39.5 Ų | 39.5 | 0% | 0 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -65.3 | -37.9 | -180 | -63.3 | -173.5 | 0 | 0 | 0 | 112.7 | V245 L261 L264 M265 V288 V289 D295 L296 | V245-L292 HydrophobicContact CG1-CD2 4.21Å; V245-L292 HydrophobicContact CG2-CD2 4.08Å; L261-L292 HydrophobicContact CD2-CD2 3.3Å; L261-L292 HydrophobicContact CD2-CG 4.34Å; L264-L292 HydrophobicContact CB-CD1 4.17Å; L264-L292 HydrophobicContact CD2-CD1 4.19Å; L264-L292 HydrophobicContact CG-CD1 4.27Å; M265-L292 HydrophobicContact CB-CB 4Å; M265-L292 HydrophobicContact CB-CD1 3.91Å; M265-L292 HydrophobicContact CG-CB 4.26Å; V288-L292 HydrophobicContact CG1-CD1 3.87Å; V288-L292 HydrophobicContact CG1-CG 4.12Å; V288-L292 WeakPolarHBondContact O-CB 3.47Å; V288-L292 VanDerWaalsContact O-CG 3.25Å; V288-L292 WeakPolarHBondContact O-CG 3.26Å; V288-L292 PolarHBondContact O-N 2.61Å; V289-L292 PolarHBondContact O-N 2.7Å; L292-D295 PolarHBondContact O-N 2.9Å; L292-L296 VanDerWaalsContact O-CB 3.25Å; L292-L296 WeakPolarHBondContact O-CB 3.42Å; L292-L296 WeakPolarHBondContact O-CD1 3.21Å; L292-L296 WeakPolarHBondContact O-CG 3.44Å; L292-L296 PolarHBondContact O-N 3.39Å |
| 293 | M | 92.7 | Very high | 88.7 | Confident | 0 Ų | 0 | 40.4 Ų | 40.4 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -60.7 | -46.8 | 174.5 | -77.4 | -175.8 | 176.3 | 0 | 0 | 111.5 | M265 V289 F290 T291 L296 L297 I308 V311 L312 L319 I330 | M265-M293 HydrophobicContact CG-CG 4.24Å; M265-M293 HydrophobicContact SD-CB 4.29Å; M265-M293 HydrophobicContact SD-CE 4.19Å; M265-M293 HydrophobicContact SD-CG 3.34Å; M265-M293 WeakPolarHBondContact SD-CG 3.29Å; V289-M293 HydrophobicContact CG1-CE 3.76Å; V289-M293 HydrophobicContact CG1-CG 4.46Å; V289-M293 HydrophobicContact CG1-SD 4.16Å; V289-M293 WeakPolarHBondContact O-CB 3.36Å; V289-M293 WeakPolarHBondContact O-CG 3.43Å; V289-M293 PolarHBondContact O-N 2.86Å; F290-M293 HydrophobicContact CD1-SD 4.47Å; F290-M293 PolarHBondContact O-N 3.45Å; T291-M293 PolarHBondContact O-N 2.91Å; M293-L296 PolarHBondContact O-N 3.46Å; M293-L297 WeakPolarHBondContact O-CB 3.4Å; M293-L297 VanDerWaalsContact O-CG 3.31Å; M293-L297 WeakPolarHBondContact O-CG 3.5Å; M293-L297 PolarHBondContact O-N 3.28Å; M293-I308 HydrophobicContact CE-CG2 4.35Å; M293-I308 HydrophobicContact CG-CG1 4.22Å; M293-I308 HydrophobicContact CG-CG2 4.12Å; M293-I308 WeakPolarHBondContact O-CD1 3.43Å; M293-I308 HydrophobicContact SD-CG2 4.14Å; M293-V311 HydrophobicContact CE-CB 3.72Å; M293-V311 HydrophobicContact CE-CG1 3.27Å; M293-L312 HydrophobicContact CE-CD2 3.88Å; M293-L312 HydrophobicContact CE-CG 3.88Å; M293-L312 HydrophobicContact SD-CD2 4.11Å; M293-L312 HydrophobicContact SD-CG 4.32Å; M293-L319 HydrophobicContact CE-CD1 4.41Å; M293-I330 HydrophobicContact CB-CD1 3.89Å; M293-I330 HydrophobicContact CG-CD1 4.43Å; M293-I330 HydrophobicContact SD-CD1 3.7Å; M293-I330 HydrophobicContact SD-CG2 4.17Å |
| 294 | N | 90.5 | Very high | 88.4 | Confident | 77 Ų | 77 | 34.7 Ų | 34.7 | 41% | 0.412 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -63 | -45.7 | 178.9 | -74 | -42.8 | 0 | 0 | 0 | 111.3 | F290 T291 L296 L297 I298 | F290-N294 PolarHBondContact O-N 3.19Å; F290-N294 PolarHBondContact O-ND2 2.88Å; T291-N294 PolarHBondContact O-N 2.94Å; N294-L296 VanDerWaalsContact C-N 3.34Å; N294-L296 PolarHBondContact O-N 3.4Å; N294-L297 PolarHBondContact O-N 2.87Å; N294-I298 PolarHBondContact O-N 3.01Å |
| 295 | D | 85.7 | Confident | 88 | Confident | 34 Ų | 34 | 32.6 Ų | 32.6 | 18% | 0.182 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -62.2 | -41.1 | 178.4 | -72 | -12.7 | 0 | 0 | 0 | 112.3 | T291 L292 L297 I298 | T291-D295 PolarHBondContact O-N 3.34Å; L292-D295 PolarHBondContact O-N 2.9Å; D295-L297 VanDerWaalsContact C-N 3.34Å; D295-I298 WeakPolarHBondContact O-CB 3.3Å; D295-I298 PolarHBondContact O-N 3.33Å |
| 296 | L | 86 | Confident | 87.7 | Confident | 0 Ų | 0 | 36.9 Ų | 36.9 | 0% | 0 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -69.9 | -30.3 | 178 | -73.3 | 171.4 | 0 | 0 | 0 | 112.3 | L261 R262 M265 L292 M293 N294 I298 N304 I308 | L261-L296 HydrophobicContact CB-CD1 4.47Å; L261-L296 HydrophobicContact CB-CD2 3.9Å; L261-L296 HydrophobicContact CB-CG 4.42Å; L261-L296 HydrophobicContact CD1-CD2 4.36Å; R262-L296 HydrophobicContact CG-CD1 4.07Å; R262-L296 HydrophobicContact CG-CD2 4.2Å; M265-L296 HydrophobicContact CE-CD1 4.04Å; M265-L296 HydrophobicContact SD-CD1 3.84Å; L292-L296 VanDerWaalsContact O-CB 3.25Å; L292-L296 WeakPolarHBondContact O-CB 3.42Å; L292-L296 WeakPolarHBondContact O-CD1 3.21Å; L292-L296 WeakPolarHBondContact O-CG 3.44Å; L292-L296 PolarHBondContact O-N 3.39Å; M293-L296 PolarHBondContact O-N 3.46Å; N294-L296 VanDerWaalsContact C-N 3.34Å; N294-L296 PolarHBondContact O-N 3.4Å; L296-I298 VanDerWaalsContact C-N 3.3Å; L296-I298 PolarHBondContact O-N 3.15Å; L296-N304 HydrophobicContact CB-CB 4.12Å; L296-N304 HydrophobicContact CD2-CB 4.37Å; L296-N304 WeakPolarHBondContact CD2-OD1 3.04Å; L296-N304 WeakPolarHBondContact O-CB 3.15Å; L296-N304 PolarHBondContact O-ND2 3.13Å; L296-I308 HydrophobicContact CB-CD1 3.96Å |
| 297 | L | 87.3 | Confident | 87.4 | Confident | 10 Ų | 10 | 35.8 Ų | 35.8 | 5% | 0.052 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -69.4 | -23.6 | 175.4 | -78.8 | 172.9 | 0 | 0 | 0 | 113.4 | M293 N294 D295 C299 K300 I308 I330 T333 L334 I337 | M293-L297 WeakPolarHBondContact O-CB 3.4Å; M293-L297 VanDerWaalsContact O-CG 3.31Å; M293-L297 WeakPolarHBondContact O-CG 3.5Å; M293-L297 PolarHBondContact O-N 3.28Å; N294-L297 PolarHBondContact O-N 2.87Å; D295-L297 VanDerWaalsContact C-N 3.34Å; L297-C299 VanDerWaalsContact C-N 3.31Å; L297-C299 PolarHBondContact O-N 3.48Å; L297-K300 WeakPolarHBondContact O-CG 3.01Å; L297-K300 PolarHBondContact O-N 3.14Å; L297-I308 HydrophobicContact CD1-CD1 4.46Å; L297-I308 HydrophobicContact CD2-CD1 3.76Å; L297-I308 HydrophobicContact CG-CD1 3.59Å; L297-I330 HydrophobicContact CD1-CG2 4.04Å; L297-T333 HydrophobicContact CD1-CG2 3.99Å; L297-L334 HydrophobicContact CD2-CD2 3.59Å; L297-L334 HydrophobicContact CD2-CG 4.06Å; L297-I337 HydrophobicContact CD2-CD1 4Å |
| 298 | I | 83.2 | Confident | 87.3 | Confident | 121 Ų | 121 | 29.6 Ų | 29.6 | 62% | 0.621 | 16% | 0.158 | S | C | * | . | H | α-helix | trans | -59.9 | -43.7 | 177.8 | -64.1 | 170.7 | 0 | 0 | 0 | 110.5 | N294 D295 L296 | N294-I298 PolarHBondContact O-N 3.01Å; D295-I298 WeakPolarHBondContact O-CB 3.3Å; D295-I298 PolarHBondContact O-N 3.33Å; L296-I298 VanDerWaalsContact C-N 3.3Å; L296-I298 PolarHBondContact O-N 3.15Å |
| 299 | C | 76.2 | Confident | 87.2 | Confident | 46 Ų | 46 | 29.5 Ų | 29.5 | 31% | 0.311 | 16% | 0.158 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -83.4 | -10 | -176.8 | -57.5 | 0 | 0 | 0 | 0 | 114.5 | S252 L297 S301 | S252-C299 VanDerWaalsContact C-SG 3.59Å; L297-C299 VanDerWaalsContact C-N 3.31Å; L297-C299 PolarHBondContact O-N 3.48Å; C299-S301 PolarHBondContact O-N 2.83Å |
| 300 | K | 79 | Confident | 87 | Confident | 75 Ų | 75 | 32.6 Ų | 32.6 | 33% | 0.326 | 17% | 0.172 | S | C | . | . | trans | 46.7 | 22.9 | 174.7 | -55.8 | 178.9 | -174.7 | 170.9 | 0 | 116.4 | L297 I305 I337 | L297-K300 WeakPolarHBondContact O-CG 3.01Å; L297-K300 PolarHBondContact O-N 3.14Å; K300-I305 WeakPolarHBondContact O-CD1 3.35Å; K300-I337 HydrophobicContact CD-CD1 4.19Å; K300-I337 HydrophobicContact CD-CG1 4.17Å; K300-I337 HydrophobicContact CG-CD1 3.95Å; K300-I337 HydrophobicContact CG-CG1 4.46Å | ||
