| 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 | 41.6 | Very low | 46.3 | Very low | 229 Ų | 229 | 152.4 Ų | 152.4 | 100% | 1.128 | 84% | 0.838 | S | S | * | * | 0 | 86.4 | 0 | -56.7 | 173.5 | 94.3 | 0 | 0 | 104.9 | |||||
| 2 | S | 38.9 | Very low | 45.9 | Very low | 125 Ų | 125 | 149.7 Ų | 149.7 | 87% | 0.874 | 84% | 0.838 | S | S | * | * | cis | 69.6 | 125.6 | 46.1 | -35.2 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 3 | A | 45.1 | Very low | 45.6 | Very low | 94 Ų | 94 | 151.1 Ų | 151.1 | 78% | 0.777 | 84% | 0.842 | S | S | * | * | cis | -140 | 166.5 | 8.2 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 4 | L | 47.8 | Very low | 45 | Very low | 146 Ų | 146 | 145.4 Ų | 145.4 | 76% | 0.764 | 84% | 0.835 | S | S | * | * | cis | 77.9 | 88.3 | 22.8 | -167.2 | 83.1 | 0 | 0 | 0 | 117.3 | ||||
| 5 | R | 55 | Low | 45.2 | Very low | 247 Ų | 247 | 143.2 Ų | 143.2 | 93% | 0.932 | 83% | 0.828 | S | S | * | * | trans | -156.5 | 134.2 | 131.8 | -63.2 | -159.6 | -175.2 | -137.4 | -0.6 | 106.7 | ||||
| 6 | R | 49.5 | Very low | 45 | Very low | 222 Ų | 222 | 144.8 Ų | 144.8 | 84% | 0.838 | 83% | 0.825 | S | S | * | * | cis | 81.1 | 90.5 | 15.3 | -150.6 | -176.8 | -155.7 | -106.3 | 4 | 116.3 | ||||
| 7 | S | 45.8 | Very low | 44.8 | Very low | 130 Ų | 130 | 150.4 Ų | 150.4 | 91% | 0.909 | 83% | 0.832 | S | S | * | * | trans | -155.7 | 139 | 150.4 | -166.4 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 8 | G | 40.7 | Very low | 44.5 | Very low | 56 Ų | 56 | 145.6 Ų | 145.6 | 58% | 0.577 | 82% | 0.822 | S | S | * | * | cis | -174.8 | 141 | -6.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 9 | Y | 41.6 | Very low | 44.3 | Very low | 234 Ų | 234 | 148.8 Ų | 148.8 | 92% | 0.918 | 82% | 0.82 | S | S | * | * | trans | 57.6 | 135.5 | 161.8 | -73.1 | -85.2 | 0 | 0 | 0 | 122 | ||||
| 10 | G | 43.3 | Very low | 44.2 | Very low | 64 Ų | 64 | 151.9 Ų | 151.9 | 66% | 0.66 | 82% | 0.82 | S | S | * | * | trans | -114.2 | -142.9 | 168.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 11 | P | 60.1 | Low | 44.1 | Very low | 129 Ų | 129 | 155 Ų | 155 | 84% | 0.838 | 82% | 0.822 | S | S | * | * | trans | -92.6 | 171.7 | -144.9 | 37.4 | -40.1 | 0 | 0 | 0 | 116.1 | ||||
| 12 | S | 41.4 | Very low | 43.9 | Very low | 120 Ų | 120 | 147.4 Ų | 147.4 | 84% | 0.839 | 80% | 0.802 | S | S | * | * | trans | -136.2 | 138.9 | 164.7 | -64.4 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 13 | D | 41.7 | Very low | 44.6 | Very low | 168 Ų | 168 | 148 Ų | 148 | 90% | 0.898 | 80% | 0.803 | S | S | * | * | trans | -76 | 165.6 | 173.8 | -51.2 | -98 | 0 | 0 | 0 | 113.4 | ||||
| 14 | G | 38 | Very low | 44.4 | Very low | 72 Ų | 72 | 147.2 Ų | 147.2 | 74% | 0.742 | 80% | 0.804 | S | S | * | * | trans | 178.6 | 118 | 173 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 15 | P | 47.4 | Very low | 44.3 | Very low | 112 Ų | 112 | 144.4 Ų | 144.4 | 73% | 0.727 | 81% | 0.811 | S | S | * | * | trans | -116.5 | 173.7 | -162.7 | 43.1 | -36.3 | 0 | 0 | 0 | 116 | ||||
| 16 | H | 42.6 | Very low | 43.8 | Very low | 168 Ų | 168 | 135.7 Ų | 135.7 | 78% | 0.778 | 80% | 0.798 | S | S | * | * | trans | 41.5 | 125.9 | 156.1 | -62.5 | -60.6 | 0 | 0 | 0 | 120.2 | ||||
| 17 | Y | 41.8 | Very low | 43.9 | Very low | 241 Ų | 241 | 133 Ų | 133 | 95% | 0.945 | 80% | 0.801 | S | S | * | * | -168.4 | 168.1 | 101.1 | -97.7 | -70 | 0 | 0 | 0 | 108.7 | |||||
| 18 | G | 38.9 | Very low | 44.2 | Very low | 64 Ų | 64 | 132.4 Ų | 132.4 | 66% | 0.66 | 79% | 0.791 | S | S | * | * | trans | -146.2 | -178.1 | -177.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 19 | R | 40.6 | Very low | 44.7 | Very low | 206 Ų | 206 | 134.8 Ų | 134.8 | 78% | 0.777 | 80% | 0.796 | S | S | * | * | trans | 66.9 | 119.1 | 179.6 | 177.6 | -169.5 | -73.8 | -168.4 | -2.9 | 114.4 | ||||
| 20 | Y | 42.8 | Very low | 45.2 | Very low | 210 Ų | 210 | 130 Ų | 130 | 82% | 0.824 | 79% | 0.791 | S | S | * | * | -158.7 | 162.6 | 108.4 | -115.8 | -84.8 | 0 | 0 | 0 | 111.6 | |||||
| 21 | Y | 42.1 | Very low | 45.5 | Very low | 217 Ų | 217 | 135 Ų | 135 | 85% | 0.851 | 80% | 0.797 | S | S | * | * | trans | -88.9 | 155.6 | -176.6 | -83.8 | -114 | 0 | 0 | 0 | 111.6 | ||||
| 22 | G | 37.6 | Very low | 45.7 | Very low | 70 Ų | 70 | 133.9 Ų | 133.9 | 72% | 0.722 | 79% | 0.79 | S | S | * | * | trans | 141 | 157.8 | 141.7 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 23 | P | 52.8 | Low | 46.4 | Very low | 137 Ų | 137 | 133.7 Ų | 133.7 | 89% | 0.89 | 79% | 0.786 | S | S | * | * | trans | -113.3 | 150.8 | -146 | 38.2 | -28.5 | 0 | 0 | 0 | 114.5 | ||||
| 24 | G | 41.3 | Very low | 47.1 | Very low | 78 Ų | 78 | 131 Ų | 131 | 80% | 0.804 | 78% | 0.778 | S | S | * | * | trans | -142.5 | 128.5 | 165.8 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 25 | G | 46.1 | Very low | 47.8 | Very low | 88 Ų | 88 | 131.9 Ų | 131.9 | 91% | 0.907 | 77% | 0.77 | S | S | * | * | trans | -77.8 | 158.1 | -180 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 26 | G | 42.7 | Very low | 47.8 | Very low | 64 Ų | 64 | 135 Ų | 135 | 66% | 0.66 | 78% | 0.779 | S | S | * | * | trans | 172.3 | 78.1 | -178.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | V28 | G26-V28 PolarHBondContact O-N 3.43Š| ||
| 27 | D | 53.2 | Low | 48 | Very low | 166 Ų | 166 | 136.4 Ų | 136.4 | 89% | 0.888 | 78% | 0.779 | S | S | * | * | trans | -58.9 | 115.3 | 176 | -66.6 | -99.2 | 0 | 0 | 0 | 111.5 | ||||
| 28 | V | 51.4 | Low | 48.4 | Very low | 117 Ų | 117 | 130.6 Ų | 130.6 | 71% | 0.709 | 77% | 0.771 | S | S | * | * | trans | -128 | 101.2 | 170.4 | -177.2 | 0 | 0 | 0 | 0 | 108.3 | G26 V30 | G26-V28 PolarHBondContact O-N 3.43Å; V28-V30 PolarHBondContact O-N 3.08Å | ||
| 29 | P | 51.6 | Low | 48.7 | Very low | 105 Ų | 105 | 135.9 Ų | 135.9 | 68% | 0.682 | 78% | 0.784 | S | S | * | * | trans | -62.6 | 108.7 | 172.4 | -23 | 34.7 | 0 | 0 | 0 | 110.4 | H31 | P29-H31 PolarHBondContact O-N 2.94Š| ||
| 30 | V | 52.5 | Low | 48.8 | Very low | 134 Ų | 134 | 136.8 Ų | 136.8 | 81% | 0.812 | 79% | 0.787 | S | S | * | * | trans | -71 | 98.9 | 173.2 | -179.2 | 0 | 0 | 0 | 0 | 108.2 | V28 P32 | V28-V30 PolarHBondContact O-N 3.08Å; V30-P32 WeakPolarHBondContact O-CD 3.36Å | ||
| 31 | H | 49.6 | Very low | 48.9 | Very low | 168 Ų | 168 | 132.2 Ų | 132.2 | 78% | 0.778 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -62 | 122.4 | 171.7 | -80 | -97.7 | 0 | 0 | 0 | 109.8 | P29 | P29-H31 PolarHBondContact O-N 2.94Š|
| 32 | P | 64.3 | Low | 49 | Very low | 106 Ų | 106 | 128.5 Ų | 128.5 | 69% | 0.688 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -67.6 | 150 | 167.4 | 29.9 | -33.8 | 0 | 0 | 0 | 109.8 | V30 | V30-P32 WeakPolarHBondContact O-CD 3.36Š|
| 33 | P | 55.8 | Low | 49.8 | Very low | 117 Ų | 117 | 129.7 Ų | 129.7 | 76% | 0.76 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -64 | 148.4 | 175.7 | 28.1 | -34.7 | 0 | 0 | 0 | 110.9 | ||
| 34 | P | 56.3 | Low | 49.6 | Very low | 112 Ų | 112 | 128.5 Ų | 128.5 | 73% | 0.727 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -65.6 | 145.9 | 178.3 | 28.5 | -35 | 0 | 0 | 0 | 111.1 | L36 | P34-L36 PolarHBondContact O-N 2.74Š|
| 35 | P | 52.7 | Low | 49.7 | Very low | 90 Ų | 90 | 132 Ų | 132 | 58% | 0.584 | 76% | 0.756 | S | S | * | * | P | Polyproline II helix | trans | -65.1 | 135.7 | 175.5 | 27.8 | -34.1 | 0 | 0 | 0 | 110.6 | Y37 | P35-Y37 HydrophobicContact CG-CE2 4.11Å; P35-Y37 WeakPolarHBondContact O-CD2 3.47Å; P35-Y37 PolarHBondContact O-N 3.46Å |
| 36 | L | 47.7 | Very low | 49.7 | Very low | 176 Ų | 176 | 132 Ų | 132 | 92% | 0.921 | 74% | 0.74 | S | S | * | * | trans | -71.4 | 97.1 | 169.5 | -69.7 | 172.2 | 0 | 0 | 0 | 108.9 | P34 | P34-L36 PolarHBondContact O-N 2.74Š| ||
| 37 | Y | 46.2 | Very low | 50.4 | Low | 198 Ų | 198 | 133.2 Ų | 133.2 | 78% | 0.776 | 74% | 0.736 | S | S | * | * | trans | -61.3 | 133.4 | 170.4 | -67.9 | -85.3 | 0 | 0 | 0 | 110 | P35 | P35-Y37 HydrophobicContact CG-CE2 4.11Å; P35-Y37 WeakPolarHBondContact O-CD2 3.47Å; P35-Y37 PolarHBondContact O-N 3.46Å | ||
| 38 | P | 49.9 | Very low | 50.2 | Low | 120 Ų | 120 | 131.9 Ų | 131.9 | 78% | 0.779 | 73% | 0.727 | S | S | * | * | trans | -56.3 | 143.7 | 167 | -23.6 | 34.2 | 0 | 0 | 0 | 110.7 | R40 | P38-R40 PolarHBondContact O-N 3.13Š| ||
| 39 | L | 45.9 | Very low | 50.1 | Low | 175 Ų | 175 | 128.9 Ų | 128.9 | 92% | 0.916 | 71% | 0.712 | S | S | * | * | trans | -59.6 | 105.6 | 172.1 | -88.9 | 154.6 | 0 | 0 | 0 | 109.4 | P41 | L39-P41 WeakPolarHBondContact O-CD 3.2Š| ||
| 40 | R | 42 | Very low | 50.3 | Low | 225 Ų | 225 | 127 Ų | 127 | 85% | 0.849 | 69% | 0.691 | S | S | * | * | P | Polyproline II helix | trans | -58.1 | 125 | 171.1 | -173.9 | -175.3 | -169.5 | -179.8 | 4.5 | 108 | P38 E42 | P38-R40 PolarHBondContact O-N 3.13Å; R40-E42 PolarHBondContact O-N 2.61Å |
| 41 | P | 44.5 | Very low | 50.5 | Low | 113 Ų | 113 | 126 Ų | 126 | 73% | 0.734 | 67% | 0.673 | S | S | * | * | P | Polyproline II helix | trans | -56.1 | 126.6 | 169.9 | -24.4 | 34.6 | 0 | 0 | 0 | 109.6 | L39 | L39-P41 WeakPolarHBondContact O-CD 3.2Š|
| 42 | E | 45.8 | Very low | 50.4 | Low | 140 Ų | 140 | 123.3 Ų | 123.3 | 65% | 0.654 | 67% | 0.668 | S | S | * | * | P | Polyproline II helix | trans | -63.2 | 123.8 | 169 | -173.5 | 177.5 | 144.3 | 0 | 0 | 107.4 | R40 Q45 | R40-E42 PolarHBondContact O-N 2.61Å; E42-Q45 PolarHBondContact OE1-NE2 3.09Å |
| 43 | P | 53.6 | Low | 49.6 | Very low | 95 Ų | 95 | 128.8 Ų | 128.8 | 62% | 0.617 | 68% | 0.675 | S | S | * | * | P | Polyproline II helix | trans | -63.3 | 134.9 | 171.2 | 28 | -32.8 | 0 | 0 | 0 | 107.8 | Q45 | P43-Q45 PolarHBondContact O-N 3.44Å; P43-Q45 VanDerWaalsContact O-N 3.08Å |
| 44 | P | 47.7 | Very low | 48.9 | Very low | 112 Ų | 112 | 126.7 Ų | 126.7 | 73% | 0.727 | 67% | 0.674 | S | S | * | * | P | Polyproline II helix | trans | -54.6 | 122.7 | 179.9 | 23.8 | -33.6 | 0 | 0 | 0 | 108.8 | ||
| 45 | Q | 43.7 | Very low | 48 | Very low | 152 Ų | 152 | 124.6 Ų | 124.6 | 71% | 0.71 | 67% | 0.673 | S | S | * | * | P | Polyproline II helix | trans | -60.3 | 127.2 | -171.6 | -63.9 | -162.5 | 11.8 | 0 | 0 | 109.6 | E42 P43 | E42-Q45 PolarHBondContact OE1-NE2 3.09Å; P43-Q45 PolarHBondContact O-N 3.44Å; P43-Q45 VanDerWaalsContact O-N 3.08Å |
| 46 | P | 46.9 | Very low | 47.3 | Very low | 86 Ų | 86 | 123.5 Ų | 123.5 | 56% | 0.558 | 68% | 0.678 | S | S | * | * | P | Polyproline II helix | trans | -60.7 | 141.8 | 177.6 | 26.6 | -34 | 0 | 0 | 0 | 108.7 | I48 Y392 | P46-I48 PolarHBondContact O-N 3.49Å; P46-Y392 HydrophobicContact CB-CE1 4.15Å |
| 47 | P | 56.6 | Low | 47.3 | Very low | 91 Ų | 91 | 121.2 Ų | 121.2 | 59% | 0.591 | 67% | 0.674 | S | S | * | * | P | Polyproline II helix | trans | -54.7 | 129.1 | 172.1 | 24.5 | -33 | 0 | 0 | 0 | 108.7 | S49 Y392 | P47-S49 PolarHBondContact O-N 3.1Å; P47-Y392 HydrophobicContact CG-CD2 4.32Å |
| 48 | I | 50.2 | Low | 47 | Very low | 137 Ų | 137 | 116.1 Ų | 116.1 | 70% | 0.703 | 67% | 0.673 | S | S | * | * | P | Polyproline II helix | trans | -48.7 | 116.4 | -172.1 | -59.2 | 167.2 | 0 | 0 | 0 | 109.5 | P46 W50 | P46-I48 PolarHBondContact O-N 3.49Å; I48-W50 PolarHBondContact O-N 3.08Å |
| 49 | S | 48.2 | Very low | 46.4 | Very low | 54 Ų | 54 | 119 Ų | 119 | 38% | 0.378 | 68% | 0.676 | S | S | . | * | trans | -50.6 | 114.1 | -178.9 | 179 | 0 | 0 | 0 | 0 | 109.5 | P47 R51 V52 | P47-S49 PolarHBondContact O-N 3.1Å; S49-R51 PolarHBondContact O-N 3.2Å; S49-V52 WeakPolarHBondContact O-CB 3.5Å; S49-V52 WeakPolarHBondContact O-CG2 3.39Å; S49-V52 PolarHBondContact O-N 3.13Å | ||
| 50 | W | 56.6 | Low | 46.1 | Very low | 65 Ų | 65 | 117.3 Ų | 117.3 | 25% | 0.246 | 67% | 0.673 | C | S | . | * | G | 310 helix | trans | -70.2 | -11.9 | -164.1 | 54.9 | -96.9 | 0 | 0 | 0 | 112.5 | I48 V52 R53 E396 A408 L411 L412 | I48-W50 PolarHBondContact O-N 3.08Å; W50-V52 PolarHBondContact O-N 3.26Å; W50-V52 VanDerWaalsContact O-N 3.09Å; W50-R53 WeakPolarHBondContact O-CB 3.29Å; W50-R53 PolarHBondContact O-N 2.63Å; W50-E396 VanDerWaalsContact NE1-CD 3.29Å; W50-E396 PolarHBondContact NE1-OE1 3.17Å; W50-E396 VanDerWaalsContact NE1-OE1 3.17Å; W50-E396 PolarHBondContact NE1-OE2 3.46Å; W50-A408 HydrophobicContact CH2-CB 4.05Å; W50-L411 HydrophobicContact CD2-CD2 3.67Å; W50-L411 HydrophobicContact CE3-CD2 3.53Å; W50-L411 HydrophobicContact CG-CD2 4.38Å; W50-L411 HydrophobicContact CH2-CD2 3.99Å; W50-L411 HydrophobicContact CZ2-CD2 4.11Å; W50-L411 HydrophobicContact CZ3-CD2 3.7Å; W50-L412 HydrophobicContact CZ2-CD2 4.38Å; W50-L412 HydrophobicContact CZ2-CG 4.49Å |
| 51 | R | 55.5 | Low | 45.7 | Very low | 113 Ų | 113 | 112.1 Ų | 112.1 | 43% | 0.426 | 67% | 0.667 | S | S | . | * | G | 310 helix | trans | -48.2 | -31.8 | 164.9 | -59.7 | -169.5 | -173.7 | -72.7 | 3.5 | 111.9 | S49 E399 | S49-R51 PolarHBondContact O-N 3.2Å; R51-E399 IonicContact CZ-OE2 2.81Å; R51-E399 VanDerWaalsContact CZ-OE2 3.26Å; R51-E399 IonicContact NE-OE2 2.76Å; R51-E399 PolarHBondContact NE-OE2 2.96Å; R51-E399 VanDerWaalsContact NE-OE2 3.08Å; R51-E399 IonicContact NH2-OE2 3.51Å; R51-E399 PolarHBondContact NH2-OE2 3.03Å |
| 52 | V | 49.2 | Very low | 45.3 | Very low | 112 Ų | 112 | 117.9 Ų | 117.9 | 68% | 0.679 | 67% | 0.674 | S | S | * | * | G | 310 helix | trans | -74.2 | -21.2 | 178.8 | -178.5 | 0 | 0 | 0 | 0 | 113.5 | S49 W50 G54 | S49-V52 WeakPolarHBondContact O-CB 3.5Å; S49-V52 WeakPolarHBondContact O-CG2 3.39Å; S49-V52 PolarHBondContact O-N 3.13Å; W50-V52 PolarHBondContact O-N 3.26Å; W50-V52 VanDerWaalsContact O-N 3.09Å; V52-G54 PolarHBondContact O-N 2.92Å |
| 53 | R | 46.7 | Very low | 44.7 | Very low | 221 Ų | 221 | 119.8 Ų | 119.8 | 83% | 0.834 | 69% | 0.688 | S | S | * | * | G | 310 helix | trans | -79.3 | 1.1 | -175.1 | -167.9 | 173.1 | -76.8 | -95.5 | 3.3 | 113.8 | W50 | W50-R53 WeakPolarHBondContact O-CB 3.29Å; W50-R53 PolarHBondContact O-N 2.63Å |
| 54 | G | 40.6 | Very low | 43.7 | Very low | 73 Ų | 73 | 118 Ų | 118 | 75% | 0.753 | 69% | 0.686 | S | S | * | * | G | 310 helix | trans | -143.5 | 34.7 | -167.2 | 0 | 0 | 0 | 0 | 0 | 116.4 | V52 | V52-G54 PolarHBondContact O-N 2.92Š|
| 55 | G | 37 | Very low | 43.1 | Very low | 68 Ų | 68 | 122.4 Ų | 122.4 | 70% | 0.701 | 70% | 0.697 | S | S | * | * | trans | -129.2 | 138.3 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 56 | G | 39.3 | Very low | 42.6 | Very low | 67 Ų | 67 | 119 Ų | 119 | 69% | 0.691 | 70% | 0.704 | S | S | * | * | trans | -71.8 | 177.9 | 162.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | A58 | G56-A58 PolarHBondContact O-N 2.87Š| ||
| 57 | P | 46.8 | Very low | 42 | Very low | 129 Ų | 129 | 118.9 Ų | 118.9 | 84% | 0.838 | 72% | 0.718 | S | S | * | * | trans | -59.2 | 126.3 | 178.6 | 26.1 | -34.1 | 0 | 0 | 0 | 110.6 | E59 | P57-E59 PolarHBondContact O-N 2.79Š| ||
| 58 | A | 39.6 | Very low | 41.1 | Very low | 90 Ų | 90 | 118.8 Ų | 118.8 | 74% | 0.744 | 73% | 0.733 | S | S | * | * | trans | -65.7 | 129.6 | 178.5 | 0 | 0 | 0 | 0 | 0 | 110.6 | G56 T60 | G56-A58 PolarHBondContact O-N 2.87Å; A58-T60 PolarHBondContact O-N 3.42Å | ||
| 59 | E | 37.8 | Very low | 40.4 | Very low | 181 Ų | 181 | 115.9 Ų | 115.9 | 85% | 0.846 | 74% | 0.737 | S | S | * | * | trans | -77.3 | 88 | -175.5 | -62.6 | 177.6 | 124.9 | 0 | 0 | 110.7 | P57 T61 | P57-E59 PolarHBondContact O-N 2.79Å; E59-T61 PolarHBondContact O-N 2.67Å; E59-T61 PolarHBondContact O-OG1 3.22Å | ||
| 60 | T | 39.3 | Very low | 39.9 | Very low | 139 Ų | 139 | 120.5 Ų | 120.5 | 85% | 0.853 | 76% | 0.757 | S | S | * | * | trans | -64.5 | 93.7 | -179.3 | -46.2 | 0 | 0 | 0 | 0 | 111.2 | A58 W62 | A58-T60 PolarHBondContact O-N 3.42Å; T60-W62 PolarHBondContact O-N 2.69Å | ||
| 61 | T | 34.3 | Very low | 38.9 | Very low | 117 Ų | 117 | 121 Ų | 121 | 72% | 0.718 | 78% | 0.783 | S | S | * | * | trans | -75.4 | 107.4 | -175.5 | -64.2 | 0 | 0 | 0 | 0 | 111 | E59 | E59-T61 PolarHBondContact O-N 2.67Å; E59-T61 PolarHBondContact O-OG1 3.22Å | ||
| 62 | W | 35.3 | Very low | 37.9 | Very low | 233 Ų | 233 | 124.7 Ų | 124.7 | 88% | 0.883 | 80% | 0.798 | S | S | * | * | trans | 38.4 | 112.7 | 159.6 | -61.3 | 107 | 0 | 0 | 0 | 119.4 | T60 | T60-W62 PolarHBondContact O-N 2.69Š| ||
| 63 | L | 34.5 | Very low | 37.2 | Very low | 181 Ų | 181 | 129.4 Ų | 129.4 | 95% | 0.948 | 81% | 0.805 | S | S | * | * | trans | -128 | 119.8 | 136.8 | -138 | 172.7 | 0 | 0 | 0 | 106.4 | ||||
| 64 | G | 32 | Very low | 36.6 | Very low | 57 Ų | 57 | 123.5 Ų | 123.5 | 59% | 0.588 | 80% | 0.798 | S | S | * | * | trans | -127.6 | 126.2 | -172.7 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 65 | E | 35.5 | Very low | 36.3 | Very low | 204 Ų | 204 | 125.7 Ų | 125.7 | 95% | 0.953 | 80% | 0.802 | S | S | * | * | trans | -146.4 | 156.8 | 156 | -139.3 | 167.6 | 98.3 | 0 | 0 | 109.6 | ||||
| 66 | G | 33.2 | Very low | 36.1 | Very low | 82 Ų | 82 | 126.5 Ų | 126.5 | 85% | 0.845 | 81% | 0.81 | S | S | * | * | trans | -85.2 | 168.7 | -159.3 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 67 | G | 33 | Very low | 35.8 | Very low | 83 Ų | 83 | 127.3 Ų | 127.3 | 86% | 0.856 | 82% | 0.818 | S | S | * | * | trans | 168.9 | 96.3 | 171.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 68 | G | 38.3 | Very low | 35.1 | Very low | 88 Ų | 88 | 125.2 Ų | 125.2 | 91% | 0.907 | 81% | 0.812 | S | S | * | * | trans | -82.3 | 149.2 | 168.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 69 | G | 34.6 | Very low | 34.9 | Very low | 76 Ų | 76 | 131.9 Ų | 131.9 | 78% | 0.784 | 82% | 0.818 | S | S | * | * | trans | -171.6 | 102.5 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 70 | D | 38.8 | Very low | 35.2 | Very low | 151 Ų | 151 | 128.5 Ų | 128.5 | 81% | 0.807 | 81% | 0.811 | S | S | * | * | trans | -71.5 | 132.8 | 174.4 | -60.6 | -76.2 | 0 | 0 | 0 | 111.4 | Y72 | D70-Y72 HydrophobicContact CB-CE2 4.37Š| ||
| 71 | G | 35.2 | Very low | 35.3 | Very low | 77 Ų | 77 | 130 Ų | 130 | 79% | 0.794 | 81% | 0.809 | S | S | * | * | trans | -145.2 | 74.6 | -167.1 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 72 | Y | 35.2 | Very low | 35.8 | Very low | 189 Ų | 189 | 129.9 Ų | 129.9 | 74% | 0.741 | 81% | 0.81 | S | S | * | * | trans | -54.7 | 138.4 | -172.3 | -57.7 | -94 | 0 | 0 | 0 | 118 | D70 | D70-Y72 HydrophobicContact CB-CE2 4.37Š| ||
| 73 | Y | 35 | Very low | 35.6 | Very low | 212 Ų | 212 | 122 Ų | 122 | 83% | 0.831 | 80% | 0.801 | S | S | * | * | trans | 68.2 | 153.7 | 159.9 | -63.8 | -65.9 | 0 | 0 | 0 | 118.2 | ||||
| 74 | S | 34.3 | Very low | 36 | Very low | 96 Ų | 96 | 126 Ų | 126 | 67% | 0.671 | 80% | 0.803 | S | S | * | * | cis | -152.3 | 150 | 12.8 | -147.6 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 75 | S | 34.1 | Very low | 36.1 | Very low | 120 Ų | 120 | 127.9 Ų | 127.9 | 84% | 0.839 | 81% | 0.813 | S | S | * | * | trans | 39 | 123.4 | 149.1 | -61.7 | 0 | 0 | 0 | 0 | 122.6 | ||||
| 76 | G | 32.3 | Very low | 36.4 | Very low | 85 Ų | 85 | 122.6 Ų | 122.6 | 88% | 0.876 | 81% | 0.814 | S | S | * | * | trans | -175.5 | 60.2 | 167.8 | 0 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 77 | G | 32.5 | Very low | 36.3 | Very low | 84 Ų | 84 | 121.6 Ų | 121.6 | 87% | 0.866 | 80% | 0.803 | S | S | * | * | trans | 93.4 | 138.7 | 164.9 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 78 | A | 32.8 | Very low | 36.9 | Very low | 84 Ų | 84 | 123.4 Ų | 123.4 | 69% | 0.694 | 80% | 0.803 | S | S | * | * | trans | -139.6 | 118.2 | -177.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 79 | W | 34.2 | Very low | 36.9 | Very low | 231 Ų | 231 | 128 Ų | 128 | 88% | 0.875 | 80% | 0.8 | S | S | * | * | trans | 63.3 | 164.5 | 152.7 | -62.4 | 119.8 | 0 | 0 | 0 | 117.4 | ||||
| 80 | P | 45.3 | Very low | 37.2 | Very low | 109 Ų | 109 | 132.8 Ų | 132.8 | 71% | 0.708 | 80% | 0.802 | S | S | * | * | cis | -126 | 163.4 | 12.3 | 42.2 | -27.8 | 0 | 0 | 0 | 117.1 | ||||
| 81 | E | 41.9 | Very low | 37.4 | Very low | 170 Ų | 170 | 134.5 Ų | 134.5 | 79% | 0.794 | 81% | 0.805 | S | S | * | * | trans | -79.1 | 138.2 | 154.6 | 178.3 | -179.1 | 116.1 | 0 | 0 | 109.9 | ||||
| 82 | P | 43.4 | Very low | 37.7 | Very low | 116 Ų | 116 | 139.3 Ų | 139.3 | 75% | 0.753 | 81% | 0.807 | S | S | * | * | trans | -129.5 | 113.1 | 160.3 | 34.6 | -19.7 | 0 | 0 | 0 | 113.4 | ||||
| 83 | G | 30.6 | Very low | 38.5 | Very low | 66 Ų | 66 | 135.2 Ų | 135.2 | 68% | 0.68 | 80% | 0.803 | S | S | * | * | trans | 75.7 | 120.3 | 130.8 | 0 | 0 | 0 | 0 | 0 | 119.1 | A85 | G83-A85 PolarHBondContact O-N 2.78Š| ||
| 84 | R | 43.3 | Very low | 39.1 | Very low | 266 Ų | 266 | 130.7 Ų | 130.7 | 100% | 1.004 | 80% | 0.8 | S | S | * | * | trans | -62.7 | 118.4 | 158.3 | -67.6 | -177.9 | 176.7 | -158.4 | -1.3 | 110.3 | ||||
| 85 | A | 33.7 | Very low | 39.4 | Very low | 97 Ų | 97 | 135.1 Ų | 135.1 | 80% | 0.802 | 80% | 0.804 | S | S | * | * | trans | -128.7 | 137.3 | 161.6 | 0 | 0 | 0 | 0 | 0 | 109.2 | G83 G87 | G83-A85 PolarHBondContact O-N 2.78Å; A85-G87 PolarHBondContact O-N 2.76Å | ||
| 86 | G | 42.6 | Very low | 40.3 | Very low | 93 Ų | 93 | 135.6 Ų | 135.6 | 96% | 0.959 | 80% | 0.804 | S | S | * | * | trans | -77.3 | 120 | 176.7 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 87 | G | 31.9 | Very low | 40.8 | Very low | 60 Ų | 60 | 137 Ų | 137 | 62% | 0.619 | 80% | 0.8 | S | S | * | * | trans | -145.3 | 115.1 | 176.2 | 0 | 0 | 0 | 0 | 0 | 110.9 | A85 H89 | A85-G87 PolarHBondContact O-N 2.76Å; G87-H89 PolarHBondContact O-N 3.37Å | ||