| 301 | S | 80.8 | Confident | 87 | Confident | 34 Ų | 34 | 31.8 Ų | 31.8 | 24% | 0.238 | 17% | 0.169 | C | C | . | . | trans | -71.3 | 151.5 | -179.6 | 73.4 | 0 | 0 | 0 | 0 | 111.3 | R262 C299 G303 N304 I305 | R262-S301 PolarHBondContact NH2-OG 2.81Å; C299-S301 PolarHBondContact O-N 2.83Å; S301-G303 PolarHBondContact O-N 3Å; S301-N304 PolarHBondContact O-N 3.4Å; S301-N304 VanDerWaalsContact O-N 3.11Å; S301-N304 WeakPolarHBondContact OG-CB 3.39Å; S301-N304 PolarHBondContact OG-N 3.43Å; S301-N304 PolarHBondContact OG-ND2 3.23Å; S301-N304 PolarHBondContact OG-OD1 3.47Å; S301-I305 WeakPolarHBondContact O-CG1 3.39Å; S301-I305 PolarHBondContact O-N 3.21Å | ||
| 302 | L | 82.3 | Confident | 87.2 | Confident | 36 Ų | 36 | 29.2 Ų | 29.2 | 19% | 0.188 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -55.6 | -41.8 | 178 | 174.6 | 61.4 | 0 | 0 | 0 | 111.7 | I305 R306 I344 V346 V347 L350 | L302-I305 PolarHBondContact O-N 3.45Å; L302-R306 VanDerWaalsContact O-CB 3.25Å; L302-R306 WeakPolarHBondContact O-CB 3.29Å; L302-R306 PolarHBondContact O-N 2.91Å; L302-I344 HydrophobicContact CB-CD1 4.26Å; L302-I344 HydrophobicContact CD1-CD1 4.11Å; L302-I344 HydrophobicContact CD2-CD1 4.18Å; L302-I344 HydrophobicContact CG-CD1 4.41Å; L302-V346 HydrophobicContact CD1-CB 4.44Å; L302-V346 HydrophobicContact CD1-CG1 3.89Å; L302-V347 HydrophobicContact CD1-CG2 3.69Å; L302-L350 HydrophobicContact CD1-CD1 4.13Å |
| 303 | G | 81.9 | Confident | 87.3 | Confident | 18 Ų | 18 | 32.7 Ų | 32.7 | 19% | 0.186 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -63.2 | -40.3 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | S301 A307 | S301-G303 PolarHBondContact O-N 3Å; G303-A307 WeakPolarHBondContact O-CB 3.37Å; G303-A307 PolarHBondContact O-N 3.36Å |
| 304 | N | 85.6 | Confident | 87.2 | Confident | 1 Ų | 1 | 35.8 Ų | 35.8 | 1% | 0.005 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -66.1 | -49 | 175.6 | -70.9 | 3.8 | 0 | 0 | 0 | 110.7 | R262 L296 S301 R306 A307 I308 | R262-N304 PolarHBondContact NE-OD1 2.87Å; R262-N304 PolarHBondContact NH2-OD1 3.4Å; L296-N304 HydrophobicContact CB-CB 4.12Å; L296-N304 HydrophobicContact CD2-CB 4.37Å; L296-N304 WeakPolarHBondContact CD2-OD1 3.04Å; L296-N304 WeakPolarHBondContact O-CB 3.15Å; L296-N304 PolarHBondContact O-ND2 3.13Å; S301-N304 PolarHBondContact O-N 3.4Å; S301-N304 VanDerWaalsContact O-N 3.11Å; S301-N304 WeakPolarHBondContact OG-CB 3.39Å; S301-N304 PolarHBondContact OG-N 3.43Å; S301-N304 PolarHBondContact OG-ND2 3.23Å; S301-N304 PolarHBondContact OG-OD1 3.47Å; N304-R306 VanDerWaalsContact C-N 3.32Å; N304-R306 PolarHBondContact O-N 2.87Å; N304-A307 PolarHBondContact O-N 3.11Å; N304-I308 VanDerWaalsContact O-CG1 3.31Å; N304-I308 WeakPolarHBondContact O-CG1 3.42Å; N304-I308 PolarHBondContact O-N 2.95Å |
| 305 | I | 86.4 | Confident | 87.4 | Confident | 0 Ų | 0 | 32.7 Ų | 32.7 | 0% | 0 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -59.3 | -45.5 | 179.2 | -67.6 | 169.5 | 0 | 0 | 0 | 110.4 | K300 S301 L302 A307 I308 V309 L334 I337 V347 | K300-I305 WeakPolarHBondContact O-CD1 3.35Å; S301-I305 WeakPolarHBondContact O-CG1 3.39Å; S301-I305 PolarHBondContact O-N 3.21Å; L302-I305 PolarHBondContact O-N 3.45Å; I305-A307 VanDerWaalsContact C-N 3.34Å; I305-A307 PolarHBondContact O-N 2.9Å; I305-I308 PolarHBondContact O-N 3.41Å; I305-V309 HydrophobicContact CG2-CG2 4.21Å; I305-V309 WeakPolarHBondContact O-CB 3.05Å; I305-V309 VanDerWaalsContact O-CG2 3.25Å; I305-V309 WeakPolarHBondContact O-CG2 3.3Å; I305-V309 PolarHBondContact O-N 3.17Å; I305-L334 HydrophobicContact CG1-CD2 4.42Å; I305-L334 HydrophobicContact CG2-CD2 4.06Å; I305-I337 HydrophobicContact CD1-CG2 3.99Å; I305-V347 HydrophobicContact CD1-CG1 4Å; I305-V347 HydrophobicContact CD1-CG2 4Å; I305-V347 HydrophobicContact CG2-CG1 4.17Å; I305-V347 HydrophobicContact CG2-CG2 4.4Å |
| 306 | R | 89.5 | Confident | 87.8 | Confident | 89 Ų | 89 | 31.1 Ų | 31.1 | 34% | 0.336 | 16% | 0.162 | S | C | . | . | H | α-helix | trans | -60.2 | -43.3 | 177.6 | -174.5 | -177.6 | -71.4 | 174 | -1.8 | 111.7 | C79 L302 N304 H310 L350 | C79-R306 PolarHBondContact O-NH1 3.14Å; C79-R306 VanDerWaalsContact O-NH1 3.11Å; L302-R306 VanDerWaalsContact O-CB 3.25Å; L302-R306 WeakPolarHBondContact O-CB 3.29Å; L302-R306 PolarHBondContact O-N 2.91Å; N304-R306 VanDerWaalsContact C-N 3.32Å; N304-R306 PolarHBondContact O-N 2.87Å; R306-H310 VanDerWaalsContact O-CB 3.29Å; R306-H310 WeakPolarHBondContact O-CB 3.33Å; R306-H310 PolarHBondContact O-N 3.13Å; R306-L350 HydrophobicContact CB-CD1 4.22Å; R306-L350 HydrophobicContact CG-CD1 4.46Å |
| 307 | A | 88.6 | Confident | 88.1 | Confident | 1 Ų | 1 | 33 Ų | 33 | 1% | 0.008 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -64 | -43.8 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | Y207 R262 M265 G303 N304 I305 H310 V311 | Y207-A307 VanDerWaalsContact OH-CB 3.26Å; Y207-A307 WeakPolarHBondContact OH-CB 3.48Å; R262-A307 HydrophobicContact CB-CB 3.74Å; R262-A307 HydrophobicContact CG-CB 3.55Å; M265-A307 HydrophobicContact CE-CB 3.8Å; G303-A307 WeakPolarHBondContact O-CB 3.37Å; G303-A307 PolarHBondContact O-N 3.36Å; N304-A307 PolarHBondContact O-N 3.11Å; I305-A307 VanDerWaalsContact C-N 3.34Å; I305-A307 PolarHBondContact O-N 2.9Å; A307-H310 WeakPolarHBondContact O-CB 3.35Å; A307-H310 PolarHBondContact O-N 2.86Å; A307-V311 WeakPolarHBondContact O-CG2 3.38Å; A307-V311 PolarHBondContact O-N 3.49Å |
| 308 | I | 92 | Very high | 88.4 | Confident | 0 Ų | 0 | 34.6 Ų | 34.6 | 0% | 0 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -66 | -46.1 | 178.8 | -63.4 | 172.1 | 0 | 0 | 0 | 110.5 | M265 M293 L296 L297 N304 I305 H310 V311 L312 I330 L334 | M265-I308 HydrophobicContact CE-CG1 3.92Å; M265-I308 HydrophobicContact SD-CG1 4.01Å; M293-I308 HydrophobicContact CE-CG2 4.35Å; M293-I308 HydrophobicContact CG-CG1 4.22Å; M293-I308 HydrophobicContact CG-CG2 4.12Å; M293-I308 WeakPolarHBondContact O-CD1 3.43Å; M293-I308 HydrophobicContact SD-CG2 4.14Å; L296-I308 HydrophobicContact CB-CD1 3.96Å; L297-I308 HydrophobicContact CD1-CD1 4.46Å; L297-I308 HydrophobicContact CD2-CD1 3.76Å; L297-I308 HydrophobicContact CG-CD1 3.59Å; N304-I308 VanDerWaalsContact O-CG1 3.31Å; N304-I308 WeakPolarHBondContact O-CG1 3.42Å; N304-I308 PolarHBondContact O-N 2.95Å; I305-I308 PolarHBondContact O-N 3.41Å; I308-H310 VanDerWaalsContact C-N 3.3Å; I308-H310 PolarHBondContact O-N 3.39Å; I308-V311 PolarHBondContact O-N 3.46Å; I308-L312 HydrophobicContact CG2-CD1 3.89Å; I308-L312 HydrophobicContact CG2-CG 4.33Å; I308-L312 WeakPolarHBondContact O-CB 3.16Å; I308-L312 WeakPolarHBondContact O-CG 3.31Å; I308-L312 PolarHBondContact O-N 3.18Å; I308-I330 HydrophobicContact CG2-CG2 4.05Å; I308-L334 HydrophobicContact CG2-CD1 3.94Å |
| 309 | V | 91.7 | Very high | 88.9 | Confident | 7 Ų | 7 | 28.9 Ų | 28.9 | 4% | 0.042 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -58.7 | -44 | 175.2 | 168.3 | 0 | 0 | 0 | 0 | 110.3 | I305 V311 L312 T313 L334 L350 L354 | I305-V309 HydrophobicContact CG2-CG2 4.21Å; I305-V309 WeakPolarHBondContact O-CB 3.05Å; I305-V309 VanDerWaalsContact O-CG2 3.25Å; I305-V309 WeakPolarHBondContact O-CG2 3.3Å; I305-V309 PolarHBondContact O-N 3.17Å; V309-V311 PolarHBondContact O-N 3.42Å; V309-L312 PolarHBondContact O-N 2.83Å; V309-T313 WeakPolarHBondContact O-CB 3.27Å; V309-T313 PolarHBondContact O-N 2.89Å; V309-T313 PolarHBondContact O-OG1 3.35Å; V309-L334 HydrophobicContact CG2-CD1 4.43Å; V309-L350 HydrophobicContact CG1-CB 4.34Å; V309-L350 HydrophobicContact CG1-CD2 4.31Å; V309-L350 HydrophobicContact CG2-CB 4.31Å; V309-L354 HydrophobicContact CG1-CB 4.18Å; V309-L354 HydrophobicContact CG2-CD2 4.06Å |