| 88 | S | 44.1 | Very low | 41.1 | Very low | 122 Ų | 122 | 143.2 Ų | 143.2 | 85% | 0.853 | 80% | 0.799 | S | S | * | * | trans | -81.2 | 82.6 | -177.5 | 54.4 | 0 | 0 | 0 | 0 | 111.5 | Q90 | S88-Q90 PolarHBondContact O-N 3.21Š| ||
| 89 | H | 39.8 | Very low | 41.6 | Very low | 184 Ų | 184 | 144.7 Ų | 144.7 | 85% | 0.852 | 80% | 0.795 | S | S | * | * | trans | -80.7 | 94.1 | 168.3 | -85.5 | -87.1 | 0 | 0 | 0 | 110.7 | G87 E91 | G87-H89 PolarHBondContact O-N 3.37Å; H89-E91 PolarHBondContact O-N 2.83Å | ||
| 90 | Q | 39.9 | Very low | 42.1 | Very low | 177 Ų | 177 | 139.1 Ų | 139.1 | 83% | 0.827 | 79% | 0.791 | S | S | * | * | trans | -81.8 | 101.5 | 169 | -178.1 | 173.5 | 43.9 | 0 | 0 | 108.8 | S88 Q92 | S88-Q90 PolarHBondContact O-N 3.21Å; Q90-Q92 PolarHBondContact O-N 3.35Å | ||
| 91 | E | 42.5 | Very low | 42.2 | Very low | 187 Ų | 187 | 138.8 Ų | 138.8 | 87% | 0.874 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -61.4 | 127.8 | 170.5 | -70.7 | -171.3 | 86.7 | 0 | 0 | 110.1 | H89 | H89-E91 PolarHBondContact O-N 2.83Š|
| 92 | Q | 41.2 | Very low | 42.5 | Very low | 178 Ų | 178 | 140 Ų | 140 | 83% | 0.832 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -82.7 | 129 | 177.7 | -71.3 | -173.1 | -26.5 | 0 | 0 | 110.2 | Q90 | Q90-Q92 PolarHBondContact O-N 3.35Š|
| 93 | P | 53 | Low | 42.4 | Very low | 102 Ų | 102 | 145.7 Ų | 145.7 | 66% | 0.662 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -68.2 | 144.3 | 168.5 | 29.6 | -33.7 | 0 | 0 | 0 | 110.1 | Y95 | P93-Y95 PolarHBondContact O-N 3.45Š|
| 94 | P | 47.6 | Very low | 43 | Very low | 118 Ų | 118 | 149.4 Ų | 149.4 | 77% | 0.766 | 79% | 0.793 | S | S | * | * | S | Bend | trans | -72.5 | 10.4 | -169.5 | 28.4 | -36.1 | 0 | 0 | 0 | 115.9 | ||
| 95 | Y | 40.8 | Very low | 42.5 | Very low | 189 Ų | 189 | 141.5 Ų | 141.5 | 74% | 0.741 | 78% | 0.779 | S | S | * | * | trans | -137.8 | 105.2 | 178.6 | -73.5 | -79.4 | 0 | 0 | 0 | 111.2 | P93 S97 | P93-Y95 PolarHBondContact O-N 3.45Å; Y95-S97 VanDerWaalsContact C-N 3.25Å; Y95-S97 PolarHBondContact O-N 3.04Å | ||
| 96 | P | 52.3 | Low | 43 | Very low | 130 Ų | 130 | 142.6 Ų | 142.6 | 84% | 0.844 | 78% | 0.781 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.1 | -2.6 | -174.8 | 31.6 | -36.5 | 0 | 0 | 0 | 114.6 | ||
| 97 | S | 43 | Very low | 43 | Very low | 114 Ų | 114 | 143 Ų | 143 | 80% | 0.797 | 78% | 0.775 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101 | 5.6 | -167.5 | -50 | 0 | 0 | 0 | 0 | 115.3 | Y95 | Y95-S97 VanDerWaalsContact C-N 3.25Å; Y95-S97 PolarHBondContact O-N 3.04Å |
| 98 | Y | 40.3 | Very low | 43.6 | Very low | 214 Ų | 214 | 151.7 Ų | 151.7 | 84% | 0.839 | 79% | 0.789 | S | S | * | * | trans | -114.4 | 120.3 | 179 | -122.3 | -92.7 | 0 | 0 | 0 | 112 | ||||
| 99 | N | 43.3 | Very low | 43.3 | Very low | 115 Ų | 115 | 151.8 Ų | 151.8 | 62% | 0.615 | 79% | 0.789 | S | S | * | * | trans | -82.7 | 117.3 | -178.6 | -176.9 | -7.1 | 0 | 0 | 0 | 110.8 | N101 | N99-N101 PolarHBondContact O-N 3.27Å; N99-N101 WeakPolarHBondContact OD1-CB 3.25Å; N99-N101 PolarHBondContact OD1-N 3.44Å; N99-N101 PolarHBondContact OD1-ND2 3.06Å | ||
| 100 | S | 44.2 | Very low | 43 | Very low | 114 Ų | 114 | 154 Ų | 154 | 80% | 0.797 | 79% | 0.79 | S | S | * | * | G | 310 helix | trans | -62.2 | -8.3 | -177.1 | -157.6 | 0 | 0 | 0 | 0 | 115.1 | Y102 | S100-Y102 PolarHBondContact O-N 2.99Š|
| 101 | N | 46.9 | Very low | 43 | Very low | 103 Ų | 103 | 149.4 Ų | 149.4 | 55% | 0.551 | 78% | 0.783 | S | S | * | * | G | 310 helix | trans | -83.2 | -2.9 | -175.5 | -68 | -76.8 | 0 | 0 | 0 | 115.4 | N99 W103 N104 | N99-N101 PolarHBondContact O-N 3.27Å; N99-N101 WeakPolarHBondContact OD1-CB 3.25Å; N99-N101 PolarHBondContact OD1-N 3.44Å; N99-N101 PolarHBondContact OD1-ND2 3.06Å; N101-W103 PolarHBondContact O-N 3.25Å; N101-N104 PolarHBondContact O-N 2.86Å |
| 102 | Y | 48.9 | Very low | 43 | Very low | 196 Ų | 196 | 146.4 Ų | 146.4 | 77% | 0.769 | 78% | 0.78 | S | S | * | * | G | 310 helix | trans | -62.1 | -29.5 | -175.6 | -157.4 | -93.5 | 0 | 0 | 0 | 113.7 | S100 | S100-Y102 PolarHBondContact O-N 2.99Š|
| 103 | W | 39.7 | Very low | 42.7 | Very low | 234 Ų | 234 | 148.1 Ų | 148.1 | 89% | 0.886 | 78% | 0.78 | S | S | * | * | G | 310 helix | trans | -94 | -7.4 | -179.5 | -77.2 | 103.9 | 0 | 0 | 0 | 115.3 | N101 | N101-W103 PolarHBondContact O-N 3.25Š|
| 104 | N | 43.7 | Very low | 41.9 | Very low | 144 Ų | 144 | 148.6 Ų | 148.6 | 77% | 0.77 | 78% | 0.783 | S | S | * | * | trans | -121.2 | 45.3 | -179.4 | -87.7 | -56.2 | 0 | 0 | 0 | 112.5 | N101 | N101-N104 PolarHBondContact O-N 2.86Š| ||
| 105 | S | 32.7 | Very low | 41.3 | Very low | 100 Ų | 100 | 148.2 Ų | 148.2 | 70% | 0.699 | 78% | 0.783 | S | S | * | * | trans | -92.2 | 107.6 | 166.1 | -70.6 | 0 | 0 | 0 | 0 | 110.2 | A107 | S105-A107 PolarHBondContact O-N 3.28Š| ||
| 106 | S | 45.6 | Very low | 41.3 | Very low | 120 Ų | 120 | 145.1 Ų | 145.1 | 84% | 0.839 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -50.5 | 127.6 | 175.5 | -51.9 | 0 | 0 | 0 | 0 | 111.1 | R108 | S106-R108 PolarHBondContact O-N 3.31Å; S106-R108 VanDerWaalsContact O-N 3.14Å |
| 107 | A | 42 | Very low | 40.6 | Very low | 101 Ų | 101 | 149 Ų | 149 | 84% | 0.835 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -57.6 | 118.4 | -170.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | S105 S109 | S105-A107 PolarHBondContact O-N 3.28Å; A107-S109 PolarHBondContact O-N 3.43Å |
| 108 | R | 43.6 | Very low | 40.5 | Very low | 244 Ų | 244 | 149.4 Ų | 149.4 | 92% | 0.921 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -64.8 | 127.5 | 167.5 | -71.7 | -175.2 | 176 | -173.3 | -0.8 | 108.7 | S106 R110 | S106-R108 PolarHBondContact O-N 3.31Å; S106-R108 VanDerWaalsContact O-N 3.14Å; R108-R110 PolarHBondContact O-N 2.95Å; R108-R110 VanDerWaalsContact O-N 3.13Å |
| 109 | S | 37.6 | Very low | 40.5 | Very low | 123 Ų | 123 | 146 Ų | 146 | 86% | 0.86 | 78% | 0.784 | S | S | * | * | trans | -60.8 | 114 | 177.4 | 36.4 | 0 | 0 | 0 | 0 | 110.8 | A107 | A107-S109 PolarHBondContact O-N 3.43Š| ||
| 110 | R | 34.1 | Very low | 40.3 | Very low | 231 Ų | 231 | 151.5 Ų | 151.5 | 87% | 0.872 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -75.7 | 122.6 | 174.6 | -170.4 | 179.5 | -174.1 | -173.4 | 2.2 | 108.8 | R108 | R108-R110 PolarHBondContact O-N 2.95Å; R108-R110 VanDerWaalsContact O-N 3.13Å |
| 111 | A | 41.1 | Very low | 40.4 | Very low | 81 Ų | 81 | 151.7 Ų | 151.7 | 67% | 0.669 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -61.4 | 139.3 | 177 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||
| 112 | P | 41.6 | Very low | 39.9 | Very low | 124 Ų | 124 | 155.9 Ų | 155.9 | 81% | 0.805 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -64 | 142.9 | 174.2 | -21.4 | 33.4 | 0 | 0 | 0 | 112.2 | ||
| 113 | Y | 35.7 | Very low | 39.6 | Very low | 214 Ų | 214 | 154.6 Ų | 154.6 | 84% | 0.839 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -75.9 | 138.4 | 167 | -117.7 | -101.2 | 0 | 0 | 0 | 109.6 | S115 | Y113-S115 PolarHBondContact O-N 3.32Š|
| 114 | P | 35.1 | Very low | 39.3 | Very low | 111 Ų | 111 | 151.8 Ų | 151.8 | 72% | 0.721 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -70.3 | 125.1 | 169.6 | 29.3 | -32.5 | 0 | 0 | 0 | 109.9 | ||
| 115 | S | 36.1 | Very low | 39.2 | Very low | 110 Ų | 110 | 148.4 Ų | 148.4 | 77% | 0.769 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -103.6 | 120.1 | 174 | -173 | 0 | 0 | 0 | 0 | 110 | Y113 | Y113-S115 PolarHBondContact O-N 3.32Š|
| 116 | T | 40.2 | Very low | 39.4 | Very low | 125 Ų | 125 | 152.8 Ų | 152.8 | 77% | 0.767 | 82% | 0.822 | S | S | * | * | trans | -105 | 74.2 | -173.5 | -49.9 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 117 | Y | 36.6 | Very low | 38.8 | Very low | 210 Ų | 210 | 151.8 Ų | 151.8 | 82% | 0.824 | 82% | 0.815 | S | S | * | * | trans | -138.9 | 133.5 | 167.3 | -87 | -79.9 | 0 | 0 | 0 | 111.3 | ||||
| 118 | P | 42.4 | Very low | 38.5 | Very low | 123 Ų | 123 | 154.8 Ų | 154.8 | 80% | 0.799 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -77.5 | 135.2 | -176.8 | 30.5 | -34.3 | 0 | 0 | 0 | 112.3 | ||
| 119 | V | 39.7 | Very low | 38.2 | Very low | 142 Ų | 142 | 149.1 Ų | 149.1 | 86% | 0.861 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -66.9 | 135 | 169 | 173.9 | 0 | 0 | 0 | 0 | 109.6 | ||
| 120 | R | 39.2 | Very low | 38 | Very low | 231 Ų | 231 | 148.9 Ų | 148.9 | 87% | 0.872 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -100.7 | 134.7 | 174 | -169.2 | 174.6 | -174 | 163.4 | 2.3 | 109.6 | ||
| 121 | P | 46.5 | Very low | 37.8 | Very low | 118 Ų | 118 | 147.8 Ų | 147.8 | 77% | 0.766 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -61.8 | 158.7 | -178.7 | -26.2 | 35.8 | 0 | 0 | 0 | 115 | ||
| 122 | E | 36.3 | Very low | 37.6 | Very low | 191 Ų | 191 | 149.9 Ų | 149.9 | 89% | 0.893 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -64 | 160.1 | -178.1 | -59.3 | 165.4 | 107.9 | 0 | 0 | 113.4 | ||
| 123 | L | 42.5 | Very low | 37.4 | Very low | 169 Ų | 169 | 151 Ų | 151 | 89% | 0.885 | 80% | 0.804 | S | S | * | * | trans | -141.9 | 113.2 | 167.6 | -124.2 | 167.8 | 0 | 0 | 0 | 111.4 | ||||
| 124 | Q | 34.2 | Very low | 37.4 | Very low | 175 Ų | 175 | 144.2 Ų | 144.2 | 82% | 0.818 | 80% | 0.799 | S | S | * | * | trans | -6.5 | 123.8 | 170 | -146.6 | 68.2 | 8.3 | 0 | 0 | 118 | ||||
| 125 | G | 40.3 | Very low | 37.4 | Very low | 74 Ų | 74 | 143.4 Ų | 143.4 | 76% | 0.763 | 80% | 0.802 | S | S | * | * | trans | -72 | 163.5 | -177 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 126 | Q | 37.4 | Very low | 37.3 | Very low | 191 Ų | 191 | 149.8 Ų | 149.8 | 89% | 0.893 | 81% | 0.811 | S | S | * | * | trans | -133.6 | 132.3 | 168.7 | -63.9 | -176 | -2.1 | 0 | 0 | 108.7 | ||||
| 127 | S | 33.5 | Very low | 37.2 | Very low | 99 Ų | 99 | 147.2 Ų | 147.2 | 69% | 0.692 | 81% | 0.809 | S | S | * | * | trans | -81.4 | 118.5 | 176 | 45.2 | 0 | 0 | 0 | 0 | 110.6 | N129 | S127-N129 PolarHBondContact O-N 2.97Å; S127-N129 VanDerWaalsContact O-N 3.08Å | ||
| 128 | L | 35 | Very low | 37.7 | Very low | 164 Ų | 164 | 142.9 Ų | 142.9 | 86% | 0.859 | 81% | 0.806 | S | S | * | * | trans | -82.3 | 87.6 | 177.2 | -164.2 | 70.4 | 0 | 0 | 0 | 110.1 | ||||
| 129 | N | 37.8 | Very low | 37.4 | Very low | 125 Ų | 125 | 142.5 Ų | 142.5 | 67% | 0.668 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -66 | 150.7 | 176.4 | -70.4 | -44.2 | 0 | 0 | 0 | 112 | S127 Y131 | S127-N129 PolarHBondContact O-N 2.97Å; S127-N129 VanDerWaalsContact O-N 3.08Å; N129-Y131 PolarHBondContact O-N 2.63Å |
| 130 | S | 32 | Very low | 37.1 | Very low | 119 Ų | 119 | 145.8 Ų | 145.8 | 83% | 0.832 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -60.1 | 126.8 | -175.1 | -47.9 | 0 | 0 | 0 | 0 | 113.4 | ||
| 131 | Y | 31.3 | Very low | 37.7 | Very low | 208 Ų | 208 | 140.5 Ų | 140.5 | 82% | 0.816 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -80.1 | 119.8 | 167.1 | -81.6 | -86.9 | 0 | 0 | 0 | 110.7 | N129 | N129-Y131 PolarHBondContact O-N 2.63Š|
| 132 | T | 35.6 | Very low | 38.3 | Very low | 125 Ų | 125 | 140.7 Ų | 140.7 | 77% | 0.767 | 80% | 0.797 | S | S | * | * | trans | -131.8 | 126.9 | 165.7 | 179 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 133 | N | 37.1 | Very low | 38.2 | Very low | 148 Ų | 148 | 135.1 Ų | 135.1 | 79% | 0.791 | 79% | 0.791 | S | S | * | * | trans | -105.4 | 137.1 | 162.5 | -57.3 | -72.9 | 0 | 0 | 0 | 105.2 | ||||
| 134 | G | 37.7 | Very low | 38.2 | Very low | 71 Ų | 71 | 133.4 Ų | 133.4 | 73% | 0.732 | 79% | 0.79 | S | S | * | * | cis | 92.5 | 127.2 | 25.2 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 135 | A | 33.9 | Very low | 38.2 | Very low | 93 Ų | 93 | 128.5 Ų | 128.5 | 77% | 0.769 | 79% | 0.787 | S | S | * | * | cis | -163.2 | 156 | -7.5 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 136 | Y | 35.1 | Very low | 38 | Very low | 245 Ų | 245 | 129.3 Ų | 129.3 | 96% | 0.961 | 79% | 0.786 | S | S | * | * | trans | -148.2 | 128.5 | 157.7 | -91.3 | -76.3 | 0 | 0 | 0 | 110.3 | ||||
| 137 | G | 36.5 | Very low | 37.9 | Very low | 70 Ų | 70 | 128.5 Ų | 128.5 | 72% | 0.722 | 79% | 0.788 | S | S | * | * | trans | -101.5 | -169.9 | 169.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 138 | P | 46.9 | Very low | 37.9 | Very low | 119 Ų | 119 | 130.2 Ų | 130.2 | 77% | 0.773 | 79% | 0.794 | S | S | * | * | cis | -144.6 | 138.7 | 40.2 | 37 | -15.8 | 0 | 0 | 0 | 119.2 | ||||
| 139 | T | 36.1 | Very low | 37.9 | Very low | 116 Ų | 116 | 127.5 Ų | 127.5 | 71% | 0.712 | 80% | 0.796 | S | S | * | * | 60.8 | 90.3 | 118.3 | -41.1 | 0 | 0 | 0 | 0 | 122.6 | |||||
| 140 | Y | 34.3 | Very low | 37.5 | Very low | 211 Ų | 211 | 126.5 Ų | 126.5 | 83% | 0.827 | 80% | 0.798 | S | S | * | * | trans | 65.2 | 166.6 | 140.3 | -73.6 | -63.1 | 0 | 0 | 0 | 120.3 | ||||
| 141 | P | 52.2 | Low | 37.6 | Very low | 120 Ų | 120 | 132.3 Ų | 132.3 | 78% | 0.779 | 80% | 0.804 | S | S | * | * | cis | -124.4 | 174.5 | 16 | 42.9 | -27.9 | 0 | 0 | 0 | 117.4 | ||||
| 142 | P | 59.3 | Low | 37.7 | Very low | 121 Ų | 121 | 128 Ų | 128 | 79% | 0.786 | 80% | 0.804 | S | S | * | * | trans | -93.6 | 157.8 | -177.8 | 36.7 | -35.1 | 0 | 0 | 0 | 114.8 | ||||
| 143 | G | 32.8 | Very low | 37.5 | Very low | 75 Ų | 75 | 126 Ų | 126 | 77% | 0.773 | 81% | 0.807 | S | S | * | * | trans | -152.3 | 163.4 | 173.2 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 144 | P | 44.2 | Very low | 37.4 | Very low | 133 Ų | 133 | 122.6 Ų | 122.6 | 86% | 0.864 | 80% | 0.8 | S | S | * | * | trans | -122.9 | 160.5 | -150.3 | 40.6 | -29 | 0 | 0 | 0 | 117 | ||||
| 145 | G | 33.7 | Very low | 37.2 | Very low | 72 Ų | 72 | 129.4 Ų | 129.4 | 74% | 0.742 | 81% | 0.805 | S | S | * | * | 103.4 | 127.1 | 129.9 | 0 | 0 | 0 | 0 | 0 | 118.9 | |||||
| 146 | A | 36.3 | Very low | 37.3 | Very low | 90 Ų | 90 | 135.9 Ų | 135.9 | 74% | 0.744 | 81% | 0.812 | S | S | * | * | trans | 50 | 126.7 | 150.1 | 0 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 147 | N | 34.1 | Very low | 37.3 | Very low | 175 Ų | 175 | 128.3 Ų | 128.3 | 94% | 0.936 | 80% | 0.8 | S | S | * | * | -149 | 126.9 | 129 | -101.2 | -52.1 | 0 | 0 | 0 | 110.3 | |||||
| 148 | T | 33.3 | Very low | 37.9 | Very low | 134 Ų | 134 | 130.6 Ų | 130.6 | 82% | 0.822 | 80% | 0.802 | S | S | * | * | trans | -110.4 | 128.1 | 178.6 | 50.4 | 0 | 0 | 0 | 0 | 110 | ||||
| 149 | A | 35.1 | Very low | 37.2 | Very low | 108 Ų | 108 | 128.1 Ų | 128.1 | 89% | 0.893 | 80% | 0.797 | S | S | * | * | trans | -143.9 | 105.4 | 167.3 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 150 | S | 30.9 | Very low | 37.1 | Very low | 104 Ų | 104 | 133.9 Ų | 133.9 | 73% | 0.727 | 81% | 0.808 | S | S | * | * | trans | -82.8 | 148.8 | 176.5 | -54.3 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 151 | Y | 33.5 | Very low | 37.3 | Very low | 241 Ų | 241 | 129.6 Ų | 129.6 | 95% | 0.945 | 80% | 0.804 | S | S | * | * | trans | -131.1 | 134.8 | 148 | -111.6 | -88.5 | 0 | 0 | 0 | 109.5 | ||||
| 152 | S | 33.6 | Very low | 36.4 | Very low | 118 Ų | 118 | 131.8 Ų | 131.8 | 83% | 0.825 | 80% | 0.804 | S | S | * | * | trans | -98.7 | 148 | -172.5 | -58.5 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 153 | G | 31.7 | Very low | 35 | Very low | 81 Ų | 81 | 130.3 Ų | 130.3 | 84% | 0.835 | 79% | 0.793 | S | S | * | * | trans | 176.2 | 79.1 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 154 | A | 34 | Very low | 35 | Very low | 77 Ų | 77 | 132 Ų | 132 | 64% | 0.636 | 79% | 0.792 | S | S | * | * | trans | -91.4 | 156.4 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 155 | Y | 34.8 | Very low | 34.3 | Very low | 215 Ų | 215 | 136.4 Ų | 136.4 | 84% | 0.843 | 79% | 0.793 | S | S | * | * | 159.3 | 159.7 | 116.1 | -82.5 | -63.6 | 0 | 0 | 0 | 112.5 | |||||
| 156 | Y | 34.3 | Very low | 34.4 | Very low | 229 Ų | 229 | 138.5 Ų | 138.5 | 90% | 0.898 | 80% | 0.797 | S | S | * | * | trans | 74.7 | 106.4 | 174.5 | -71.5 | -77.8 | 0 | 0 | 0 | 120.7 | ||||
| 157 | A | 35.7 | Very low | 34.2 | Very low | 86 Ų | 86 | 140 Ų | 140 | 71% | 0.711 | 80% | 0.797 | S | S | * | * | trans | -118.1 | -175.4 | 140.3 | 0 | 0 | 0 | 0 | 0 | 106.4 | ||||
| 158 | P | 49.8 | Very low | 34.2 | Very low | 118 Ų | 118 | 140.4 Ų | 140.4 | 77% | 0.766 | 79% | 0.793 | S | S | * | * | cis | -137.9 | 165.2 | 1.7 | 42 | -24.9 | 0 | 0 | 0 | 117 | ||||
| 159 | G | 32.4 | Very low | 34.5 | Very low | 66 Ų | 66 | 140.5 Ų | 140.5 | 68% | 0.68 | 79% | 0.793 | S | S | * | * | 56.8 | 127.3 | 128.8 | 0 | 0 | 0 | 0 | 0 | 123.2 | |||||
| 160 | Y | 33.7 | Very low | 35.2 | Very low | 237 Ų | 237 | 141.2 Ų | 141.2 | 93% | 0.929 | 79% | 0.789 | S | S | * | * | trans | -139.7 | 168.4 | 149.3 | -86.3 | -71.5 | 0 | 0 | 0 | 110.8 | ||||
| 161 | T | 37.2 | Very low | 35.2 | Very low | 121 Ų | 121 | 141 Ų | 141 | 74% | 0.742 | 79% | 0.787 | S | S | * | * | trans | -138.8 | 169.6 | -166.8 | 58.7 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 162 | Q | 33.8 | Very low | 35.2 | Very low | 167 Ų | 167 | 134.8 Ų | 134.8 | 78% | 0.78 | 78% | 0.775 | S | S | * | * | trans | 97.5 | 130.9 | 151.1 | -77 | -170.1 | 88.7 | 0 | 0 | 123.4 | ||||
| 163 | T | 30.1 | Very low | 35.1 | Very low | 90 Ų | 90 | 137.9 Ų | 137.9 | 55% | 0.552 | 77% | 0.769 | S | S | * | * | trans | 64.4 | 107.1 | 138.7 | 56.3 | 0 | 0 | 0 | 0 | 123.5 | ||||
| 164 | S | 33.8 | Very low | 35.1 | Very low | 109 Ų | 109 | 143.6 Ų | 143.6 | 76% | 0.762 | 77% | 0.766 | S | S | * | * | 40.8 | 121.8 | 105.1 | -46.8 | 0 | 0 | 0 | 0 | 121.5 | |||||
| 165 | Y | 28.7 | Very low | 34.9 | Very low | 226 Ų | 226 | 145.3 Ų | 145.3 | 89% | 0.886 | 77% | 0.773 | S | S | * | * | trans | -138.4 | 157.2 | 147.5 | -70.5 | -74.6 | 0 | 0 | 0 | 110.9 | ||||
| 166 | S | 34.7 | Very low | 34.7 | Very low | 117 Ų | 117 | 140.9 Ų | 140.9 | 82% | 0.818 | 77% | 0.773 | S | S | * | * | trans | -140.4 | 143.4 | 180 | -178.6 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 167 | T | 34 | Very low | 34.5 | Very low | 122 Ų | 122 | 133.2 Ų | 133.2 | 75% | 0.748 | 76% | 0.764 | S | S | * | * | trans | -150.4 | 97.3 | -176.5 | -51.5 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 168 | E | 33 | Very low | 34.3 | Very low | 183 Ų | 183 | 136.5 Ų | 136.5 | 86% | 0.855 | 77% | 0.77 | S | S | * | * | trans | 16.4 | 150.8 | 140.2 | 47.8 | -168.5 | 97.5 | 0 | 0 | 123.2 | ||||
| 169 | V | 38.6 | Very low | 33.7 | Very low | 135 Ų | 135 | 136.5 Ų | 136.5 | 82% | 0.818 | 77% | 0.773 | S | S | * | * | trans | -121.4 | 151.9 | -178.1 | -162.5 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 170 | P | 51.1 | Low | 34.4 | Very low | 124 Ų | 124 | 139 Ų | 139 | 81% | 0.805 | 78% | 0.777 | S | S | * | * | trans | -140.4 | 105.6 | 138.2 | 33.5 | -17.4 | 0 | 0 | 0 | 115.9 | ||||
| 171 | S | 31.3 | Very low | 34.4 | Very low | 99 Ų | 99 | 134 Ų | 134 | 69% | 0.692 | 77% | 0.771 | S | S | * | * | 45.7 | 143 | 126.2 | -160.8 | 0 | 0 | 0 | 0 | 123.7 | |||||
| 172 | T | 32 | Very low | 34.9 | Very low | 111 Ų | 111 | 134 Ų | 134 | 68% | 0.681 | 77% | 0.773 | S | S | * | * | trans | 85 | 105.8 | 147.4 | -4.2 | 0 | 0 | 0 | 0 | 120 | ||||
| 173 | Y | 32.3 | Very low | 35 | Very low | 183 Ų | 183 | 132.5 Ų | 132.5 | 72% | 0.718 | 78% | 0.775 | S | S | * | * | -165.9 | 136 | 101.6 | -125.2 | -121 | 0 | 0 | 0 | 114.7 | |||||
| 174 | R | 31.3 | Very low | 35.1 | Very low | 201 Ų | 201 | 133.4 Ų | 133.4 | 76% | 0.758 | 79% | 0.785 | S | S | * | * | trans | 48.1 | 123.9 | 160.7 | -69.2 | -172.8 | -165.5 | -72.7 | -4.5 | 122.7 | ||||
| 175 | S | 30.3 | Very low | 35.1 | Very low | 112 Ų | 112 | 138.9 Ų | 138.9 | 78% | 0.783 | 79% | 0.789 | S | S | * | * | trans | -58.8 | 176.2 | 148.8 | -18.9 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 176 | S | 29.8 | Very low | 35.1 | Very low | 122 Ų | 122 | 139.8 Ų | 139.8 | 85% | 0.853 | 79% | 0.791 | S | S | * | * | cis | -169.3 | 151.5 | 13.5 | 30.7 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 177 | G | 30.5 | Very low | 35 | Very low | 69 Ų | 69 | 141.7 Ų | 141.7 | 71% | 0.711 | 79% | 0.791 | S | S | * | * | trans | 179.1 | 97.4 | 169.4 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 178 | N | 32.8 | Very low | 34.8 | Very low | 155 Ų | 155 | 146.4 Ų | 146.4 | 83% | 0.829 | 80% | 0.796 | S | S | * | * | trans | 44.7 | 95.1 | 152 | -59.1 | 11.6 | 0 | 0 | 0 | 120.9 | ||||
| 179 | S | 36.6 | Very low | 35.4 | Very low | 117 Ų | 117 | 143.2 Ų | 143.2 | 82% | 0.818 | 79% | 0.791 | S | S | * | * | 47.3 | 164.7 | 109.7 | -35.7 | 0 | 0 | 0 | 0 | 121.6 | |||||
| 180 | P | 46.1 | Very low | 35 | Very low | 119 Ų | 119 | 145.3 Ų | 145.3 | 77% | 0.773 | 79% | 0.792 | S | S | * | * | -130.6 | 159 | -94.9 | 33.7 | -13.6 | 0 | 0 | 0 | 115.7 | |||||
| 181 | T | 35.4 | Very low | 34.3 | Very low | 133 Ų | 133 | 148 Ų | 148 | 82% | 0.816 | 79% | 0.794 | S | S | * | * | trans | -96.8 | 119.9 | 168.1 | 41.7 | 0 | 0 | 0 | 0 | 111.6 | V183 | T181-V183 PolarHBondContact O-N 3.27Š| ||