| 310 | H | 91.6 | Very high | 89.8 | Confident | 65 Ų | 65 | 27.5 Ų | 27.5 | 30% | 0.301 | 14% | 0.14 | S | C | . | . | H | α-helix | trans | -57.7 | -50.8 | 176.1 | 172.1 | 61.1 | 0 | 0 | 0 | 112 | Y207 R306 A307 I308 L312 T313 E314 | Y207-H310 AromaticContact CE1-CD2 3.83Å; R306-H310 VanDerWaalsContact O-CB 3.29Å; R306-H310 WeakPolarHBondContact O-CB 3.33Å; R306-H310 PolarHBondContact O-N 3.13Å; A307-H310 WeakPolarHBondContact O-CB 3.35Å; A307-H310 PolarHBondContact O-N 2.86Å; I308-H310 VanDerWaalsContact C-N 3.3Å; I308-H310 PolarHBondContact O-N 3.39Å; H310-L312 PolarHBondContact O-N 3.28Å; H310-T313 PolarHBondContact O-N 3.33Å; H310-E314 IonicContact CE1-OE2 3.21Å; H310-E314 PolarHBondContact CE1-OE2 3.32Å; H310-E314 IonicContact NE2-OE2 3.77Å; H310-E314 PolarHBondContact NE2-OE2 3.43Å; H310-E314 WeakPolarHBondContact O-CB 3.47Å; H310-E314 PolarHBondContact O-N 3.35Å |
| 311 | V | 93.8 | Very high | 90.4 | Very high | 0 Ų | 0 | 29.1 Ų | 29.1 | 0% | 0 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -62.8 | -42.1 | 179.6 | 172 | 0 | 0 | 0 | 0 | 111.8 | M265 A266 A269 V289 M293 A307 I308 V309 E314 Y315 L319 | M265-V311 HydrophobicContact CE-CB 4.37Å; M265-V311 HydrophobicContact CE-CG2 3.79Å; M265-V311 HydrophobicContact CG-CG2 4.36Å; A266-V311 HydrophobicContact CB-CG2 4.04Å; A269-V311 HydrophobicContact CB-CG1 3.42Å; A269-V311 VanDerWaalsContact CB-CG1 3.42Å; V289-V311 HydrophobicContact CG1-CG1 4.44Å; M293-V311 HydrophobicContact CE-CB 3.72Å; M293-V311 HydrophobicContact CE-CG1 3.27Å; A307-V311 WeakPolarHBondContact O-CG2 3.38Å; A307-V311 PolarHBondContact O-N 3.49Å; I308-V311 PolarHBondContact O-N 3.46Å; V309-V311 PolarHBondContact O-N 3.42Å; V311-E314 PolarHBondContact O-N 3.05Å; V311-Y315 HydrophobicContact CG1-CD2 4.13Å; V311-Y315 WeakPolarHBondContact O-CD2 3.33Å; V311-Y315 PolarHBondContact O-N 3.39Å; V311-L319 HydrophobicContact CG1-CD1 4.35Å |
| 312 | L | 95.5 | Very high | 90.9 | Very high | 0 Ų | 0 | 30 Ų | 30 | 0% | 0 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -70.6 | -37.3 | 178.2 | -69.9 | 175.1 | 0 | 0 | 0 | 112.3 | M293 I308 V309 H310 E314 G316 L319 V327 I330 V331 L334 L354 W361 | M293-L312 HydrophobicContact CE-CD2 3.88Å; M293-L312 HydrophobicContact CE-CG 3.88Å; M293-L312 HydrophobicContact SD-CD2 4.11Å; M293-L312 HydrophobicContact SD-CG 4.32Å; I308-L312 HydrophobicContact CG2-CD1 3.89Å; I308-L312 HydrophobicContact CG2-CG 4.33Å; I308-L312 WeakPolarHBondContact O-CB 3.16Å; I308-L312 WeakPolarHBondContact O-CG 3.31Å; I308-L312 PolarHBondContact O-N 3.18Å; V309-L312 PolarHBondContact O-N 2.83Å; H310-L312 PolarHBondContact O-N 3.28Å; L312-E314 VanDerWaalsContact C-N 3.27Å; L312-E314 PolarHBondContact O-N 3.21Å; L312-G316 WeakPolarHBondContact O-CA 3.31Å; L312-G316 PolarHBondContact O-N 3.02Å; L312-L319 HydrophobicContact CD2-CD1 4.4Å; L312-V327 HydrophobicContact CD2-CG1 4.27Å; L312-I330 HydrophobicContact CD1-CG2 3.93Å; L312-V331 HydrophobicContact CD1-CG2 4.22Å; L312-L334 HydrophobicContact CD1-CD1 3.97Å; L312-L354 HydrophobicContact CB-CD1 3.56Å; L312-L354 HydrophobicContact CB-CD2 4.45Å; L312-L354 HydrophobicContact CD1-CD1 4.4Å; L312-L354 HydrophobicContact CD1-CD2 3.86Å; L312-W361 HydrophobicContact CB-CH2 4.17Å; L312-W361 WeakPolarHBondContact O-CZ2 3.24Å |
| 313 | T | 92.5 | Very high | 91.4 | Very high | 72 Ų | 72 | 30.9 Ų | 30.9 | 44% | 0.442 | 15% | 0.152 | S | C | . | . | H | α-helix | trans | -64.3 | -37.2 | 175.6 | -63.3 | 0 | 0 | 0 | 0 | 111.2 | V309 H310 | V309-T313 WeakPolarHBondContact O-CB 3.27Å; V309-T313 PolarHBondContact O-N 2.89Å; V309-T313 PolarHBondContact O-OG1 3.35Å; H310-T313 PolarHBondContact O-N 3.33Å |
| 314 | E | 91.4 | Very high | 92 | Very high | 66 Ų | 66 | 35.7 Ų | 35.7 | 31% | 0.308 | 17% | 0.168 | S | C | . | . | H | α-helix | trans | -85.9 | -38.1 | -175.6 | -172.3 | 165.9 | -172.7 | 0 | 0 | 114.3 | Y210 K211 H310 V311 L312 | Y210-E314 PolarHBondContact OH-OE2 2.96Å; K211-E314 WeakPolarHBondContact CE-OE1 3.19Å; K211-E314 IonicContact NZ-OE1 3.85Å; K211-E314 PolarHBondContact NZ-OE1 2.84Å; K211-E314 IonicContact NZ-OE2 2.7Å; H310-E314 IonicContact CE1-OE2 3.21Å; H310-E314 PolarHBondContact CE1-OE2 3.32Å; H310-E314 IonicContact NE2-OE2 3.77Å; H310-E314 PolarHBondContact NE2-OE2 3.43Å; H310-E314 WeakPolarHBondContact O-CB 3.47Å; H310-E314 PolarHBondContact O-N 3.35Å; V311-E314 PolarHBondContact O-N 3.05Å; L312-E314 VanDerWaalsContact C-N 3.27Å; L312-E314 PolarHBondContact O-N 3.21Å |
| 315 | Y | 94.3 | Very high | 92.4 | Very high | 12 Ų | 12 | 41 Ų | 41 | 5% | 0.047 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -122.1 | 5.4 | -174.3 | -51.7 | -75.7 | 0 | 0 | 0 | 113.3 | Y210 K211 A269 H270 A273 V311 D317 I318 L319 | Y210-Y315 WeakPolarHBondContact CE2-OH 3.25Å; Y210-Y315 PolarHBondContact OH-OH 3.11Å; K211-Y315 WeakPolarHBondContact CE-OH 3.42Å; A269-Y315 HydrophobicContact CB-CD2 3.67Å; A269-Y315 HydrophobicContact CB-CE2 4.14Å; A269-Y315 HydrophobicContact CB-CG 4.15Å; H270-Y315 HydrophobicContact CB-CE1 4.31Å; H270-Y315 AromaticContact ND1-CE1 3.61Å; H270-Y315 AromaticContact ND1-CZ 3.56Å; H270-Y315 PolarHBondContact ND1-OH 3.43Å; A273-Y315 HydrophobicContact CB-CD1 3.94Å; A273-Y315 HydrophobicContact CB-CE1 4.34Å; V311-Y315 HydrophobicContact CG1-CD2 4.13Å; V311-Y315 WeakPolarHBondContact O-CD2 3.33Å; V311-Y315 PolarHBondContact O-N 3.39Å; Y315-D317 VanDerWaalsContact C-N 3.28Å; Y315-D317 PolarHBondContact O-N 3.5Å; Y315-I318 PolarHBondContact O-N 3.31Å; Y315-L319 WeakPolarHBondContact O-CG 3.46Å; Y315-L319 PolarHBondContact O-N 3.11Å |
| 316 | G | 93.3 | Very high | 92.8 | Very high | 0 Ų | 0 | 42 Ų | 42 | 0% | 0 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -66 | -28 | -171.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | L312 F320 | L312-G316 WeakPolarHBondContact O-CA 3.31Å; L312-G316 PolarHBondContact O-N 3.02Å; G316-F320 WeakPolarHBondContact O-CA 3.44Å; G316-F320 WeakPolarHBondContact O-CB 3.13Å; G316-F320 PolarHBondContact O-N 2.82Å |
| 317 | D | 93 | Very high | 93.1 | Very high | 41 Ų | 41 | 37.8 Ų | 37.8 | 22% | 0.219 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -61.7 | -50.7 | 172.6 | 61.1 | -26.8 | 0 | 0 | 0 | 111.6 | Y315 F320 Q321 W361 | Y315-D317 VanDerWaalsContact C-N 3.28Å; Y315-D317 PolarHBondContact O-N 3.5Å; D317-F320 PolarHBondContact O-N 3.28Å; D317-Q321 VanDerWaalsContact O-CG 3.29Å; D317-Q321 WeakPolarHBondContact O-CG 3.36Å; D317-Q321 PolarHBondContact O-N 3.04Å; D317-W361 HydrophobicContact CB-CB 4.36Å; D317-W361 HydrophobicContact CB-CG 4.07Å |
| 318 | I | 93.1 | Very high | 93.4 | Very high | 42 Ų | 42 | 40 Ų | 40 | 22% | 0.215 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -65.8 | -47.4 | 178.9 | -62.9 | 171 | 0 | 0 | 0 | 110 | A273 Y315 F320 Q321 R322 | A273-I318 HydrophobicContact CB-CD1 3.5Å; A273-I318 VanDerWaalsContact CB-CD1 3.5Å; Y315-I318 PolarHBondContact O-N 3.31Å; I318-F320 VanDerWaalsContact C-N 3.28Å; I318-F320 PolarHBondContact O-N 3Å; I318-Q321 PolarHBondContact O-N 2.77Å; I318-R322 WeakPolarHBondContact O-CG 3.32Å; I318-R322 PolarHBondContact O-N 2.99Å; I318-R322 VanDerWaalsContact O-N 3.12Å |
| 319 | L | 94.8 | Very high | 93.6 | Very high | 1 Ų | 1 | 42.4 Ų | 42.4 | 1% | 0.005 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -61.7 | -38.5 | 178.5 | -67.7 | 173.5 | 0 | 0 | 0 | 111.4 | T272 Q286 V289 F290 M293 V311 L312 Y315 R322 D323 V327 | T272-L319 HydrophobicContact CG2-CD2 4Å; Q286-L319 HydrophobicContact CG-CD2 4.48Å; V289-L319 HydrophobicContact CG1-CD1 4.13Å; V289-L319 HydrophobicContact CG1-CD2 4.45Å; F290-L319 HydrophobicContact CE1-CB 4.29Å; F290-L319 HydrophobicContact CE1-CD1 4.49Å; F290-L319 HydrophobicContact CE1-CD2 4.23Å; F290-L319 HydrophobicContact CZ-CB 4.28Å; F290-L319 HydrophobicContact CZ-CD2 4.2Å; M293-L319 HydrophobicContact CE-CD1 4.41Å; V311-L319 HydrophobicContact CG1-CD1 4.35Å; L312-L319 HydrophobicContact CD2-CD1 4.4Å; Y315-L319 WeakPolarHBondContact O-CG 3.46Å; Y315-L319 PolarHBondContact O-N 3.11Å; L319-R322 PolarHBondContact O-N 3.37Å; L319-D323 PolarHBondContact O-N 2.91Å; L319-V327 HydrophobicContact CB-CG2 3.81Å |
| 320 | F | 94.5 | Very high | 93.9 | Very high | 18 Ų | 18 | 42.1 Ų | 42.1 | 8% | 0.079 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -71.6 | -37.3 | 179.8 | -175.3 | -89.6 | 0 | 0 | 0 | 112.4 | G316 D317 I318 R322 K324 V327 L328 W361 | G316-F320 WeakPolarHBondContact O-CA 3.44Å; G316-F320 WeakPolarHBondContact O-CB 3.13Å; G316-F320 PolarHBondContact O-N 2.82Å; D317-F320 PolarHBondContact O-N 3.28Å; I318-F320 VanDerWaalsContact C-N 3.28Å; I318-F320 PolarHBondContact O-N 3Å; F320-R322 VanDerWaalsContact C-N 3.29Å; F320-R322 PolarHBondContact O-N 3.19Å; F320-K324 HydrophobicContact CD2-CG 4.39Å; F320-K324 HydrophobicContact CE1-CD 4.1Å; F320-K324 HydrophobicContact CE1-CG 4.13Å; F320-K324 HydrophobicContact CE2-CD 4.45Å; F320-K324 HydrophobicContact CE2-CG 3.79Å; F320-K324 HydrophobicContact CZ-CB 4.49Å; F320-K324 HydrophobicContact CZ-CD 3.81Å; F320-K324 HydrophobicContact CZ-CG 3.65Å; F320-K324 WeakPolarHBondContact O-CA 3.41Å; F320-K324 PolarHBondContact O-N 3.34Å; F320-K324 VanDerWaalsContact O-N 3.13Å; F320-V327 HydrophobicContact CB-CB 4.48Å; F320-V327 HydrophobicContact CB-CG1 4.28Å; F320-V327 HydrophobicContact CB-CG2 4.47Å; F320-V327 HydrophobicContact CD2-CB 4.11Å; F320-V327 HydrophobicContact CD2-CG1 3.87Å; F320-L328 HydrophobicContact CE2-CD1 4.45Å; F320-L328 HydrophobicContact CE2-CD2 3.86Å; F320-L328 HydrophobicContact CE2-CG 3.91Å; F320-W361 HydrophobicContact CB-CE3 4.08Å; F320-W361 HydrophobicContact CD2-CE3 4.19Å; F320-W361 HydrophobicContact CG-CE3 4.27Å |
| 321 | Q | 91.8 | Very high | 94 | Very high | 108 Ų | 108 | 39 Ų | 39 | 51% | 0.505 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -62.6 | -38.6 | 173.5 | -75.3 | 173.4 | 11.5 | 0 | 0 | 111.4 | D317 I318 | D317-Q321 VanDerWaalsContact O-CG 3.29Å; D317-Q321 WeakPolarHBondContact O-CG 3.36Å; D317-Q321 PolarHBondContact O-N 3.04Å; I318-Q321 PolarHBondContact O-N 2.77Å |
| 322 | R | 90.9 | Very high | 94.1 | Very high | 52 Ų | 52 | 43.3 Ų | 43.3 | 20% | 0.196 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -80.7 | -41.1 | -177.2 | -66.4 | -179.7 | -177.4 | -174.2 | 2.5 | 114.2 | T272 F275 E277 Q286 I318 L319 F320 | T272-R322 VanDerWaalsContact O-CZ 3.27Å; T272-R322 PolarHBondContact O-NH1 3.34Å; T272-R322 PolarHBondContact O-NH2 3.33Å; F275-R322 PolarHBondContact O-NH2 3.22Å; E277-R322 HydrophobicContact CB-CG 4.36Å; Q286-R322 VanDerWaalsContact OE1-CB 3.23Å; I318-R322 WeakPolarHBondContact O-CG 3.32Å; I318-R322 PolarHBondContact O-N 2.99Å; I318-R322 VanDerWaalsContact O-N 3.12Å; L319-R322 PolarHBondContact O-N 3.37Å; F320-R322 VanDerWaalsContact C-N 3.29Å; F320-R322 PolarHBondContact O-N 3.19Å |
| 323 | D | 93.1 | Very high | 94.1 | Very high | 56 Ų | 56 | 46.2 Ų | 46.2 | 30% | 0.299 | 25% | 0.249 | S | C | . | . | trans | -146.4 | 86.5 | 173.9 | -170 | -17.4 | 0 | 0 | 0 | 111.4 | F290 L319 T325 A326 V327 | F290-D323 HydrophobicContact CE2-CB 3.79Å; F290-D323 HydrophobicContact CZ-CB 4.18Å; L319-D323 PolarHBondContact O-N 2.91Å; D323-T325 PolarHBondContact O-N 2.96Å; D323-T325 PolarHBondContact OD1-N 3.46Å; D323-A326 HydrophobicContact CB-CB 4.15Å; D323-A326 VanDerWaalsContact CG-CB 3.46Å; D323-A326 PolarHBondContact O-N 3.17Å; D323-A326 PolarHBondContact OD1-N 2.88Å; D323-A326 WeakPolarHBondContact OD2-CB 3.34Å; D323-V327 WeakPolarHBondContact O-CG2 3.48Å; D323-V327 PolarHBondContact O-N 3.5Å | ||
| 324 | K | 93.7 | Very high | 94.2 | Very high | 119 Ų | 119 | 42.8 Ų | 42.8 | 52% | 0.517 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -55.9 | -38.4 | 175.9 | 176.5 | 171.3 | 178.4 | -178.9 | 0 | 112.5 | F320 L328 | F320-K324 HydrophobicContact CD2-CG 4.39Å; F320-K324 HydrophobicContact CE1-CD 4.1Å; F320-K324 HydrophobicContact CE1-CG 4.13Å; F320-K324 HydrophobicContact CE2-CD 4.45Å; F320-K324 HydrophobicContact CE2-CG 3.79Å; F320-K324 HydrophobicContact CZ-CB 4.49Å; F320-K324 HydrophobicContact CZ-CD 3.81Å; F320-K324 HydrophobicContact CZ-CG 3.65Å; F320-K324 WeakPolarHBondContact O-CA 3.41Å; F320-K324 PolarHBondContact O-N 3.34Å; F320-K324 VanDerWaalsContact O-N 3.13Å; K324-L328 HydrophobicContact CD-CD1 4.44Å; K324-L328 HydrophobicContact CG-CD1 3.74Å; K324-L328 HydrophobicContact CG-CG 4.25Å; K324-L328 VanDerWaalsContact O-CB 3.29Å; K324-L328 WeakPolarHBondContact O-CB 3.42Å; K324-L328 WeakPolarHBondContact O-CG 3.21Å; K324-L328 PolarHBondContact O-N 3.4Å |
| 325 | T | 95.3 | Very high | 94.4 | Very high | 111 Ų | 111 | 42.6 Ų | 42.6 | 68% | 0.681 | 23% | 0.227 | S | C | * | . | H | α-helix | trans | -70.1 | -47.2 | -173.5 | -55 | 0 | 0 | 0 | 0 | 110.4 | D323 L328 A329 | D323-T325 PolarHBondContact O-N 2.96Å; D323-T325 PolarHBondContact OD1-N 3.46Å; T325-L328 PolarHBondContact O-N 3.06Å; T325-A329 PolarHBondContact O-N 3.48Å |
| 326 | A | 95 | Very high | 94.4 | Very high | 23 Ų | 23 | 44.7 Ų | 44.7 | 19% | 0.19 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -61.7 | -47 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | F290 D323 L328 A329 I330 | F290-A326 HydrophobicContact CD1-CB 4.4Å; F290-A326 HydrophobicContact CD2-CB 3.81Å; F290-A326 HydrophobicContact CE1-CB 4.36Å; F290-A326 HydrophobicContact CE2-CB 3.73Å; F290-A326 HydrophobicContact CG-CB 4.15Å; F290-A326 HydrophobicContact CZ-CB 4.03Å; D323-A326 HydrophobicContact CB-CB 4.15Å; D323-A326 VanDerWaalsContact CG-CB 3.46Å; D323-A326 PolarHBondContact O-N 3.17Å; D323-A326 PolarHBondContact OD1-N 2.88Å; D323-A326 WeakPolarHBondContact OD2-CB 3.34Å; A326-L328 VanDerWaalsContact C-N 3.35Å; A326-L328 PolarHBondContact O-N 2.96Å; A326-A329 PolarHBondContact O-N 3.49Å; A326-I330 WeakPolarHBondContact O-CG1 3.39Å; A326-I330 PolarHBondContact O-N 3.07Å; A326-I330 VanDerWaalsContact O-N 3.11Å |
| 327 | V | 95.7 | Very high | 94.2 | Very high | 0 Ų | 0 | 44.9 Ų | 44.9 | 0% | 0 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -62.6 | -42.5 | 178.7 | 176 | 0 | 0 | 0 | 0 | 111.4 | F290 L312 L319 F320 D323 A329 I330 V331 W361 | F290-V327 HydrophobicContact CE1-CG2 3.75Å; F290-V327 HydrophobicContact CZ-CG2 3.85Å; L312-V327 HydrophobicContact CD2-CG1 4.27Å; L319-V327 HydrophobicContact CB-CG2 3.81Å; F320-V327 HydrophobicContact CB-CB 4.48Å; F320-V327 HydrophobicContact CB-CG1 4.28Å; F320-V327 HydrophobicContact CB-CG2 4.47Å; F320-V327 HydrophobicContact CD2-CB 4.11Å; F320-V327 HydrophobicContact CD2-CG1 3.87Å; D323-V327 WeakPolarHBondContact O-CG2 3.48Å; D323-V327 PolarHBondContact O-N 3.5Å; V327-A329 VanDerWaalsContact C-N 3.34Å; V327-A329 PolarHBondContact O-N 3.35Å; V327-I330 PolarHBondContact O-N 3Å; V327-V331 HydrophobicContact CG1-CG2 4.25Å; V327-V331 VanDerWaalsContact O-CG2 3.32Å; V327-V331 WeakPolarHBondContact O-CG2 3.32Å; V327-V331 PolarHBondContact O-N 2.97Å; V327-W361 HydrophobicContact CG1-CZ3 3.93Å |
| 328 | L | 95.1 | Very high | 94.1 | Very high | 46 Ų | 46 | 43.6 Ų | 43.6 | 24% | 0.241 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -63.1 | -39.5 | 176.8 | -74.6 | 177.2 | 0 | 0 | 0 | 112.3 | F320 K324 T325 A326 I330 V331 N332 K358 | F320-L328 HydrophobicContact CE2-CD1 4.45Å; F320-L328 HydrophobicContact CE2-CD2 3.86Å; F320-L328 HydrophobicContact CE2-CG 3.91Å; K324-L328 HydrophobicContact CD-CD1 4.44Å; K324-L328 HydrophobicContact CG-CD1 3.74Å; K324-L328 HydrophobicContact CG-CG 4.25Å; K324-L328 VanDerWaalsContact O-CB 3.29Å; K324-L328 WeakPolarHBondContact O-CB 3.42Å; K324-L328 WeakPolarHBondContact O-CG 3.21Å; K324-L328 PolarHBondContact O-N 3.4Å; T325-L328 PolarHBondContact O-N 3.06Å; A326-L328 VanDerWaalsContact C-N 3.35Å; A326-L328 PolarHBondContact O-N 2.96Å; L328-I330 PolarHBondContact O-N 3.45Å; L328-V331 PolarHBondContact O-N 2.83Å; L328-N332 VanDerWaalsContact O-CB 3.29Å; L328-N332 WeakPolarHBondContact O-CB 3.27Å; L328-N332 PolarHBondContact O-N 2.99Å; L328-N332 PolarHBondContact O-ND2 3.18Å; L328-N332 PolarHBondContact O-OD1 3.49Å; L328-K358 VanDerWaalsContact CD2-CE 3.47Å |