| 182 | P | 47.3 | Very low | 34.3 | Very low | 119 Ų | 119 | 150.2 Ų | 150.2 | 77% | 0.773 | 80% | 0.798 | S | S | * | * | trans | -84.9 | 110.9 | 176.7 | 31.6 | -32 | 0 | 0 | 0 | 111.8 | ||||
| 183 | V | 35.1 | Very low | 34.3 | Very low | 136 Ų | 136 | 149.3 Ų | 149.3 | 82% | 0.824 | 80% | 0.796 | S | S | * | * | trans | -106.4 | 105.1 | 163.1 | 175.8 | 0 | 0 | 0 | 0 | 108.4 | T181 | T181-V183 PolarHBondContact O-N 3.27Š| ||
| 184 | S | 33.1 | Very low | 34.1 | Very low | 110 Ų | 110 | 148.5 Ų | 148.5 | 77% | 0.769 | 80% | 0.798 | S | S | * | * | trans | -101.7 | 100.8 | 179.2 | -62.7 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 185 | R | 33.4 | Very low | 34.1 | Very low | 223 Ų | 223 | 144 Ų | 144 | 84% | 0.842 | 79% | 0.793 | S | S | * | * | trans | -98.7 | 125.2 | 166 | -173.3 | -177 | -69.4 | -132.9 | 2.3 | 108.6 | ||||
| 186 | W | 28.6 | Very low | 34 | Very low | 245 Ų | 245 | 147.5 Ų | 147.5 | 93% | 0.928 | 80% | 0.797 | S | S | * | * | trans | -66.5 | 136 | -177.2 | -59.8 | 88.2 | 0 | 0 | 0 | 112.3 | ||||
| 187 | I | 32.3 | Very low | 34.2 | Very low | 157 Ų | 157 | 145.8 Ų | 145.8 | 81% | 0.805 | 79% | 0.791 | S | S | * | * | trans | -136.3 | 139.4 | 168.6 | -70.1 | -174.2 | 0 | 0 | 0 | 109.3 | ||||
| 188 | Y | 31 | Very low | 35.2 | Very low | 221 Ų | 221 | 148.1 Ų | 148.1 | 87% | 0.867 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -69.3 | 140.2 | 176.7 | -112.5 | -106.8 | 0 | 0 | 0 | 112 | ||
| 189 | P | 43.8 | Very low | 36.5 | Very low | 116 Ų | 116 | 145.5 Ų | 145.5 | 75% | 0.753 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -80.7 | 119.9 | 166.8 | 31.7 | -30.9 | 0 | 0 | 0 | 110.9 | ||
| 190 | Q | 31.4 | Very low | 36.4 | Very low | 179 Ų | 179 | 147.4 Ų | 147.4 | 84% | 0.836 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -90.3 | 140 | 160.3 | -124 | -97.2 | -74 | 0 | 0 | 107.8 | ||
| 191 | Q | 36.4 | Very low | 35.6 | Very low | 180 Ų | 180 | 153.6 Ų | 153.6 | 84% | 0.841 | 79% | 0.792 | S | S | * | * | trans | -104.3 | 132.9 | 175.7 | -75.4 | -174.2 | -34 | 0 | 0 | 110.2 | ||||
| 192 | D | 31.3 | Very low | 35.4 | Very low | 147 Ų | 147 | 150.6 Ų | 150.6 | 79% | 0.786 | 79% | 0.788 | S | S | * | * | trans | -140.6 | 173.3 | 154.8 | -142.5 | -46.5 | 0 | 0 | 0 | 109.3 | ||||
| 193 | C | 30.8 | Very low | 34.7 | Very low | 92 Ų | 92 | 153.3 Ų | 153.3 | 62% | 0.622 | 79% | 0.791 | S | S | * | * | trans | -104.5 | -172.4 | -138.7 | -58.7 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 194 | Q | 29.2 | Very low | 34.7 | Very low | 166 Ų | 166 | 152.5 Ų | 152.5 | 78% | 0.776 | 79% | 0.786 | S | S | * | * | trans | 87.1 | 139.4 | 159.8 | -50.5 | -57.4 | -44.4 | 0 | 0 | 116.9 | ||||
| 195 | T | 30.9 | Very low | 35.5 | Very low | 105 Ų | 105 | 153.2 Ų | 153.2 | 64% | 0.644 | 79% | 0.788 | S | S | * | * | cis | -165.7 | 169.8 | -21 | -120.9 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 196 | E | 28.8 | Very low | 35.3 | Very low | 186 Ų | 186 | 145.6 Ų | 145.6 | 87% | 0.869 | 78% | 0.778 | S | S | * | * | trans | 72.8 | 166.4 | 166.3 | -141.2 | 129.1 | 112.5 | 0 | 0 | 119.8 | ||||
| 197 | A | 33.8 | Very low | 35.6 | Very low | 87 Ų | 87 | 145 Ų | 145 | 72% | 0.719 | 78% | 0.778 | S | S | * | * | trans | -143.3 | -159.2 | -164.4 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 198 | P | 51.2 | Low | 36.3 | Very low | 117 Ų | 117 | 143 Ų | 143 | 76% | 0.76 | 78% | 0.775 | S | S | * | * | trans | -121.2 | -144.4 | -133.5 | 41.7 | -19.7 | 0 | 0 | 0 | 110.6 | ||||
| 199 | P | 59.8 | Low | 36.4 | Very low | 101 Ų | 101 | 137.4 Ų | 137.4 | 66% | 0.656 | 77% | 0.774 | S | S | * | * | cis | -132.6 | -173.5 | -17.3 | 28.1 | -4.4 | 0 | 0 | 0 | 114.1 | ||||
| 200 | L | 35.3 | Very low | 36.1 | Very low | 156 Ų | 156 | 137.6 Ų | 137.6 | 82% | 0.817 | 78% | 0.778 | S | S | * | * | 156.5 | 154.9 | 116.5 | -81.9 | 176.6 | 0 | 0 | 0 | 116.5 | |||||
| 201 | R | 29.6 | Very low | 36.6 | Very low | 249 Ų | 249 | 137.8 Ų | 137.8 | 94% | 0.94 | 78% | 0.779 | S | S | * | * | trans | 78.8 | 118.9 | 151.6 | -99.2 | -178.7 | -179.1 | -169.4 | 1.8 | 121.7 | ||||
| 202 | G | 30.8 | Very low | 36.3 | Very low | 71 Ų | 71 | 137 Ų | 137 | 73% | 0.732 | 78% | 0.781 | S | S | * | * | trans | 177.5 | 141.8 | 160.3 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 203 | Q | 32.5 | Very low | 36.9 | Very low | 175 Ų | 175 | 135.7 Ų | 135.7 | 82% | 0.818 | 78% | 0.781 | S | S | * | * | trans | -128.2 | 125.3 | -170.4 | -69.5 | -84.6 | 33.5 | 0 | 0 | 113.1 | ||||
| 204 | V | 35 | Very low | 37.1 | Very low | 120 Ų | 120 | 134.7 Ų | 134.7 | 73% | 0.727 | 79% | 0.785 | S | S | * | * | 34.5 | 143.6 | 109.2 | -178.1 | 0 | 0 | 0 | 0 | 118.4 | |||||
| 205 | P | 49.1 | Very low | 37.5 | Very low | 125 Ų | 125 | 135.8 Ų | 135.8 | 81% | 0.812 | 79% | 0.793 | S | S | * | * | cis | -137.9 | -172.3 | -18.5 | 40.5 | -22.4 | 0 | 0 | 0 | 115.8 | ||||
| 206 | G | 30 | Very low | 37.9 | Very low | 62 Ų | 62 | 137.4 Ų | 137.4 | 64% | 0.639 | 80% | 0.803 | S | S | * | * | trans | 162.1 | 82.5 | 149.8 | 0 | 0 | 0 | 0 | 0 | 122.6 | ||||
| 207 | Y | 35.4 | Very low | 38.5 | Very low | 233 Ų | 233 | 136.6 Ų | 136.6 | 91% | 0.914 | 80% | 0.803 | S | S | * | * | trans | 55.4 | 172.8 | 154.3 | -67.1 | -79.8 | 0 | 0 | 0 | 119.5 | ||||
| 208 | P | 45.3 | Very low | 39 | Very low | 115 Ų | 115 | 137.9 Ų | 137.9 | 75% | 0.747 | 81% | 0.805 | S | S | * | * | -123.7 | 162.5 | -77.9 | 35.4 | -18.5 | 0 | 0 | 0 | 114.5 | |||||
| 209 | A | 33.3 | Very low | 38.2 | Very low | 103 Ų | 103 | 141 Ų | 141 | 85% | 0.851 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -81.8 | 140.9 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||
| 210 | S | 37.2 | Very low | 37 | Very low | 120 Ų | 120 | 146 Ų | 146 | 84% | 0.839 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -84.2 | 150.1 | 178.1 | 49.6 | 0 | 0 | 0 | 0 | 113 | ||
| 211 | Q | 41.8 | Very low | 37.6 | Very low | 184 Ų | 184 | 144.3 Ų | 144.3 | 86% | 0.86 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -88.9 | 149.5 | 174.9 | -63.3 | 175.6 | -5 | 0 | 0 | 111.2 | ||
| 212 | N | 31.2 | Very low | 37.8 | Very low | 163 Ų | 163 | 143.8 Ų | 143.8 | 87% | 0.872 | 81% | 0.814 | S | S | * | * | trans | -146.6 | 147.5 | 145.1 | -122.6 | -105.4 | 0 | 0 | 0 | 110.4 | ||||
| 213 | P | 44.6 | Very low | 38 | Very low | 120 Ų | 120 | 144.1 Ų | 144.1 | 78% | 0.779 | 82% | 0.817 | S | S | * | * | trans | -105.7 | 170.1 | -166.1 | 40.3 | -34.4 | 0 | 0 | 0 | 113.9 | ||||
| 214 | G | 33.5 | Very low | 38.1 | Very low | 70 Ų | 70 | 143.9 Ų | 143.9 | 72% | 0.722 | 82% | 0.821 | S | S | * | * | trans | 110.4 | 89.8 | 156.8 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 215 | M | 39 | Very low | 38.2 | Very low | 190 Ų | 190 | 140.3 Ų | 140.3 | 94% | 0.936 | 81% | 0.809 | S | S | * | * | -167 | 140.2 | 101.8 | -91.8 | -55.7 | 168.2 | 0 | 0 | 109.7 | |||||
| 216 | T | 39.4 | Very low | 37.4 | Very low | 139 Ų | 139 | 141.9 Ų | 141.9 | 85% | 0.853 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -102.5 | 118.6 | -173.4 | 47.3 | 0 | 0 | 0 | 0 | 112.2 | ||
| 217 | L | 40.5 | Very low | 37.5 | Very low | 168 Ų | 168 | 150.5 Ų | 150.5 | 88% | 0.88 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -84.6 | 140.8 | 163.8 | -123.9 | 69 | 0 | 0 | 0 | 109.4 | H219 | L217-H219 PolarHBondContact O-N 2.86Š|
| 218 | P | 45.1 | Very low | 37.4 | Very low | 115 Ų | 115 | 144.1 Ų | 144.1 | 75% | 0.747 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -71.5 | 122.9 | -176.9 | 27.6 | -34 | 0 | 0 | 0 | 111.9 | ||
| 219 | H | 34.1 | Very low | 37.2 | Very low | 183 Ų | 183 | 145.2 Ų | 145.2 | 85% | 0.847 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -83.6 | 117.4 | 175.5 | -163.2 | -63.3 | 0 | 0 | 0 | 109.8 | L217 | L217-H219 PolarHBondContact O-N 2.86Š|
| 220 | Y | 33.8 | Very low | 37.9 | Very low | 206 Ų | 206 | 145.1 Ų | 145.1 | 81% | 0.808 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -66.5 | 132.1 | 171 | -84.8 | -94.8 | 0 | 0 | 0 | 110 | Y222 | Y220-Y222 PolarHBondContact O-N 3.03Š|
| 221 | P | 48.8 | Very low | 37.8 | Very low | 119 Ų | 119 | 148.2 Ų | 148.2 | 77% | 0.773 | 81% | 0.81 | S | S | * | * | trans | -86.3 | 110.1 | 175.1 | 31.9 | -31 | 0 | 0 | 0 | 110.6 | ||||
| 222 | Y | 33.2 | Very low | 37.4 | Very low | 239 Ų | 239 | 144.9 Ų | 144.9 | 94% | 0.937 | 81% | 0.807 | S | S | * | * | trans | -82.6 | 128.9 | 153.8 | -115.5 | -90.5 | 0 | 0 | 0 | 107.9 | Y220 | Y220-Y222 PolarHBondContact O-N 3.03Š| ||
| 223 | G | 34.9 | Very low | 37.4 | Very low | 78 Ų | 78 | 140.7 Ų | 140.7 | 80% | 0.804 | 80% | 0.802 | S | S | * | * | trans | -81.4 | 124.6 | -178.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 224 | D | 35.5 | Very low | 37.3 | Very low | 169 Ų | 169 | 141 Ų | 141 | 90% | 0.904 | 80% | 0.804 | S | S | * | * | trans | -114.3 | 155.6 | 155.2 | -168 | 11.8 | 0 | 0 | 0 | 108.7 | ||||
| 225 | G | 35.6 | Very low | 37.3 | Very low | 46 Ų | 46 | 144.2 Ų | 144.2 | 47% | 0.474 | 81% | 0.81 | S | S | . | * | trans | -113.4 | 168.5 | -150.8 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 226 | N | 34.1 | Very low | 37 | Very low | 158 Ų | 158 | 141.4 Ų | 141.4 | 85% | 0.845 | 80% | 0.803 | S | S | * | * | trans | 83 | 104.1 | 149.3 | -44.3 | -59.9 | 0 | 0 | 0 | 119.1 | ||||
| 227 | R | 32.1 | Very low | 36.8 | Very low | 242 Ų | 242 | 143.9 Ų | 143.9 | 91% | 0.913 | 80% | 0.797 | S | S | * | * | -169.4 | 120.9 | 120 | -105 | 170.4 | -170.2 | -127.2 | 1.1 | 114.7 | |||||
| 228 | S | 32 | Very low | 37.1 | Very low | 100 Ų | 100 | 141.5 Ų | 141.5 | 70% | 0.699 | 79% | 0.791 | S | S | * | * | trans | 56.3 | 103.6 | 137.7 | -50.6 | 0 | 0 | 0 | 0 | 123.1 | ||||
| 229 | V | 41.2 | Very low | 36.4 | Very low | 137 Ų | 137 | 141.7 Ų | 141.7 | 83% | 0.83 | 78% | 0.782 | S | S | * | * | 55.9 | 135.8 | 113.3 | 170.3 | 0 | 0 | 0 | 0 | 120.1 | |||||
| 230 | P | 48.4 | Very low | 36.3 | Very low | 102 Ų | 102 | 141.3 Ų | 141.3 | 66% | 0.662 | 78% | 0.781 | S | S | * | * | cis | -140.7 | -169.5 | -25.5 | 41.3 | -21.7 | 0 | 0 | 0 | 114.6 | ||||
| 231 | Q | 34.1 | Very low | 36.3 | Very low | 184 Ų | 184 | 137.6 Ų | 137.6 | 86% | 0.86 | 78% | 0.775 | S | S | * | * | trans | 65.5 | 156.2 | 161.1 | -77.5 | -178.3 | -22.7 | 0 | 0 | 117.8 | ||||