| 329 | A | 96.3 | Very high | 94.1 | Very high | 51 Ų | 51 | 48 Ų | 48 | 42% | 0.421 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -61 | -44 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112 | T325 A326 V327 N332 T333 | T325-A329 PolarHBondContact O-N 3.48Å; A326-A329 PolarHBondContact O-N 3.49Å; V327-A329 VanDerWaalsContact C-N 3.34Å; V327-A329 PolarHBondContact O-N 3.35Å; A329-N332 PolarHBondContact O-N 3Å; A329-T333 PolarHBondContact O-N 3.38Å; A329-T333 PolarHBondContact O-OG1 2.94Å |
| 330 | I | 96.5 | Very high | 93.8 | Very high | 1 Ų | 1 | 51.5 Ų | 51.5 | 1% | 0.005 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -64.9 | -47.2 | 177.5 | -66.4 | 166.1 | 0 | 0 | 0 | 110.6 | F290 M293 L297 I308 L312 A326 V327 L328 N332 T333 L334 | F290-I330 HydrophobicContact CD1-CD1 3.71Å; F290-I330 HydrophobicContact CE1-CD1 4.38Å; F290-I330 HydrophobicContact CG-CD1 4.47Å; M293-I330 HydrophobicContact CB-CD1 3.89Å; M293-I330 HydrophobicContact CG-CD1 4.43Å; M293-I330 HydrophobicContact SD-CD1 3.7Å; M293-I330 HydrophobicContact SD-CG2 4.17Å; L297-I330 HydrophobicContact CD1-CG2 4.04Å; I308-I330 HydrophobicContact CG2-CG2 4.05Å; L312-I330 HydrophobicContact CD1-CG2 3.93Å; A326-I330 WeakPolarHBondContact O-CG1 3.39Å; A326-I330 PolarHBondContact O-N 3.07Å; A326-I330 VanDerWaalsContact O-N 3.11Å; V327-I330 PolarHBondContact O-N 3Å; L328-I330 PolarHBondContact O-N 3.45Å; I330-N332 PolarHBondContact O-N 2.86Å; I330-T333 WeakPolarHBondContact O-CB 3.4Å; I330-T333 PolarHBondContact O-N 3.31Å; I330-L334 HydrophobicContact CG2-CD1 4.36Å; I330-L334 PolarHBondContact O-N 3.48Å |
| 331 | V | 95.5 | Very high | 93.1 | Very high | 1 Ų | 1 | 57 Ų | 57 | 1% | 0.006 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -62.6 | -42 | 178.5 | 172 | 0 | 0 | 0 | 0 | 111.7 | L312 V327 L328 T333 L334 Q335 L355 K358 | L312-V331 HydrophobicContact CD1-CG2 4.22Å; V327-V331 HydrophobicContact CG1-CG2 4.25Å; V327-V331 VanDerWaalsContact O-CG2 3.32Å; V327-V331 WeakPolarHBondContact O-CG2 3.32Å; V327-V331 PolarHBondContact O-N 2.97Å; L328-V331 PolarHBondContact O-N 2.83Å; V331-T333 VanDerWaalsContact C-N 3.28Å; V331-T333 PolarHBondContact O-N 3.21Å; V331-L334 PolarHBondContact O-N 2.77Å; V331-Q335 WeakPolarHBondContact O-CB 3.41Å; V331-Q335 PolarHBondContact O-N 3.12Å; V331-L355 HydrophobicContact CG1-CD2 3.62Å; V331-K358 HydrophobicContact CB-CD 4.46Å; V331-K358 HydrophobicContact CG1-CD 3.79Å; V331-K358 HydrophobicContact CG2-CD 4.31Å |
| 332 | N | 95.7 | Very high | 92.7 | Very high | 89 Ų | 89 | 59.1 Ų | 59.1 | 48% | 0.476 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -63.7 | -37.6 | 177.6 | -69.6 | -12.6 | 0 | 0 | 0 | 111.2 | L328 A329 I330 Q335 A336 | L328-N332 VanDerWaalsContact O-CB 3.29Å; L328-N332 WeakPolarHBondContact O-CB 3.27Å; L328-N332 PolarHBondContact O-N 2.99Å; L328-N332 PolarHBondContact O-ND2 3.18Å; L328-N332 PolarHBondContact O-OD1 3.49Å; A329-N332 PolarHBondContact O-N 3Å; I330-N332 PolarHBondContact O-N 2.86Å; N332-Q335 PolarHBondContact O-N 3.05Å; N332-A336 WeakPolarHBondContact O-CB 3.37Å; N332-A336 PolarHBondContact O-N 3.36Å |
| 333 | T | 95.5 | Very high | 92.4 | Very high | 61 Ų | 61 | 57.3 Ų | 57.3 | 37% | 0.374 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -64.4 | -44.9 | 175.2 | -56.3 | 0 | 0 | 0 | 0 | 111.3 | L297 A329 I330 V331 Q335 A336 I337 | L297-T333 HydrophobicContact CD1-CG2 3.99Å; A329-T333 PolarHBondContact O-N 3.38Å; A329-T333 PolarHBondContact O-OG1 2.94Å; I330-T333 WeakPolarHBondContact O-CB 3.4Å; I330-T333 PolarHBondContact O-N 3.31Å; V331-T333 VanDerWaalsContact C-N 3.28Å; V331-T333 PolarHBondContact O-N 3.21Å; T333-Q335 VanDerWaalsContact C-N 3.34Å; T333-Q335 PolarHBondContact O-N 2.97Å; T333-A336 PolarHBondContact O-N 3.02Å; T333-I337 HydrophobicContact CG2-CD1 4.24Å; T333-I337 VanDerWaalsContact O-CG1 3.32Å; T333-I337 WeakPolarHBondContact O-CG1 3.43Å; T333-I337 PolarHBondContact O-N 3.25Å |
| 334 | L | 94 | Very high | 92.1 | Very high | 0 Ų | 0 | 57.1 Ų | 57.1 | 0% | 0 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -61.1 | -41.6 | 174.8 | -75.1 | 170.2 | 0 | 0 | 0 | 112.4 | L297 I305 I308 V309 L312 I330 V331 I337 S338 V351 L354 | L297-L334 HydrophobicContact CD2-CD2 3.59Å; L297-L334 HydrophobicContact CD2-CG 4.06Å; I305-L334 HydrophobicContact CG1-CD2 4.42Å; I305-L334 HydrophobicContact CG2-CD2 4.06Å; I308-L334 HydrophobicContact CG2-CD1 3.94Å; V309-L334 HydrophobicContact CG2-CD1 4.43Å; L312-L334 HydrophobicContact CD1-CD1 3.97Å; I330-L334 HydrophobicContact CG2-CD1 4.36Å; I330-L334 PolarHBondContact O-N 3.48Å; V331-L334 PolarHBondContact O-N 2.77Å; L334-I337 PolarHBondContact O-N 3.18Å; L334-S338 PolarHBondContact O-N 3.48Å; L334-V351 HydrophobicContact CB-CG1 4.39Å; L334-V351 HydrophobicContact CB-CG2 4.17Å; L334-L354 HydrophobicContact CD1-CD2 3.58Å |
| 335 | Q | 94.8 | Very high | 91.7 | Very high | 62 Ų | 62 | 57.6 Ų | 57.6 | 29% | 0.29 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -64.1 | -41.8 | 175.8 | -175.3 | 175.7 | -7.4 | 0 | 0 | 111.9 | V331 N332 T333 I337 S338 Q339 L355 | V331-Q335 WeakPolarHBondContact O-CB 3.41Å; V331-Q335 PolarHBondContact O-N 3.12Å; N332-Q335 PolarHBondContact O-N 3.05Å; T333-Q335 VanDerWaalsContact C-N 3.34Å; T333-Q335 PolarHBondContact O-N 2.97Å; Q335-I337 VanDerWaalsContact C-N 3.29Å; Q335-I337 PolarHBondContact O-N 3.41Å; Q335-S338 PolarHBondContact O-N 2.66Å; Q335-S338 PolarHBondContact O-OG 3.12Å; Q335-Q339 VanDerWaalsContact O-CG 3.29Å; Q335-Q339 WeakPolarHBondContact O-CG 3.45Å; Q335-Q339 PolarHBondContact O-N 3.24Å; Q335-Q339 VanDerWaalsContact O-N 3.12Å; Q335-L355 HydrophobicContact CG-CD1 4.37Å |
| 336 | A | 93.9 | Very high | 91.3 | Very high | 57 Ų | 57 | 55.8 Ų | 55.8 | 47% | 0.471 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -62.4 | -38 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | N332 T333 Q340 | N332-A336 WeakPolarHBondContact O-CB 3.37Å; N332-A336 PolarHBondContact O-N 3.36Å; T333-A336 PolarHBondContact O-N 3.02Å; A336-Q340 WeakPolarHBondContact O-CG 3.46Å |
| 337 | I | 90.1 | Very high | 90.8 | Very high | 4 Ų | 4 | 54.8 Ų | 54.8 | 2% | 0.021 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -65 | -44.9 | 174.6 | -66.9 | 164.4 | 0 | 0 | 0 | 110.9 | L297 K300 I305 T333 L334 Q335 Q339 Q340 V347 | L297-I337 HydrophobicContact CD2-CD1 4Å; K300-I337 HydrophobicContact CD-CD1 4.19Å; K300-I337 HydrophobicContact CD-CG1 4.17Å; K300-I337 HydrophobicContact CG-CD1 3.95Å; K300-I337 HydrophobicContact CG-CG1 4.46Å; I305-I337 HydrophobicContact CD1-CG2 3.99Å; T333-I337 HydrophobicContact CG2-CD1 4.24Å; T333-I337 VanDerWaalsContact O-CG1 3.32Å; T333-I337 WeakPolarHBondContact O-CG1 3.43Å; T333-I337 PolarHBondContact O-N 3.25Å; L334-I337 PolarHBondContact O-N 3.18Å; Q335-I337 VanDerWaalsContact C-N 3.29Å; Q335-I337 PolarHBondContact O-N 3.41Å; I337-Q339 VanDerWaalsContact C-N 3.26Å; I337-Q339 PolarHBondContact O-N 3.26Å; I337-Q340 WeakPolarHBondContact O-CG 3.49Å; I337-Q340 PolarHBondContact O-N 3.49Å; I337-V347 HydrophobicContact CG2-CG1 4.32Å |