| 232 | S | 33.3 | Very low | 35.6 | Very low | 114 Ų | 114 | 136 Ų | 136 | 80% | 0.797 | 77% | 0.772 | S | S | * | * | cis | -161.6 | 164.6 | -14.2 | 49.9 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 233 | G | 32.8 | Very low | 35.4 | Very low | 75 Ų | 75 | 135.9 Ų | 135.9 | 77% | 0.773 | 77% | 0.77 | S | S | * | * | trans | 123.7 | 138.5 | 166.4 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 234 | P | 42.8 | Very low | 35.3 | Very low | 126 Ų | 126 | 136.7 Ų | 136.7 | 82% | 0.818 | 77% | 0.769 | S | S | * | * | trans | -116.2 | 155.8 | -175.5 | 40.3 | -31.4 | 0 | 0 | 0 | 115.6 | ||||
| 235 | T | 33.3 | Very low | 35.3 | Very low | 138 Ų | 138 | 134.4 Ų | 134.4 | 85% | 0.847 | 77% | 0.766 | S | S | * | * | trans | -137.2 | 101.4 | 159.1 | -61.2 | 0 | 0 | 0 | 0 | 112 | ||||
| 236 | V | 32.8 | Very low | 35.7 | Very low | 131 Ų | 131 | 138.2 Ų | 138.2 | 79% | 0.794 | 78% | 0.783 | S | S | * | * | trans | 34.9 | 117.9 | 135.6 | -174.3 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 237 | R | 34.8 | Very low | 35.7 | Very low | 192 Ų | 192 | 134.1 Ų | 134.1 | 73% | 0.725 | 78% | 0.778 | S | S | * | * | trans | -79.9 | 152.9 | 160.9 | -149.1 | -171.9 | -179.2 | 119.2 | -8.7 | 109.6 | Q239 | R237-Q239 HydrophobicContact CG-CB 4.19Å; R237-Q239 VanDerWaalsContact CZ-OE1 3.24Å | ||
| 238 | P | 46.4 | Very low | 35.7 | Very low | 117 Ų | 117 | 126.7 Ų | 126.7 | 76% | 0.76 | 77% | 0.769 | S | S | * | * | -140.6 | 150.6 | 91.8 | 40.4 | -26.4 | 0 | 0 | 0 | 111.7 | |||||
| 239 | Q | 31.2 | Very low | 35.8 | Very low | 120 Ų | 120 | 133.5 Ų | 133.5 | 56% | 0.561 | 78% | 0.781 | S | S | * | * | cis | 66 | 89.6 | 38.9 | -161.8 | 80.4 | 15.5 | 0 | 0 | 110.8 | R237 | R237-Q239 HydrophobicContact CG-CB 4.19Å; R237-Q239 VanDerWaalsContact CZ-OE1 3.24Å | ||
| 240 | E | 31.1 | Very low | 35.5 | Very low | 174 Ų | 174 | 130.8 Ų | 130.8 | 81% | 0.813 | 78% | 0.78 | S | S | * | * | -167.1 | 171.8 | 80 | 56.4 | -139.3 | 148.5 | 0 | 0 | 109 | |||||
| 241 | D | 33.8 | Very low | 34.8 | Very low | 129 Ų | 129 | 135.3 Ų | 135.3 | 69% | 0.69 | 79% | 0.794 | S | S | * | * | cis | -147.1 | 164.7 | 29.9 | -148.8 | -31.6 | 0 | 0 | 0 | 111.5 | W243 | D241-W243 PolarHBondContact OD1-NE1 2.98Š| ||
| 242 | A | 33.2 | Very low | 34.8 | Very low | 86 Ų | 86 | 130.2 Ų | 130.2 | 71% | 0.711 | 79% | 0.792 | S | S | * | * | trans | -140.9 | 108.6 | -173.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 243 | W | 29.9 | Very low | 34.9 | Very low | 236 Ų | 236 | 128.6 Ų | 128.6 | 89% | 0.894 | 79% | 0.793 | S | S | * | * | trans | -130.1 | 114.1 | 174.5 | -72.7 | 94.9 | 0 | 0 | 0 | 112.1 | D241 | D241-W243 PolarHBondContact OD1-NE1 2.98Š| ||
| 244 | A | 33.7 | Very low | 35 | Very low | 94 Ų | 94 | 135.2 Ų | 135.2 | 78% | 0.777 | 80% | 0.795 | S | S | * | * | trans | -96.3 | 151.7 | 170.4 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 245 | S | 34.8 | Very low | 34.8 | Very low | 122 Ų | 122 | 138.5 Ų | 138.5 | 85% | 0.853 | 79% | 0.792 | S | S | * | * | trans | -75.4 | 150.9 | -169 | -40.8 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 246 | P | 44.1 | Very low | 35.3 | Very low | 125 Ų | 125 | 137 Ų | 137 | 81% | 0.812 | 78% | 0.784 | S | S | * | * | trans | -106.8 | 128.4 | 158.9 | 35 | -27.2 | 0 | 0 | 0 | 113.3 | ||||
| 247 | G | 34.4 | Very low | 35.3 | Very low | 73 Ų | 73 | 142.3 Ų | 142.3 | 75% | 0.753 | 79% | 0.79 | S | S | * | * | trans | 55 | 101.1 | 138 | 0 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 248 | A | 31.9 | Very low | 35.8 | Very low | 86 Ų | 86 | 138.5 Ų | 138.5 | 71% | 0.711 | 79% | 0.791 | S | S | * | * | trans | 37.2 | 122.7 | 131.6 | 0 | 0 | 0 | 0 | 0 | 121.8 | ||||
| 249 | Y | 34.6 | Very low | 35.1 | Very low | 243 Ų | 243 | 138.9 Ų | 138.9 | 95% | 0.953 | 80% | 0.796 | S | S | * | * | 167.6 | 132.5 | 112.1 | -95.3 | -72.6 | 0 | 0 | 0 | 109.9 | |||||
| 250 | G | 33.3 | Very low | 35.1 | Very low | 79 Ų | 79 | 138.9 Ų | 138.9 | 81% | 0.814 | 81% | 0.809 | S | S | * | * | trans | 163.1 | 118.4 | 175.5 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 251 | M | 33.9 | Very low | 35.5 | Very low | 197 Ų | 197 | 135.3 Ų | 135.3 | 97% | 0.97 | 81% | 0.809 | S | S | * | * | trans | -59.9 | 148.4 | -178.1 | -94.4 | -75.4 | -150.4 | 0 | 0 | 116.2 | ||||
| 252 | G | 34.3 | Very low | 36.1 | Very low | 78 Ų | 78 | 135.4 Ų | 135.4 | 80% | 0.804 | 82% | 0.817 | S | S | * | * | 97.8 | 81.3 | 126.2 | 0 | 0 | 0 | 0 | 0 | 119.5 | |||||
| 253 | G | 36.3 | Very low | 35.9 | Very low | 80 Ų | 80 | 137 Ų | 137 | 83% | 0.825 | 82% | 0.823 | S | S | * | * | trans | -151.9 | 147.5 | 163.2 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 254 | R | 35 | Very low | 36.2 | Very low | 214 Ų | 214 | 129.6 Ų | 129.6 | 81% | 0.808 | 81% | 0.813 | S | S | * | * | trans | -110.2 | 125.8 | -170.7 | -69.8 | -159.4 | -165.8 | -118.9 | 12.6 | 114.2 | ||||
| 255 | Y | 38 | Very low | 37 | Very low | 195 Ų | 195 | 130.7 Ų | 130.7 | 77% | 0.765 | 81% | 0.812 | S | S | * | * | trans | 67.2 | 152.2 | 153.1 | -59.4 | -45.1 | 0 | 0 | 0 | 116 | ||||
| 256 | P | 44.3 | Very low | 37.8 | Very low | 105 Ų | 105 | 130.9 Ų | 130.9 | 68% | 0.682 | 81% | 0.81 | S | S | * | * | cis | -146.7 | 179 | 46.5 | 45.2 | -25.5 | 0 | 0 | 0 | 119.1 | ||||
| 257 | W | 32.8 | Very low | 37.2 | Very low | 243 Ų | 243 | 128.3 Ų | 128.3 | 92% | 0.92 | 81% | 0.806 | S | S | * | * | trans | 51.4 | 117.8 | 164.3 | -64.3 | 104.5 | 0 | 0 | 0 | 120.4 | ||||
| 258 | P | 44.5 | Very low | 37 | Very low | 113 Ų | 113 | 132.3 Ų | 132.3 | 73% | 0.734 | 81% | 0.81 | S | S | * | * | trans | -95.5 | 126.1 | 165.8 | 34.6 | -28.4 | 0 | 0 | 0 | 112.8 | ||||
| 259 | S | 32.2 | Very low | 37.1 | Very low | 125 Ų | 125 | 135.1 Ų | 135.1 | 87% | 0.874 | 81% | 0.812 | S | S | * | * | trans | -82.5 | 138.6 | 154.5 | -68.7 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 260 | S | 32 | Very low | 37.1 | Very low | 119 Ų | 119 | 133.1 Ų | 133.1 | 83% | 0.832 | 80% | 0.804 | S | S | * | * | trans | -154.4 | 110 | 174.9 | -74 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 261 | A | 39 | Very low | 37 | Very low | 99 Ų | 99 | 137 Ų | 137 | 82% | 0.818 | 80% | 0.803 | S | S | * | * | trans | -116.5 | 133.2 | 160.4 | 0 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 262 | P | 45.1 | Very low | 36.8 | Very low | 132 Ų | 132 | 133.4 Ų | 133.4 | 86% | 0.857 | 79% | 0.793 | S | S | * | * | trans | -82.9 | 146.4 | -172.8 | 31.8 | -34.7 | 0 | 0 | 0 | 113.5 | ||||
| 263 | S | 30.7 | Very low | 36.5 | Very low | 119 Ų | 119 | 138.3 Ų | 138.3 | 83% | 0.832 | 80% | 0.795 | S | S | * | * | trans | -93.4 | 167.5 | 159.5 | -151.2 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 264 | A | 35.5 | Very low | 36.4 | Very low | 81 Ų | 81 | 139.1 Ų | 139.1 | 67% | 0.669 | 79% | 0.788 | S | S | * | * | cis | -153.9 | -139.1 | 24 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 265 | P | 50.9 | Low | 36.3 | Very low | 117 Ų | 117 | 135.8 Ų | 135.8 | 76% | 0.76 | 79% | 0.791 | S | S | * | * | -128.3 | -146.8 | -128.4 | 43.4 | -19.7 | 0 | 0 | 0 | 111.5 | |||||
| 266 | P | 51.7 | Low | 36 | Very low | 126 Ų | 126 | 131.9 Ų | 131.9 | 82% | 0.818 | 79% | 0.793 | S | S | * | * | cis | -133.2 | 173.2 | -14.7 | 40.6 | -23.7 | 0 | 0 | 0 | 116.1 | ||||
| 267 | G | 31.3 | Very low | 36 | Very low | 70 Ų | 70 | 131.9 Ų | 131.9 | 72% | 0.722 | 79% | 0.792 | S | S | * | * | trans | 175.9 | 135.8 | 164.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 268 | N | 30.1 | Very low | 36.2 | Very low | 158 Ų | 158 | 131.4 Ų | 131.4 | 85% | 0.845 | 79% | 0.791 | S | S | * | * | trans | -132.9 | 161.7 | -175 | -78.6 | -43.7 | 0 | 0 | 0 | 112.8 | ||||
| 269 | L | 33.3 | Very low | 36.2 | Very low | 145 Ų | 145 | 132 Ų | 132 | 76% | 0.759 | 79% | 0.794 | S | S | * | * | trans | 110.2 | 144.8 | 150.2 | -56.5 | 179.3 | 0 | 0 | 0 | 119.1 | ||||
| 270 | Y | 35.8 | Very low | 36.1 | Very low | 200 Ų | 200 | 131.2 Ų | 131.2 | 78% | 0.784 | 79% | 0.789 | S | S | * | * | trans | 69.7 | 121.1 | 175.4 | -62.4 | -80.2 | 0 | 0 | 0 | 115.5 | ||||
| 271 | M | 31 | Very low | 36.2 | Very low | 160 Ų | 160 | 131.1 Ų | 131.1 | 79% | 0.788 | 79% | 0.788 | S | S | * | * | 69.7 | 130.7 | 66.5 | -66.5 | -82.4 | -175.5 | 0 | 0 | 111.4 | |||||
| 272 | T | 28.3 | Very low | 35.8 | Very low | 122 Ų | 122 | 130.2 Ų | 130.2 | 75% | 0.748 | 79% | 0.789 | S | S | * | * | cis | -152.4 | 179.2 | 16.4 | -34.2 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 273 | E | 28.7 | Very low | 35.4 | Very low | 182 Ų | 182 | 129.7 Ų | 129.7 | 85% | 0.85 | 79% | 0.788 | S | S | * | * | trans | 102.6 | 133.3 | 145 | -155.8 | 157.7 | 123.7 | 0 | 0 | 120 | ||||
| 274 | S | 33.3 | Very low | 36 | Very low | 97 Ų | 97 | 129.5 Ų | 129.5 | 68% | 0.678 | 78% | 0.784 | S | S | * | * | trans | -80.5 | 144.4 | -176.4 | -46.2 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 275 | T | 33.4 | Very low | 35.8 | Very low | 144 Ų | 144 | 135 Ų | 135 | 88% | 0.883 | 80% | 0.796 | S | S | * | * | 179.1 | 158.7 | 112.3 | 26.9 | 0 | 0 | 0 | 0 | 112.7 | |||||
| 276 | S | 32.8 | Very low | 35.1 | Very low | 113 Ų | 113 | 134.9 Ų | 134.9 | 79% | 0.79 | 80% | 0.798 | S | S | * | * | trans | -99.6 | -175.4 | 175.2 | -44.5 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 277 | P | 44.1 | Very low | 34.8 | Very low | 104 Ų | 104 | 134.1 Ų | 134.1 | 68% | 0.675 | 79% | 0.793 | S | S | * | * | -131.7 | 125.1 | -101.4 | 34.8 | -14.4 | 0 | 0 | 0 | 115.4 | |||||
| 278 | W | 36.5 | Very low | 35.3 | Very low | 234 Ų | 234 | 136.8 Ų | 136.8 | 89% | 0.886 | 80% | 0.797 | S | S | * | * | trans | 63.9 | 164.9 | 175.9 | -51.6 | 92.2 | 0 | 0 | 0 | 113.8 | ||||
| 279 | P | 45.4 | Very low | 35.7 | Very low | 125 Ų | 125 | 134.4 Ų | 134.4 | 81% | 0.812 | 79% | 0.793 | S | S | * | * | -122.8 | 164 | 60.8 | 36.4 | -24.3 | 0 | 0 | 0 | 114.3 | |||||
| 280 | S | 30.1 | Very low | 36.4 | Very low | 109 Ų | 109 | 133.2 Ų | 133.2 | 76% | 0.762 | 79% | 0.794 | S | S | * | * | trans | -98.1 | 131 | 168.3 | -180 | 0 | 0 | 0 | 0 | 111 | ||||
| 281 | S | 33 | Very low | 36.8 | Very low | 117 Ų | 117 | 129.8 Ų | 129.8 | 82% | 0.818 | 80% | 0.796 | S | S | * | * | trans | -156.7 | 146.5 | 159.7 | 68.9 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 282 | G | 30.2 | Very low | 36.9 | Very low | 80 Ų | 80 | 130.5 Ų | 130.5 | 83% | 0.825 | 80% | 0.802 | S | S | * | * | trans | 104.4 | 80.2 | 173 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 283 | S | 37.5 | Very low | 37.2 | Very low | 120 Ų | 120 | 133.8 Ų | 133.8 | 84% | 0.839 | 81% | 0.809 | S | S | * | * | trans | -75.6 | 159.4 | 139.9 | -69.2 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 284 | P | 42.8 | Very low | 37.5 | Very low | 115 Ų | 115 | 133.9 Ų | 133.9 | 75% | 0.747 | 81% | 0.81 | S | S | * | * | cis | -138.3 | 158.7 | 20.8 | 40.8 | -24.2 | 0 | 0 | 0 | 117.1 | ||||
| 285 | Q | 31.1 | Very low | 38.1 | Very low | 198 Ų | 198 | 134.5 Ų | 134.5 | 93% | 0.925 | 81% | 0.811 | S | S | * | * | trans | -169.3 | 161.3 | 137.8 | -111.5 | 165.5 | -13.5 | 0 | 0 | 113.1 | ||||
| 286 | S | 37.3 | Very low | 37.9 | Very low | 114 Ų | 114 | 135.6 Ų | 135.6 | 80% | 0.797 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -97 | 172.5 | -175.7 | -54.5 | 0 | 0 | 0 | 0 | 111.7 | ||
| 287 | P | 45.5 | Very low | 37.7 | Very low | 110 Ų | 110 | 136.5 Ų | 136.5 | 71% | 0.714 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -90.3 | 164 | -144.8 | 36.2 | -39.4 | 0 | 0 | 0 | 116.3 | ||
| 288 | P | 40.7 | Very low | 37.1 | Very low | 126 Ų | 126 | 137.4 Ų | 137.4 | 82% | 0.818 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -85.7 | 126.4 | 162 | 33.7 | -30.3 | 0 | 0 | 0 | 111.8 | ||
| 289 | S | 39.7 | Very low | 36.7 | Very low | 108 Ų | 108 | 131.7 Ų | 131.7 | 76% | 0.755 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -90 | 145.9 | 171.9 | -55 | 0 | 0 | 0 | 0 | 112 | ||
| 290 | P | 47 | Very low | 35.9 | Very low | 119 Ų | 119 | 135.1 Ų | 135.1 | 77% | 0.773 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -70.4 | 161.9 | 157.8 | 31.4 | -32.6 | 0 | 0 | 0 | 111.1 | ||
| 291 | P | 43.4 | Very low | 36.6 | Very low | 128 Ų | 128 | 135.7 Ų | 135.7 | 83% | 0.831 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -88.4 | 160.9 | -152.3 | 33.3 | -37.7 | 0 | 0 | 0 | 116.7 | ||
| 292 | L | 33.5 | Very low | 36.3 | Very low | 175 Ų | 175 | 139.2 Ų | 139.2 | 92% | 0.916 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -67.8 | 144.7 | 171.6 | -68.1 | 158.4 | 0 | 0 | 0 | 112.5 | ||
| 293 | Q | 34.5 | Very low | 36.5 | Very low | 192 Ų | 192 | 139 Ų | 139 | 90% | 0.897 | 79% | 0.786 | S | S | * | * | trans | -134.7 | 114.6 | 154.8 | -73.1 | -166.5 | 1.3 | 0 | 0 | 110.9 | ||||
| 294 | Q | 36.3 | Very low | 36.2 | Very low | 184 Ų | 184 | 141 Ų | 141 | 86% | 0.86 | 78% | 0.782 | S | S | * | * | trans | -163 | 163.9 | 164 | -90.8 | -153.3 | 0.8 | 0 | 0 | 107.5 | ||||
| 295 | P | 46 | Very low | 35.6 | Very low | 109 Ų | 109 | 140.2 Ų | 140.2 | 71% | 0.708 | 78% | 0.779 | S | S | * | * | cis | -109.7 | -160.3 | 0.4 | 27 | -4 | 0 | 0 | 0 | 110.4 | ||||
| 296 | K | 28 | Very low | 35.6 | Very low | 168 Ų | 168 | 138.7 Ų | 138.7 | 73% | 0.73 | 77% | 0.772 | S | S | * | * | cis | -175.6 | 147.7 | 38.8 | -178 | 159.9 | 171.7 | 168 | 0 | 116.3 | ||||
| 297 | D | 29.5 | Very low | 35.6 | Very low | 131 Ų | 131 | 141.3 Ų | 141.3 | 70% | 0.701 | 77% | 0.772 | S | S | * | * | trans | 74 | 142.7 | 157 | -69.1 | -6.2 | 0 | 0 | 0 | 124.7 | ||||
| 298 | S | 31.1 | Very low | 34.8 | Very low | 124 Ų | 124 | 140.2 Ų | 140.2 | 87% | 0.867 | 77% | 0.767 | S | S | * | * | trans | 66.9 | 133.6 | 170.4 | -76.7 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 299 | S | 29.1 | Very low | 34.7 | Very low | 114 Ų | 114 | 142.7 Ų | 142.7 | 80% | 0.797 | 77% | 0.77 | S | S | * | * | cis | -152.7 | 156.7 | -3.1 | -176.3 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 300 | Y | 28.4 | Very low | 34.2 | Very low | 197 Ų | 197 | 145.1 Ų | 145.1 | 77% | 0.773 | 77% | 0.774 | S | S | * | * | trans | -80.9 | 167.9 | 169.1 | -101.3 | -98.8 | 0 | 0 | 0 | 111.4 | ||||
| 301 | P | 43.9 | Very low | 33.5 | Very low | 120 Ų | 120 | 150.3 Ų | 150.3 | 78% | 0.779 | 78% | 0.778 | S | S | * | * | cis | -115.3 | 153 | 39.1 | 13.4 | 11.3 | 0 | 0 | 0 | 115.1 | ||||
| 302 | Y | 27 | Very low | 33.1 | Very low | 192 Ų | 192 | 152 Ų | 152 | 75% | 0.753 | 78% | 0.775 | S | S | * | * | 64 | 119.8 | 65.6 | -156.6 | -104.7 | 0 | 0 | 0 | 113.2 | |||||
| 303 | S | 34.1 | Very low | 33 | Very low | 75 Ų | 75 | 150.5 Ų | 150.5 | 52% | 0.524 | 77% | 0.768 | S | S | . | * | cis | -139.8 | -152.1 | 6.9 | -152 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 304 | Q | 30.5 | Very low | 33 | Very low | 161 Ų | 161 | 149.1 Ų | 149.1 | 75% | 0.752 | 76% | 0.759 | S | S | * | * | cis | -161.8 | 158.4 | 8.2 | -156.1 | 165.2 | -47.5 | 0 | 0 | 111.5 | ||||
| 305 | S | 31.3 | Very low | 33 | Very low | 99 Ų | 99 | 145.8 Ų | 145.8 | 69% | 0.692 | 75% | 0.753 | S | S | * | * | trans | 56.7 | 122.8 | 162.4 | 44 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 306 | E | 31.3 | Very low | 32.4 | Very low | 167 Ų | 167 | 147 Ų | 147 | 78% | 0.78 | 76% | 0.763 | S | S | * | * | cis | 106 | 139.1 | 41.8 | -89.8 | -77.1 | 103.9 | 0 | 0 | 111.6 | ||||
| 307 | Q | 36.2 | Very low | 32.5 | Very low | 169 Ų | 169 | 144.3 Ų | 144.3 | 79% | 0.79 | 77% | 0.765 | S | S | * | * | trans | 63.8 | 127 | 174.4 | -59.8 | 177.2 | 11 | 0 | 0 | 116.9 | ||||
| 308 | S | 29.1 | Very low | 32.8 | Very low | 87 Ų | 87 | 144.2 Ų | 144.2 | 61% | 0.608 | 77% | 0.769 | S | S | * | * | cis | 108.6 | 109.3 | 16.2 | 76.9 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 309 | M | 38.4 | Very low | 33 | Very low | 178 Ų | 178 | 147 Ų | 147 | 88% | 0.877 | 77% | 0.768 | S | S | * | * | trans | 52.9 | 112.2 | 145.2 | -48 | 176 | -150 | 0 | 0 | 119.2 | ||||
| 310 | N | 28.7 | Very low | 33.1 | Very low | 159 Ų | 159 | 149 Ų | 149 | 85% | 0.85 | 77% | 0.765 | S | S | * | * | trans | -149.4 | 170.2 | 136.9 | -134.1 | -80.6 | 0 | 0 | 0 | 114.2 | ||||
| 311 | R | 32.9 | Very low | 33.4 | Very low | 227 Ų | 227 | 150 Ų | 150 | 86% | 0.857 | 77% | 0.769 | S | S | * | * | trans | -110.5 | 131.9 | -174 | -48.2 | -177.6 | 78.6 | 179.7 | 4.3 | 108.9 | N313 | R311-N313 PolarHBondContact O-N 2.91Š| ||
| 312 | H | 35.6 | Very low | 32.8 | Very low | 164 Ų | 164 | 151.6 Ų | 151.6 | 76% | 0.759 | 77% | 0.766 | S | S | * | * | trans | -74.3 | 91.8 | 175.7 | -81.1 | -76.1 | 0 | 0 | 0 | 111.6 | F314 | H312-F314 HydrophobicContact CB-CD2 4.22Å; H312-F314 HydrophobicContact CB-CE2 3.72Å; H312-F314 HydrophobicContact CB-CZ 4.27Å; H312-F314 AromaticContact CG-CE2 3.96Å; H312-F314 AromaticContact ND1-CE2 3.75Å; H312-F314 AromaticContact ND1-CZ 3.36Å; H312-F314 WeakPolarHBondContact ND1-CZ 3.42Å | ||
| 313 | N | 31.3 | Very low | 33 | Very low | 143 Ų | 143 | 148 Ų | 148 | 77% | 0.765 | 77% | 0.769 | S | S | * | * | trans | -85.9 | 135.2 | 155.4 | -173.6 | 31.4 | 0 | 0 | 0 | 108.3 | R311 | R311-N313 PolarHBondContact O-N 2.91Š| ||
| 314 | F | 34.8 | Very low | 32.9 | Very low | 164 Ų | 164 | 150.3 Ų | 150.3 | 72% | 0.719 | 79% | 0.785 | S | S | * | * | trans | -128.9 | 109.8 | 178.9 | -76.6 | -66.7 | 0 | 0 | 0 | 110.5 | H312 | H312-F314 HydrophobicContact CB-CD2 4.22Å; H312-F314 HydrophobicContact CB-CE2 3.72Å; H312-F314 HydrophobicContact CB-CZ 4.27Å; H312-F314 AromaticContact CG-CE2 3.96Å; H312-F314 AromaticContact ND1-CE2 3.75Å; H312-F314 AromaticContact ND1-CZ 3.36Å; H312-F314 WeakPolarHBondContact ND1-CZ 3.42Å | ||
| 315 | P | 36.1 | Very low | 32.8 | Very low | 114 Ų | 114 | 146.2 Ų | 146.2 | 74% | 0.74 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -79.2 | 136 | 168.1 | 32.2 | -31.6 | 0 | 0 | 0 | 110.3 | S317 | P315-S317 PolarHBondContact O-N 2.97Š|
| 316 | C | 32.6 | Very low | 33 | Very low | 133 Ų | 133 | 147.6 Ų | 147.6 | 90% | 0.899 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -75.1 | 120.2 | 164.2 | -93.7 | 0 | 0 | 0 | 0 | 109.3 | ||
| 317 | S | 31.3 | Very low | 33.1 | Very low | 113 Ų | 113 | 145.4 Ų | 145.4 | 79% | 0.79 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -87.6 | 137 | 172.3 | -167.3 | 0 | 0 | 0 | 0 | 110.3 | P315 | P315-S317 PolarHBondContact O-N 2.97Š|
| 318 | V | 34.9 | Very low | 32.8 | Very low | 129 Ų | 129 | 144 Ų | 144 | 78% | 0.782 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -101.6 | 128.4 | 174.9 | 175.8 | 0 | 0 | 0 | 0 | 108.4 | Q320 | V318-Q320 PolarHBondContact O-N 3.4Å; V318-Q320 VanDerWaalsContact O-N 3.13Å |
| 319 | H | 35.7 | Very low | 32.9 | Very low | 182 Ų | 182 | 146.8 Ų | 146.8 | 84% | 0.843 | 79% | 0.794 | S | S | * | * | trans | -72.5 | 102.8 | 172.4 | -76.2 | -85 | 0 | 0 | 0 | 110.3 | ||||
| 320 | Q | 31.4 | Very low | 32.7 | Very low | 156 Ų | 156 | 145.1 Ų | 145.1 | 73% | 0.729 | 79% | 0.789 | S | S | * | * | trans | -72.7 | 123.3 | 165.8 | -178 | 168.8 | -12.3 | 0 | 0 | 109.2 | V318 E322 | V318-Q320 PolarHBondContact O-N 3.4Å; V318-Q320 VanDerWaalsContact O-N 3.13Å; Q320-E322 PolarHBondContact NE2-OE2 2.71Å | ||
| 321 | Y | 33.3 | Very low | 32.8 | Very low | 217 Ų | 217 | 144.1 Ų | 144.1 | 85% | 0.851 | 78% | 0.784 | S | S | * | * | trans | -89.2 | 118.1 | 171 | 51.5 | -86.1 | 0 | 0 | 0 | 108.3 | ||||
| 322 | E | 32.9 | Very low | 33 | Very low | 154 Ų | 154 | 138.3 Ų | 138.3 | 72% | 0.72 | 78% | 0.778 | S | S | * | * | trans | -149.9 | 111.2 | 172.3 | -142.4 | 168.7 | 125.7 | 0 | 0 | 111.5 | Q320 | Q320-E322 PolarHBondContact NE2-OE2 2.71Š| ||
| 323 | S | 31.5 | Very low | 33 | Very low | 118 Ų | 118 | 137.7 Ų | 137.7 | 83% | 0.825 | 78% | 0.78 | S | S | * | * | trans | -169.7 | 138.1 | 176.4 | -80.6 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 324 | S | 32 | Very low | 33.1 | Very low | 122 Ų | 122 | 138.2 Ų | 138.2 | 85% | 0.853 | 78% | 0.782 | S | S | * | * | cis | -139.9 | 148.6 | 8.8 | -59.4 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 325 | G | 28.2 | Very low | 33.4 | Very low | 75 Ų | 75 | 138.3 Ų | 138.3 | 77% | 0.773 | 79% | 0.789 | S | S | * | * | trans | -112.9 | 136.8 | 159.2 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 326 | T | 33.8 | Very low | 33.4 | Very low | 129 Ų | 129 | 139.7 Ų | 139.7 | 79% | 0.791 | 79% | 0.79 | S | S | * | * | trans | -65 | 146.2 | -171.3 | -174.3 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 327 | V | 35.1 | Very low | 33.4 | Very low | 121 Ų | 121 | 138.3 Ų | 138.3 | 73% | 0.733 | 78% | 0.781 | S | S | * | * | -163.2 | 121.8 | 127.5 | -95.8 | 0 | 0 | 0 | 0 | 112.8 | |||||
| 328 | N | 30.1 | Very low | 33.4 | Very low | 139 Ų | 139 | 141.2 Ų | 141.2 | 74% | 0.743 | 78% | 0.782 | S | S | * | * | trans | 60.2 | 154.4 | 138.5 | -56 | -20.7 | 0 | 0 | 0 | 123.3 | ||||
| 329 | N | 31 | Very low | 33.4 | Very low | 146 Ų | 146 | 140.2 Ų | 140.2 | 78% | 0.781 | 78% | 0.776 | S | S | * | * | trans | -77.9 | -179.2 | 175.9 | -33.7 | -60.3 | 0 | 0 | 0 | 111 | ||||
| 330 | D | 32.8 | Very low | 33.4 | Very low | 143 Ų | 143 | 141 Ų | 141 | 77% | 0.765 | 78% | 0.78 | S | S | * | * | cis | -163.8 | 166.3 | 31.9 | -133.6 | -51.3 | 0 | 0 | 0 | 114.1 | ||||
| 331 | D | 32.1 | Very low | 33.6 | Very low | 138 Ų | 138 | 144 Ų | 144 | 74% | 0.738 | 79% | 0.786 | S | S | * | * | trans | 68.2 | 154.8 | 154.8 | -155.9 | -114.5 | 0 | 0 | 0 | 124.3 | ||||