| 338 | S | 91.3 | Very high | 90.5 | Very high | 14 Ų | 14 | 58.2 Ų | 58.2 | 10% | 0.098 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -66.4 | -27.8 | -178 | 72.6 | 0 | 0 | 0 | 0 | 113.6 | L334 Q335 Q340 K348 | L334-S338 PolarHBondContact O-N 3.48Å; Q335-S338 PolarHBondContact O-N 2.66Å; Q335-S338 PolarHBondContact O-OG 3.12Å; S338-Q340 VanDerWaalsContact C-N 3.31Å; S338-Q340 PolarHBondContact O-N 3.02Å; S338-K348 WeakPolarHBondContact O-CE 3.49Å; S338-K348 WeakPolarHBondContact O-CG 3.06Å |
| 339 | Q | 91.6 | Very high | 90.4 | Very high | 134 Ų | 134 | 61 Ų | 61 | 63% | 0.626 | 34% | 0.336 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.6 | -4.5 | 179.8 | -70 | 176.7 | -9.4 | 0 | 0 | 114.1 | Q335 I337 | Q335-Q339 VanDerWaalsContact O-CG 3.29Å; Q335-Q339 WeakPolarHBondContact O-CG 3.45Å; Q335-Q339 PolarHBondContact O-N 3.24Å; Q335-Q339 VanDerWaalsContact O-N 3.12Å; I337-Q339 VanDerWaalsContact C-N 3.26Å; I337-Q339 PolarHBondContact O-N 3.26Å |
| 340 | Q | 89.7 | Confident | 90 | Very high | 74 Ų | 74 | 60.3 Ų | 60.3 | 35% | 0.346 | 33% | 0.325 | S | S | . | . | S | Bend | trans | -64.9 | 138.5 | 177.1 | -62.8 | -177 | -2.8 | 0 | 0 | 111.3 | A336 I337 S338 N342 Q343 | A336-Q340 WeakPolarHBondContact O-CG 3.46Å; I337-Q340 WeakPolarHBondContact O-CG 3.49Å; I337-Q340 PolarHBondContact O-N 3.49Å; S338-Q340 VanDerWaalsContact C-N 3.31Å; S338-Q340 PolarHBondContact O-N 3.02Å; Q340-N342 VanDerWaalsContact C-N 3.25Å; Q340-N342 PolarHBondContact O-N 3.38Å; Q340-Q343 HydrophobicContact CB-CB 4.28Å; Q340-Q343 VanDerWaalsContact O-CB 3.27Å; Q340-Q343 WeakPolarHBondContact O-CB 3.45Å; Q340-Q343 PolarHBondContact O-N 3.47Å |
| 341 | T | 80 | Confident | 89.8 | Confident | 133 Ų | 133 | 60.4 Ų | 60.4 | 82% | 0.816 | 33% | 0.325 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57 | -38.7 | -171.7 | -36.9 | 0 | 0 | 0 | 0 | 112.7 | ||
| 342 | N | 82.5 | Confident | 89.6 | Confident | 154 Ų | 154 | 64.2 Ų | 64.2 | 82% | 0.824 | 35% | 0.348 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -94.9 | 13.6 | -176.3 | -61.5 | -17.5 | 0 | 0 | 0 | 113.3 | Q340 | Q340-N342 VanDerWaalsContact C-N 3.25Å; Q340-N342 PolarHBondContact O-N 3.38Å |
| 343 | Q | 85.2 | Confident | 89.4 | Confident | 14 Ų | 14 | 63.8 Ų | 63.8 | 7% | 0.065 | 35% | 0.346 | C | S | . | . | trans | -74.4 | 136.2 | -174.3 | -165.5 | 62.8 | 8.7 | 0 | 0 | 112.4 | Q340 V347 K348 | Q340-Q343 HydrophobicContact CB-CB 4.28Å; Q340-Q343 VanDerWaalsContact O-CB 3.27Å; Q340-Q343 WeakPolarHBondContact O-CB 3.45Å; Q340-Q343 PolarHBondContact O-N 3.47Å; Q343-V347 HydrophobicContact CG-CB 4Å; Q343-V347 HydrophobicContact CG-CG1 3.92Å; Q343-V347 VanDerWaalsContact NE2-CG1 3.28Å; Q343-K348 HydrophobicContact CB-CG 4.5Å; Q343-K348 HydrophobicContact CG-CG 4.47Å; Q343-K348 VanDerWaalsContact O-CE 3.24Å; Q343-K348 WeakPolarHBondContact O-CE 3.36Å; Q343-K348 PolarHBondContact O-NZ 2.76Å | ||
| 344 | I | 86.1 | Confident | 89.3 | Confident | 52 Ų | 52 | 60.9 Ų | 60.9 | 27% | 0.267 | 33% | 0.329 | S | S | . | . | trans | -61 | 138.8 | 176.8 | 56.8 | 172.6 | 0 | 0 | 0 | 111.8 | L302 V346 V347 K348 | L302-I344 HydrophobicContact CB-CD1 4.26Å; L302-I344 HydrophobicContact CD1-CD1 4.11Å; L302-I344 HydrophobicContact CD2-CD1 4.18Å; L302-I344 HydrophobicContact CG-CD1 4.41Å; I344-V346 PolarHBondContact O-N 3.22Å; I344-V346 VanDerWaalsContact O-N 3.17Å; I344-V347 HydrophobicContact CD1-CG2 3.75Å; I344-V347 HydrophobicContact CG1-CB 3.99Å; I344-V347 HydrophobicContact CG1-CG2 3.61Å; I344-V347 PolarHBondContact O-N 3.39Å; I344-K348 PolarHBondContact O-N 2.93Å | ||
| 345 | N | 86.2 | Confident | 89.2 | Confident | 129 Ų | 129 | 63.5 Ų | 63.5 | 69% | 0.69 | 34% | 0.342 | S | S | * | . | H | α-helix | trans | -57.7 | -33.9 | -175.7 | -72.4 | -15.9 | 0 | 0 | 0 | 113.1 | V347 K348 Q349 | N345-V347 VanDerWaalsContact C-N 3.33Å; N345-V347 PolarHBondContact O-N 3.22Å; N345-K348 WeakPolarHBondContact O-CB 3.34Å; N345-K348 PolarHBondContact O-N 2.76Å; N345-Q349 PolarHBondContact O-N 3.03Å |
| 346 | V | 85.9 | Confident | 89 | Confident | 73 Ų | 73 | 63.3 Ų | 63.3 | 44% | 0.442 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -60.9 | -41.7 | 177.6 | 179.3 | 0 | 0 | 0 | 0 | 111.4 | L302 I344 Q349 L350 | L302-V346 HydrophobicContact CD1-CB 4.44Å; L302-V346 HydrophobicContact CD1-CG1 3.89Å; I344-V346 PolarHBondContact O-N 3.22Å; I344-V346 VanDerWaalsContact O-N 3.17Å; V346-Q349 PolarHBondContact O-N 3.47Å; V346-L350 HydrophobicContact CG1-CD1 4.09Å; V346-L350 HydrophobicContact CG1-CG 4.47Å; V346-L350 WeakPolarHBondContact O-CB 3.34Å; V346-L350 VanDerWaalsContact O-CG 3.29Å; V346-L350 WeakPolarHBondContact O-CG 3.4Å; V346-L350 PolarHBondContact O-N 3.06Å |
| 347 | V | 84.7 | Confident | 88.8 | Confident | 1 Ų | 1 | 61.4 Ų | 61.4 | 1% | 0.006 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -68.4 | -40 | 176.7 | 169.8 | 0 | 0 | 0 | 0 | 110.8 | L302 I305 I337 Q343 I344 N345 Q349 L350 V351 | L302-V347 HydrophobicContact CD1-CG2 3.69Å; I305-V347 HydrophobicContact CD1-CG1 4Å; I305-V347 HydrophobicContact CD1-CG2 4Å; I305-V347 HydrophobicContact CG2-CG1 4.17Å; I305-V347 HydrophobicContact CG2-CG2 4.4Å; I337-V347 HydrophobicContact CG2-CG1 4.32Å; Q343-V347 HydrophobicContact CG-CB 4Å; Q343-V347 HydrophobicContact CG-CG1 3.92Å; Q343-V347 VanDerWaalsContact NE2-CG1 3.28Å; I344-V347 HydrophobicContact CD1-CG2 3.75Å; I344-V347 HydrophobicContact CG1-CB 3.99Å; I344-V347 HydrophobicContact CG1-CG2 3.61Å; I344-V347 PolarHBondContact O-N 3.39Å; N345-V347 VanDerWaalsContact C-N 3.33Å; N345-V347 PolarHBondContact O-N 3.22Å; V347-Q349 VanDerWaalsContact C-N 3.3Å; V347-Q349 PolarHBondContact O-N 2.83Å; V347-L350 PolarHBondContact O-N 3.25Å; V347-V351 HydrophobicContact CG1-CG2 4.29Å; V347-V351 WeakPolarHBondContact O-CG2 3.37Å; V347-V351 PolarHBondContact O-N 3.46Å |
| 348 | K | 89.6 | Confident | 88.7 | Confident | 72 Ų | 72 | 63.1 Ų | 63.1 | 31% | 0.313 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -57.8 | -45.3 | 175.2 | -64.9 | -177.1 | 178.7 | 170.6 | 0 | 111.3 | S338 Q343 I344 N345 T352 | S338-K348 WeakPolarHBondContact O-CE 3.49Å; S338-K348 WeakPolarHBondContact O-CG 3.06Å; Q343-K348 HydrophobicContact CB-CG 4.5Å; Q343-K348 HydrophobicContact CG-CG 4.47Å; Q343-K348 VanDerWaalsContact O-CE 3.24Å; Q343-K348 WeakPolarHBondContact O-CE 3.36Å; Q343-K348 PolarHBondContact O-NZ 2.76Å; I344-K348 PolarHBondContact O-N 2.93Å; N345-K348 WeakPolarHBondContact O-CB 3.34Å; N345-K348 PolarHBondContact O-N 2.76Å; K348-T352 WeakPolarHBondContact O-CB 3.43Å; K348-T352 PolarHBondContact O-N 3.48Å; K348-T352 PolarHBondContact O-OG1 3.18Å |
| 349 | Q | 92.7 | Very high | 88.4 | Confident | 106 Ų | 106 | 65.7 Ų | 65.7 | 50% | 0.495 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -64.1 | -51.4 | 178 | -170.9 | 60.3 | 40.2 | 0 | 0 | 111.6 | N345 V346 V347 V351 T352 D353 | N345-Q349 PolarHBondContact O-N 3.03Å; V346-Q349 PolarHBondContact O-N 3.47Å; V347-Q349 VanDerWaalsContact C-N 3.3Å; V347-Q349 PolarHBondContact O-N 2.83Å; Q349-V351 VanDerWaalsContact C-N 3.29Å; Q349-V351 PolarHBondContact O-N 3.29Å; Q349-T352 WeakPolarHBondContact O-CA 3.45Å; Q349-T352 WeakPolarHBondContact O-CB 3.49Å; Q349-T352 PolarHBondContact O-N 3.1Å; Q349-D353 PolarHBondContact NE2-OD1 3.29Å; Q349-D353 PolarHBondContact NE2-OD2 3.38Å; Q349-D353 VanDerWaalsContact O-CG 3.3Å; Q349-D353 PolarHBondContact O-N 3.39Å |
| 350 | L | 89.3 | Confident | 88 | Confident | 36 Ų | 36 | 65.3 Ų | 65.3 | 19% | 0.188 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -55.1 | -43.5 | 179.9 | -75.1 | 170.1 | 0 | 0 | 0 | 112.6 | L302 R306 V309 V346 V347 L354 | L302-L350 HydrophobicContact CD1-CD1 4.13Å; R306-L350 HydrophobicContact CB-CD1 4.22Å; R306-L350 HydrophobicContact CG-CD1 4.46Å; V309-L350 HydrophobicContact CG1-CB 4.34Å; V309-L350 HydrophobicContact CG1-CD2 4.31Å; V309-L350 HydrophobicContact CG2-CB 4.31Å; V346-L350 HydrophobicContact CG1-CD1 4.09Å; V346-L350 HydrophobicContact CG1-CG 4.47Å; V346-L350 WeakPolarHBondContact O-CB 3.34Å; V346-L350 VanDerWaalsContact O-CG 3.29Å; V346-L350 WeakPolarHBondContact O-CG 3.4Å; V346-L350 PolarHBondContact O-N 3.06Å; V347-L350 PolarHBondContact O-N 3.25Å; L350-L354 WeakPolarHBondContact O-CB 3.36Å; L350-L354 PolarHBondContact O-N 3.08Å |
| 351 | V | 91.2 | Very high | 87.8 | Confident | 2 Ų | 2 | 62.6 Ų | 62.6 | 1% | 0.012 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -72.1 | -34.9 | 178.7 | 176.9 | 0 | 0 | 0 | 0 | 111.3 | L334 V347 Q349 L354 L355 | L334-V351 HydrophobicContact CB-CG1 4.39Å; L334-V351 HydrophobicContact CB-CG2 4.17Å; V347-V351 HydrophobicContact CG1-CG2 4.29Å; V347-V351 WeakPolarHBondContact O-CG2 3.37Å; V347-V351 PolarHBondContact O-N 3.46Å; Q349-V351 VanDerWaalsContact C-N 3.29Å; Q349-V351 PolarHBondContact O-N 3.29Å; V351-L354 PolarHBondContact O-N 3.34Å; V351-L355 HydrophobicContact CG1-CD1 4.26Å; V351-L355 HydrophobicContact CG1-CG 4.42Å; V351-L355 VanDerWaalsContact O-CG 3.26Å; V351-L355 WeakPolarHBondContact O-CG 3.37Å; V351-L355 PolarHBondContact O-N 3.05Å |
| 352 | T | 92.5 | Very high | 87 | Confident | 81 Ų | 81 | 59.7 Ų | 59.7 | 50% | 0.497 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -63.3 | -45.5 | 174.9 | -58 | 0 | 0 | 0 | 0 | 111 | K348 Q349 L354 L355 A356 | K348-T352 WeakPolarHBondContact O-CB 3.43Å; K348-T352 PolarHBondContact O-N 3.48Å; K348-T352 PolarHBondContact O-OG1 3.18Å; Q349-T352 WeakPolarHBondContact O-CA 3.45Å; Q349-T352 WeakPolarHBondContact O-CB 3.49Å; Q349-T352 PolarHBondContact O-N 3.1Å; T352-L354 VanDerWaalsContact C-N 3.33Å; T352-L354 PolarHBondContact O-N 3.49Å; T352-L355 PolarHBondContact O-N 3.46Å; T352-A356 PolarHBondContact O-N 3.5Å |
| 353 | D | 91.6 | Very high | 85.8 | Confident | 81 Ų | 81 | 57.7 Ų | 57.7 | 43% | 0.433 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -63.2 | -40.9 | 177.1 | -62.8 | -24.1 | 0 | 0 | 0 | 111.2 | Q349 L355 A356 A357 | Q349-D353 PolarHBondContact NE2-OD1 3.29Å; Q349-D353 PolarHBondContact NE2-OD2 3.38Å; Q349-D353 VanDerWaalsContact O-CG 3.3Å; Q349-D353 PolarHBondContact O-N 3.39Å; D353-L355 PolarHBondContact O-N 3.19Å; D353-A356 WeakPolarHBondContact O-CB 3.43Å; D353-A356 PolarHBondContact O-N 3.26Å; D353-A357 PolarHBondContact O-N 3.31Å |
| 354 | L | 92.5 | Very high | 84.1 | Confident | 0 Ų | 0 | 62.2 Ų | 62.2 | 0% | 0 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -60.6 | -43.4 | 173.8 | 177.5 | 62.8 | 0 | 0 | 0 | 112.3 | V309 L312 L334 L350 V351 T352 A356 A357 K358 W361 | V309-L354 HydrophobicContact CG1-CB 4.18Å; V309-L354 HydrophobicContact CG2-CD2 4.06Å; L312-L354 HydrophobicContact CB-CD1 3.56Å; L312-L354 HydrophobicContact CB-CD2 4.45Å; L312-L354 HydrophobicContact CD1-CD1 4.4Å; L312-L354 HydrophobicContact CD1-CD2 3.86Å; L334-L354 HydrophobicContact CD1-CD2 3.58Å; L350-L354 WeakPolarHBondContact O-CB 3.36Å; L350-L354 PolarHBondContact O-N 3.08Å; V351-L354 PolarHBondContact O-N 3.34Å; T352-L354 VanDerWaalsContact C-N 3.33Å; T352-L354 PolarHBondContact O-N 3.49Å; L354-A356 VanDerWaalsContact C-N 3.27Å; L354-A356 PolarHBondContact O-N 3.33Å; L354-A357 PolarHBondContact O-N 3.11Å; L354-K358 WeakPolarHBondContact O-CB 3.45Å; L354-K358 PolarHBondContact O-N 3.48Å; L354-W361 HydrophobicContact CD1-CH2 3.9Å; L354-W361 HydrophobicContact CD1-CZ2 4.14Å |
| 355 | L | 92 | Very high | 81.5 | Confident | 54 Ų | 54 | 63.9 Ų | 63.9 | 28% | 0.283 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -65 | -34.1 | 178.7 | -71.5 | 173 | 0 | 0 | 0 | 111.6 | V331 Q335 V351 T352 D353 A359 | V331-L355 HydrophobicContact CG1-CD2 3.62Å; Q335-L355 HydrophobicContact CG-CD1 4.37Å; V351-L355 HydrophobicContact CG1-CD1 4.26Å; V351-L355 HydrophobicContact CG1-CG 4.42Å; V351-L355 VanDerWaalsContact O-CG 3.26Å; V351-L355 WeakPolarHBondContact O-CG 3.37Å; V351-L355 PolarHBondContact O-N 3.05Å; T352-L355 PolarHBondContact O-N 3.46Å; D353-L355 PolarHBondContact O-N 3.19Å; L355-A359 PolarHBondContact O-N 2.9Å |
| 356 | A | 90.2 | Very high | 78.7 | Confident | 59 Ų | 59 | 63.6 Ų | 63.6 | 49% | 0.488 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -66.1 | -42.1 | 172 | 0 | 0 | 0 | 0 | 0 | 111.9 | T352 D353 L354 A359 | T352-A356 PolarHBondContact O-N 3.5Å; D353-A356 WeakPolarHBondContact O-CB 3.43Å; D353-A356 PolarHBondContact O-N 3.26Å; L354-A356 VanDerWaalsContact C-N 3.27Å; L354-A356 PolarHBondContact O-N 3.33Å; A356-A359 PolarHBondContact O-N 3.06Å |
| 357 | A | 89 | Confident | 76.1 | Confident | 17 Ų | 17 | 66.3 Ų | 66.3 | 14% | 0.14 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -62.9 | -44.1 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | D353 L354 A359 Q360 W361 | D353-A357 PolarHBondContact O-N 3.31Å; L354-A357 PolarHBondContact O-N 3.11Å; A357-A359 PolarHBondContact O-N 3.43Å; A357-Q360 WeakPolarHBondContact O-CB 3.19Å; A357-Q360 PolarHBondContact O-N 2.91Å; A357-W361 HydrophobicContact CB-CZ2 4.37Å; A357-W361 PolarHBondContact O-NE1 3.49Å |
| 358 | K | 89.4 | Confident | 73.5 | Confident | 40 Ų | 40 | 70.7 Ų | 70.7 | 17% | 0.174 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -55.5 | -37.2 | 177.5 | 172.4 | 179.6 | 164.9 | -174.4 | 0 | 113.4 | L328 V331 L354 Q360 W361 | L328-K358 VanDerWaalsContact CD2-CE 3.47Å; V331-K358 HydrophobicContact CB-CD 4.46Å; V331-K358 HydrophobicContact CG1-CD 3.79Å; V331-K358 HydrophobicContact CG2-CD 4.31Å; L354-K358 WeakPolarHBondContact O-CB 3.45Å; L354-K358 PolarHBondContact O-N 3.48Å; K358-Q360 PolarHBondContact O-N 3.24Å; K358-Q360 VanDerWaalsContact O-N 3.16Å; K358-W361 HydrophobicContact CB-CD2 4.28Å; K358-W361 HydrophobicContact CB-CE3 3.88Å; K358-W361 HydrophobicContact CB-CH2 3.97Å; K358-W361 HydrophobicContact CB-CZ2 4.36Å; K358-W361 HydrophobicContact CB-CZ3 3.72Å; K358-W361 HydrophobicContact CD-CZ3 4.45Å; K358-W361 HydrophobicContact CG-CE3 3.84Å; K358-W361 HydrophobicContact CG-CZ3 3.86Å; K358-W361 PolarHBondContact O-N 3.31Å |
| 359 | A | 84.6 | Confident | 70.6 | Confident | 67 Ų | 67 | 76.2 Ų | 76.2 | 55% | 0.554 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -59.2 | -26.6 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | L355 A356 A357 | L355-A359 PolarHBondContact O-N 2.9Å; A356-A359 PolarHBondContact O-N 3.06Å; A357-A359 PolarHBondContact O-N 3.43Å |
| 360 | Q | 84.2 | Confident | 67.4 | Low | 126 Ų | 126 | 80.2 Ų | 80.2 | 59% | 0.589 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -82.9 | -27.6 | -179.4 | -55 | 178.7 | 9.3 | 0 | 0 | 112.6 | A357 K358 C362 T363 | A357-Q360 WeakPolarHBondContact O-CB 3.19Å; A357-Q360 PolarHBondContact O-N 2.91Å; K358-Q360 PolarHBondContact O-N 3.24Å; K358-Q360 VanDerWaalsContact O-N 3.16Å; Q360-C362 VanDerWaalsContact C-N 3.27Å; Q360-C362 PolarHBondContact O-N 2.84Å; Q360-T363 PolarHBondContact O-N 2.8Å; Q360-T363 VanDerWaalsContact O-N 3.15Å; Q360-T363 PolarHBondContact O-OG1 3.35Å |
| 361 | W | 85.2 | Confident | 64.7 | Low | 18 Ų | 18 | 83.3 Ų | 83.3 | 7% | 0.068 | 49% | 0.494 | C | S | . | . | H | α-helix | trans | -62.5 | -33.2 | -177.6 | -55.4 | -21.4 | 0 | 0 | 0 | 112.8 | L312 D317 F320 V327 L354 A357 K358 T363 | L312-W361 HydrophobicContact CB-CH2 4.17Å; L312-W361 WeakPolarHBondContact O-CZ2 3.24Å; D317-W361 HydrophobicContact CB-CB 4.36Å; D317-W361 HydrophobicContact CB-CG 4.07Å; F320-W361 HydrophobicContact CB-CE3 4.08Å; F320-W361 HydrophobicContact CD2-CE3 4.19Å; F320-W361 HydrophobicContact CG-CE3 4.27Å; V327-W361 HydrophobicContact CG1-CZ3 3.93Å; L354-W361 HydrophobicContact CD1-CH2 3.9Å; L354-W361 HydrophobicContact CD1-CZ2 4.14Å; A357-W361 HydrophobicContact CB-CZ2 4.37Å; A357-W361 PolarHBondContact O-NE1 3.49Å; K358-W361 HydrophobicContact CB-CD2 4.28Å; K358-W361 HydrophobicContact CB-CE3 3.88Å; K358-W361 HydrophobicContact CB-CH2 3.97Å; K358-W361 HydrophobicContact CB-CZ2 4.36Å; K358-W361 HydrophobicContact CB-CZ3 3.72Å; K358-W361 HydrophobicContact CD-CZ3 4.45Å; K358-W361 HydrophobicContact CG-CE3 3.84Å; K358-W361 HydrophobicContact CG-CZ3 3.86Å; K358-W361 PolarHBondContact O-N 3.31Å; W361-T363 VanDerWaalsContact C-N 3.3Å; W361-T363 PolarHBondContact O-N 3.41Å |
| 362 | C | 63.5 | Low | 61.7 | Low | 71 Ų | 71 | 89.5 Ų | 89.5 | 48% | 0.48 | 53% | 0.531 | S | S | . | . | G | 310 helix | trans | -75.3 | -16.8 | -179.4 | -65.2 | 0 | 0 | 0 | 0 | 113.5 | Q360 | Q360-C362 VanDerWaalsContact C-N 3.27Å; Q360-C362 PolarHBondContact O-N 2.84Å |
| 363 | T | 56.7 | Low | 58.6 | Low | 112 Ų | 112 | 93.6 Ų | 93.6 | 69% | 0.687 | 55% | 0.55 | S | S | * | * | G | 310 helix | trans | -88.2 | -6 | -174.9 | 50.8 | 0 | 0 | 0 | 0 | 114.8 | Q360 W361 | Q360-T363 PolarHBondContact O-N 2.8Å; Q360-T363 VanDerWaalsContact O-N 3.15Å; Q360-T363 PolarHBondContact O-OG1 3.35Å; W361-T363 VanDerWaalsContact C-N 3.3Å; W361-T363 PolarHBondContact O-N 3.41Å |
| 364 | Q | 49.6 | Very low | 55.5 | Low | 110 Ų | 110 | 93.2 Ų | 93.2 | 51% | 0.514 | 57% | 0.566 | S | S | . | * | G | 310 helix | trans | -95.6 | 12.2 | -173 | -66.9 | -171 | -2.4 | 0 | 0 | 115.2 | ||
| 365 | S | 31.4 | Very low | 52.3 | Low | 87 Ų | 87 | 105.4 Ų | 105.4 | 61% | 0.608 | 61% | 0.612 | S | S | * | * | trans | -113 | 63.9 | -176.9 | 49.2 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 366 | V | 27.4 | Very low | 49.5 | Very low | 123 Ų | 123 | 108.1 Ų | 108.1 | 75% | 0.745 | 64% | 0.635 | S | S | * | * | trans | -152.2 | 106.2 | 157 | -174 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 367 | P | 30.6 | Very low | 46.5 | Very low | 129 Ų | 129 | 113.2 Ų | 113.2 | 84% | 0.838 | 65% | 0.654 | S | S | * | * | trans | -92.8 | 100.6 | 142.2 | 25 | -11.1 | 0 | 0 | 0 | 107.1 | E369 | P367-E369 PolarHBondContact O-N 3.39Š| ||
| 368 | S | 31 | Very low | 43.7 | Very low | 94 Ų | 94 | 122 Ų | 122 | 66% | 0.657 | 69% | 0.689 | S | S | * | * | trans | -69.8 | 120.4 | 171 | 53 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 369 | E | 27.2 | Very low | 40.9 | Very low | 187 Ų | 187 | 129.8 Ų | 129.8 | 87% | 0.874 | 72% | 0.723 | S | S | * | * | S | Bend | trans | -51.3 | 147.8 | 151.5 | -69.6 | 179 | 146.2 | 0 | 0 | 108.9 | P367 | P367-E369 PolarHBondContact O-N 3.39Š|
| 370 | E | 27.2 | Very low | 38.3 | Very low | 190 Ų | 190 | 138.4 Ų | 138.4 | 89% | 0.888 | 74% | 0.741 | S | S | * | * | trans | 87.9 | 79.2 | -174.2 | -53.3 | -174.9 | 167.2 | 0 | 0 | 117.1 | ||||
| 371 | A | 31.9 | Very low | 35.7 | Very low | 101 Ų | 101 | 137.6 Ų | 137.6 | 84% | 0.835 | 75% | 0.75 | S | S | * | * | trans | -154.4 | 85.4 | 136.7 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 372 | T | 28.6 | Very low | 33.1 | Very low | 132 Ų | 132 | 140.5 Ų | 140.5 | 81% | 0.81 | 78% | 0.777 | S | S | * | * | trans | -54 | 135.1 | 156.3 | 39.4 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 373 | N | 26.8 | Very low | 31.5 | Very low | 167 Ų | 167 | 144.6 Ų | 144.6 | 89% | 0.893 | 79% | 0.793 | S | S | * | * | trans | 64.9 | 110.2 | 162.6 | -66 | -21 | 0 | 0 | 0 | 118.6 | ||||
| 374 | G | 26.8 | Very low | 30.3 | Very low | 73 Ų | 73 | 146.8 Ų | 146.8 | 75% | 0.753 | 80% | 0.8 | S | S | * | * | trans | 146.4 | 77.7 | 152.1 | 0 | 0 | 0 | 0 | 0 | 116.7 | S376 | G374-S376 PolarHBondContact O-N 3.5Š| ||
| 375 | R | 25.5 | Very low | 29.3 | Very low | 257 Ų | 257 | 147.2 Ų | 147.2 | 97% | 0.97 | 81% | 0.805 | S | S | * | * | trans | 33.7 | 90.8 | 133.6 | -156.4 | 179.6 | -161.4 | 175.4 | 4.5 | 117.2 | ||||
| 376 | S | 31.7 | Very low | 29.2 | Very low | 110 Ų | 110 | 153.6 Ų | 153.6 | 77% | 0.769 | 82% | 0.818 | S | S | * | * | trans | -170.3 | 93.3 | 135.1 | 61.7 | 0 | 0 | 0 | 0 | 112 | G374 K378 | G374-S376 PolarHBondContact O-N 3.5Å; S376-K378 PolarHBondContact O-N 3.29Å; S376-K378 VanDerWaalsContact O-N 3.11Å | ||
| 377 | D | 28 | Very low | 29.3 | Very low | 167 Ų | 167 | 155.3 Ų | 155.3 | 89% | 0.893 | 82% | 0.822 | S | S | * | * | trans | -61.4 | 100.8 | 155.2 | -74.5 | -50.3 | 0 | 0 | 0 | 108.9 | ||||
| 378 | K | 30.8 | Very low | 29.2 | Very low | 200 Ų | 200 | 155.9 Ų | 155.9 | 87% | 0.87 | 82% | 0.819 | S | S | * | * | trans | -174.2 | 15.2 | 159.4 | -108 | 165.2 | -170 | -174.1 | 0 | 118.4 | S376 | S376-K378 PolarHBondContact O-N 3.29Å; S376-K378 VanDerWaalsContact O-N 3.11Å | ||
| 379 | K | 29.5 | Very low | 29 | Very low | 205 Ų | 205 | 157 Ų | 157 | 89% | 0.891 | 82% | 0.821 | S | S | * | * | S | Bend | trans | -127.9 | 26.7 | -175.8 | -82.6 | -170.7 | 176.8 | -179.2 | 0 | 117.6 | ||
| 380 | R | 30.5 | Very low | 29 | Very low | 248 Ų | 248 | 154.9 Ų | 154.9 | 94% | 0.936 | 82% | 0.821 | S | S | * | * | S | Bend | trans | -113.5 | 9.1 | 172.8 | -101 | -177.7 | 175.5 | 177.5 | -1.2 | 116.7 | ||
| 381 | S | 30.5 | Very low | 28.9 | Very low | 109 Ų | 109 | 154 Ų | 154 | 76% | 0.762 | 82% | 0.821 | S | S | * | * | S | Bend | trans | -109.3 | 13 | 180 | -56.9 | 0 | 0 | 0 | 0 | 115.5 | ||
| 382 | A | 30.1 | Very low | 28.5 | Very low | 78 Ų | 78 | 157.6 Ų | 157.6 | 65% | 0.645 | 83% | 0.826 | S | S | * | * | S | Bend | trans | -105.2 | -3.3 | -172.2 | 0 | 0 | 0 | 0 | 0 | 116 | ||
| 383 | L | 30.2 | Very low | 28.6 | Very low | 157 Ų | 157 | 160.8 Ų | 160.8 | 82% | 0.822 | 85% | 0.853 | S | S | * | * | S | Bend | trans | -100.9 | -2.9 | 179.9 | -124.1 | 97.4 | 0 | 0 | 0 | 114.9 | ||
| 384 | L | 30.9 | Very low | 28.7 | Very low | 159 Ų | 159 | 160.5 Ų | 160.5 | 83% | 0.832 | 85% | 0.851 | S | S | * | * | S | Bend | trans | -102 | 6.7 | 179.5 | -83.9 | 164.7 | 0 | 0 | 0 | 114.2 | ||
| 385 | L | 29.3 | Very low | 28.8 | Very low | 118 Ų | 118 | 165.1 Ų | 165.1 | 62% | 0.618 | 86% | 0.856 | S | S | * | * | S | Bend | trans | -104.6 | 3.1 | -176.2 | -84 | 161.8 | 0 | 0 | 0 | 115 | ||
| 386 | Y | 29 | Very low | 29 | Very low | 222 Ų | 222 | 160 Ų | 160 | 87% | 0.871 | 85% | 0.85 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.5 | 0.8 | 179.5 | -105.8 | -85.5 | 0 | 0 | 0 | 115.6 | ||
| 387 | N | 30.3 | Very low | 28.8 | Very low | 158 Ų | 158 | 162.9 Ų | 162.9 | 85% | 0.845 | 86% | 0.855 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -116.5 | 9.7 | 178.8 | -84.3 | -17 | 0 | 0 | 0 | 115.1 | ||
| 388 | N | 26.8 | Very low | 28.9 | Very low | 142 Ų | 142 | 162.7 Ų | 162.7 | 76% | 0.759 | 85% | 0.853 | S | S | * | * | S | Bend | trans | -127.4 | 20.4 | -178.2 | -85.7 | -23.2 | 0 | 0 | 0 | 115 | ||
| 389 | V | 26.6 | Very low | 28.7 | Very low | 118 Ų | 118 | 160.2 Ų | 160.2 | 72% | 0.715 | 85% | 0.851 | S | S | * | * | S | Bend | trans | -131.1 | 56.7 | 178.5 | -166.1 | 0 | 0 | 0 | 0 | 111.4 | ||
| 390 | V | 27.9 | Very low | 28.7 | Very low | 142 Ų | 142 | 157 Ų | 157 | 86% | 0.861 | 85% | 0.849 | S | S | * | * | S | Bend | trans | -155 | 82.4 | 150.7 | -173.6 | 0 | 0 | 0 | 0 | 107.3 | ||
| 391 | L | 25.7 | Very low | 28.5 | Very low | 171 Ų | 171 | 150 Ų | 150 | 90% | 0.895 | 84% | 0.842 | S | S | * | * | S | Bend | trans | -178.8 | 78.4 | 156.2 | -99.1 | 168.4 | 0 | 0 | 0 | 106.3 | ||
| 392 | L | 23.5 | Very low | 28.4 | Very low | 177 Ų | 177 | 153.4 Ų | 153.4 | 93% | 0.927 | 85% | 0.848 | S | S | * | * | trans | 176.8 | 79.2 | 155.1 | -93.2 | 169.5 | 0 | 0 | 0 | 107.2 | ||||
| 393 | S | 30.4 | Very low | 28.2 | Very low | 199 Ų | 199 | 160.3 Ų | 160.3 | 100% | 1.392 | 87% | 0.867 | S | S | * | * | trans | -142.2 | 0 | 158 | -61.7 | 0 | 0 | 0 | 0 | 108 |
Retrieved 393 of 393 residues in 398.8 ms
(Link to these results)