| 332 | S | 36.6 | Very low | 33.9 | Very low | 105 Ų | 105 | 139.1 Ų | 139.1 | 73% | 0.734 | 78% | 0.784 | S | S | * | * | trans | 86 | 111.2 | 158.3 | -81.6 | 0 | 0 | 0 | 0 | 122.2 | ||||
| 333 | D | 34.9 | Very low | 34.1 | Very low | 151 Ų | 151 | 136.3 Ų | 136.3 | 81% | 0.807 | 79% | 0.787 | S | S | * | * | trans | -63.1 | 168.4 | 177 | -90.5 | -76.1 | 0 | 0 | 0 | 119.3 | ||||
| 334 | L | 33.9 | Very low | 34.5 | Very low | 154 Ų | 154 | 139 Ų | 139 | 81% | 0.806 | 79% | 0.787 | S | S | * | * | trans | 69.4 | 138.4 | 161.3 | -66.3 | 155.5 | 0 | 0 | 0 | 116.2 | ||||
| 335 | L | 41.8 | Very low | 35.3 | Very low | 165 Ų | 165 | 139.1 Ų | 139.1 | 86% | 0.864 | 78% | 0.784 | S | S | * | * | cis | -142.2 | 180 | 40.2 | -79.2 | 167.8 | 0 | 0 | 0 | 115 | ||||
| 336 | D | 35.9 | Very low | 36 | Very low | 144 Ų | 144 | 144.8 Ų | 144.8 | 77% | 0.77 | 79% | 0.791 | S | S | * | * | trans | -67.4 | 168.8 | -165.3 | -162.6 | 49.3 | 0 | 0 | 0 | 119.3 | ||||
| 337 | C | 32.8 | Very low | 36.2 | Very low | 104 Ų | 104 | 147.1 Ų | 147.1 | 70% | 0.703 | 80% | 0.798 | S | S | * | * | trans | -23.2 | 156.4 | 170.9 | -69.3 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 338 | Q | 31.7 | Very low | 36.3 | Very low | 173 Ų | 173 | 152.7 Ų | 152.7 | 81% | 0.808 | 81% | 0.807 | S | S | * | * | -172.6 | 162.8 | 73.5 | -156.6 | -175.3 | -18.2 | 0 | 0 | 114.8 | |||||
| 339 | V | 34.4 | Very low | 36.5 | Very low | 108 Ų | 108 | 149.2 Ų | 149.2 | 66% | 0.655 | 80% | 0.804 | S | S | * | * | trans | 54.4 | 95.5 | 165.6 | -81 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 340 | Q | 36 | Very low | 36.5 | Very low | 198 Ų | 198 | 150 Ų | 150 | 93% | 0.925 | 81% | 0.808 | S | S | * | * | trans | -83.3 | 135.7 | 143.5 | -66.7 | 169.5 | -70.3 | 0 | 0 | 109.6 | ||||
| 341 | Y | 35.5 | Very low | 36.6 | Very low | 219 Ų | 219 | 148 Ų | 148 | 86% | 0.859 | 81% | 0.812 | S | S | * | * | trans | -108.8 | 102.6 | 165 | -107.8 | -89.6 | 0 | 0 | 0 | 109.3 | ||||
| 342 | S | 37.9 | Very low | 36.7 | Very low | 116 Ų | 116 | 147.9 Ų | 147.9 | 81% | 0.811 | 82% | 0.816 | S | S | * | * | trans | -116 | 134.1 | 163.9 | -172.8 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 343 | A | 38.8 | Very low | 36.6 | Very low | 95 Ų | 95 | 147.1 Ų | 147.1 | 79% | 0.785 | 81% | 0.811 | S | S | * | * | trans | -136.5 | 101 | -175 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 344 | E | 39.8 | Very low | 36.6 | Very low | 175 Ų | 175 | 147.3 Ų | 147.3 | 82% | 0.818 | 81% | 0.812 | S | S | * | * | trans | -106.1 | 131.7 | 172.8 | -164.2 | 175.3 | 149.3 | 0 | 0 | 109 | Q346 | E344-Q346 PolarHBondContact O-N 2.69Š| ||
| 345 | P | 47.9 | Very low | 36.6 | Very low | 123 Ų | 123 | 147.9 Ų | 147.9 | 80% | 0.799 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -75.1 | 121.8 | -171.5 | 28.9 | -34.3 | 0 | 0 | 0 | 112.1 | ||
| 346 | Q | 42.9 | Very low | 36.7 | Very low | 195 Ų | 195 | 145.4 Ų | 145.4 | 91% | 0.911 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -75.1 | 151.9 | -177.1 | -68.3 | -172.1 | -7.4 | 0 | 0 | 114 | E344 | E344-Q346 PolarHBondContact O-N 2.69Š|
| 347 | L | 38.5 | Very low | 36.3 | Very low | 178 Ų | 178 | 144.2 Ų | 144.2 | 93% | 0.932 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -69.3 | 154.2 | -178.1 | -84.5 | 156.6 | 0 | 0 | 0 | 114.2 | ||
| 348 | Y | 36.2 | Very low | 36.3 | Very low | 237 Ų | 237 | 145.8 Ų | 145.8 | 93% | 0.929 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -94.9 | 131.8 | 167.7 | -163.5 | -86.8 | 0 | 0 | 0 | 109.7 | ||
| 349 | G | 34.3 | Very low | 36.6 | Very low | 67 Ų | 67 | 146.5 Ų | 146.5 | 69% | 0.691 | 80% | 0.802 | S | S | * | * | trans | 129.7 | 93.7 | 170.4 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 350 | N | 32.4 | Very low | 36.5 | Very low | 162 Ų | 162 | 147.7 Ų | 147.7 | 87% | 0.866 | 81% | 0.805 | S | S | * | * | trans | -134.9 | 113.8 | 174.1 | 48.9 | -12.6 | 0 | 0 | 0 | 111.3 | ||||
| 351 | A | 33.3 | Very low | 36.5 | Very low | 101 Ų | 101 | 147 Ų | 147 | 84% | 0.835 | 80% | 0.802 | S | S | * | * | trans | -144 | 134.4 | 169.9 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 352 | T | 35.8 | Very low | 36.2 | Very low | 136 Ų | 136 | 141.5 Ų | 141.5 | 83% | 0.834 | 80% | 0.795 | S | S | * | * | trans | -41.7 | 157.7 | 167.9 | 36 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 353 | S | 34.8 | Very low | 36.1 | Very low | 89 Ų | 89 | 141.9 Ų | 141.9 | 62% | 0.622 | 80% | 0.798 | S | S | * | * | cis | -166.6 | 177.3 | -2.2 | 51.3 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 354 | D | 32.9 | Very low | 35.7 | Very low | 155 Ų | 155 | 142.7 Ų | 142.7 | 83% | 0.829 | 80% | 0.798 | S | S | * | * | trans | 69.5 | 134.5 | 155.5 | -61.3 | -60.6 | 0 | 0 | 0 | 119.7 | ||||
| 355 | H | 34.8 | Very low | 35.5 | Very low | 165 Ų | 165 | 141.7 Ų | 141.7 | 76% | 0.764 | 80% | 0.797 | S | S | * | * | trans | -124.4 | 141.7 | 175.9 | 179.9 | 44.2 | 0 | 0 | 0 | 108.3 | N357 | H355-N357 PolarHBondContact CE1-N 3.33Š| ||
| 356 | P | 43.4 | Very low | 35.3 | Very low | 113 Ų | 113 | 141.9 Ų | 141.9 | 73% | 0.734 | 80% | 0.799 | S | S | * | * | trans | -142.1 | 133.1 | 131.9 | 33.6 | -18.9 | 0 | 0 | 0 | 115.3 | ||||
| 357 | N | 28.7 | Very low | 34.9 | Very low | 119 Ų | 119 | 141.4 Ų | 141.4 | 64% | 0.636 | 80% | 0.797 | S | S | * | * | 72.1 | 102.8 | 129.2 | -164.4 | 49.8 | 0 | 0 | 0 | 120.4 | H355 | H355-N357 PolarHBondContact CE1-N 3.33Š| |||
| 358 | N | 32.4 | Very low | 35 | Very low | 137 Ų | 137 | 140.9 Ų | 140.9 | 73% | 0.733 | 79% | 0.789 | S | S | * | * | trans | 40.4 | 112.8 | 142.4 | -69.5 | -72.5 | 0 | 0 | 0 | 120.8 | ||||
| 359 | Q | 37 | Very low | 35.2 | Very low | 189 Ų | 189 | 140.9 Ų | 140.9 | 88% | 0.883 | 79% | 0.788 | S | S | * | * | -158.2 | 164.9 | 120 | -118.2 | 173.8 | -1.1 | 0 | 0 | 112.9 | |||||
| 360 | D | 32.3 | Very low | 35.6 | Very low | 133 Ų | 133 | 142.9 Ų | 142.9 | 71% | 0.711 | 79% | 0.786 | S | S | * | * | trans | -66.6 | 138.2 | -166.1 | -50.3 | -112 | 0 | 0 | 0 | 115.6 | ||||
| 361 | Q | 36.2 | Very low | 36.4 | Very low | 182 Ų | 182 | 140.7 Ų | 140.7 | 85% | 0.85 | 78% | 0.781 | S | S | * | * | -176.2 | 157.9 | 116.6 | -103.6 | 155.4 | 104.9 | 0 | 0 | 116.2 | |||||
| 362 | S | 30.6 | Very low | 36.7 | Very low | 104 Ų | 104 | 140.5 Ų | 140.5 | 73% | 0.727 | 77% | 0.773 | S | S | * | * | trans | 48 | 102.7 | 154.7 | 60.7 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 363 | S | 34.4 | Very low | 37.2 | Very low | 124 Ų | 124 | 141.3 Ų | 141.3 | 87% | 0.867 | 77% | 0.772 | S | S | * | * | trans | -56 | 131.3 | 149.9 | 52.1 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 364 | S | 31.8 | Very low | 38.1 | Very low | 113 Ų | 113 | 145.4 Ų | 145.4 | 79% | 0.79 | 78% | 0.782 | S | S | * | * | trans | -128.3 | 123.8 | 156.4 | 49.5 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 365 | L | 35.9 | Very low | 39.6 | Very low | 153 Ų | 153 | 143.2 Ų | 143.2 | 80% | 0.801 | 78% | 0.779 | S | S | * | * | trans | -68.9 | 160.1 | 166.9 | -107.3 | 81.1 | 0 | 0 | 0 | 109.4 | E367 | L365-E367 PolarHBondContact O-N 3.12Š| ||
| 366 | P | 42.1 | Very low | 41.7 | Very low | 127 Ų | 127 | 138.2 Ų | 138.2 | 83% | 0.825 | 76% | 0.76 | S | S | * | * | trans | -61.4 | 106.4 | 160.5 | -14 | 29.2 | 0 | 0 | 0 | 108.2 | E368 | P366-E368 PolarHBondContact O-N 3.45Š| ||
| 367 | E | 35.3 | Very low | 43.6 | Very low | 186 Ų | 186 | 135.4 Ų | 135.4 | 87% | 0.869 | 74% | 0.742 | S | S | * | * | trans | -66.5 | 121.6 | -179 | -165.5 | 163 | 105 | 0 | 0 | 109.6 | L365 R369 | L365-E367 PolarHBondContact O-N 3.12Å; E367-R369 PolarHBondContact O-N 2.87Å | ||
| 368 | E | 41 | Very low | 46.5 | Very low | 166 Ų | 166 | 134.8 Ų | 134.8 | 78% | 0.776 | 74% | 0.744 | S | S | * | * | trans | -55.5 | 118.8 | 177.4 | -177.3 | 174.3 | 97.9 | 0 | 0 | 109 | P366 V370 | P366-E368 PolarHBondContact O-N 3.45Å; E368-V370 PolarHBondContact O-N 2.97Å | ||
| 369 | R | 40.8 | Very low | 49.4 | Very low | 238 Ų | 238 | 129.1 Ų | 129.1 | 90% | 0.898 | 72% | 0.715 | S | S | * | * | trans | -73.2 | 76.6 | 176.4 | -72.1 | -159 | -165.9 | 92.8 | -1 | 110.5 | E367 P371 | E367-R369 PolarHBondContact O-N 2.87Å; R369-P371 VanDerWaalsContact O-CD 3.26Å; R369-P371 WeakPolarHBondContact O-CD 3.44Å | ||
| 370 | V | 41.8 | Very low | 52.1 | Low | 109 Ų | 109 | 121.5 Ų | 121.5 | 66% | 0.661 | 68% | 0.68 | S | S | * | * | trans | -58.5 | 114.1 | 160.2 | -158.9 | 0 | 0 | 0 | 0 | 106.7 | E368 S372 | E368-V370 PolarHBondContact O-N 2.97Å; V370-S372 PolarHBondContact O-N 3.41Å; V370-S372 VanDerWaalsContact O-N 3.11Å | ||
| 371 | P | 50.1 | Low | 55.1 | Low | 115 Ų | 115 | 120.8 Ų | 120.8 | 75% | 0.747 | 67% | 0.671 | S | S | * | * | trans | -70.1 | 114.4 | -176.2 | 27.1 | -32.4 | 0 | 0 | 0 | 109 | R369 N373 | R369-P371 VanDerWaalsContact O-CD 3.26Å; R369-P371 WeakPolarHBondContact O-CD 3.44Å; P371-N373 PolarHBondContact O-N 2.88Å | ||
| 372 | S | 39.2 | Very low | 57.9 | Low | 97 Ų | 97 | 117.5 Ų | 117.5 | 68% | 0.678 | 65% | 0.654 | S | S | * | * | trans | -48.9 | 126.7 | -173.6 | -175.3 | 0 | 0 | 0 | 0 | 112.2 | V370 E374 | V370-S372 PolarHBondContact O-N 3.41Å; V370-S372 VanDerWaalsContact O-N 3.11Å; S372-E374 PolarHBondContact O-N 3.42Å | ||
| 373 | N | 46.4 | Very low | 61 | Low | 153 Ų | 153 | 112.7 Ų | 112.7 | 82% | 0.818 | 62% | 0.62 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.2 | 37.9 | -163.7 | 53 | -76.5 | 0 | 0 | 0 | 114.5 | P371 | P371-N373 PolarHBondContact O-N 2.88Š|
| 374 | E | 53.3 | Low | 63.9 | Low | 176 Ų | 176 | 110.6 Ų | 110.6 | 82% | 0.822 | 60% | 0.598 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -133 | 16.6 | -178.8 | -145.6 | -169.8 | 127.1 | 0 | 0 | 114.3 | S372 | S372-E374 PolarHBondContact O-N 3.42Š|
| 375 | S | 64.8 | Low | 67 | Low | 109 Ų | 109 | 109.5 Ų | 109.5 | 76% | 0.762 | 58% | 0.58 | S | S | * | * | trans | -134.3 | 11.1 | -178.3 | -131.3 | 0 | 0 | 0 | 0 | 117.3 | P377 | S375-P377 WeakPolarHBondContact O-CD 3.08Š| ||
| 376 | T | 78 | Confident | 69.9 | Low | 60 Ų | 60 | 102.3 Ų | 102.3 | 37% | 0.368 | 54% | 0.542 | S | S | . | . | trans | -67.3 | 118.2 | 172.6 | -35.2 | 0 | 0 | 0 | 0 | 110.1 | I380 K381 I384 | T376-I380 HydrophobicContact CG2-CB 3.93Å; T376-I380 HydrophobicContact CG2-CG2 3.5Å; T376-I380 VanDerWaalsContact CG2-CG2 3.5Å; T376-K381 HydrophobicContact CG2-CG 3.94Å; T376-K381 VanDerWaalsContact O-CE 3.25Å; T376-K381 WeakPolarHBondContact O-CE 3.35Å; T376-I384 HydrophobicContact CG2-CD1 4.4Å | ||
| 377 | P | 84.1 | Confident | 72.5 | Confident | 54 Ų | 54 | 99 Ų | 99 | 35% | 0.351 | 52% | 0.518 | S | S | . | . | trans | -67 | 152.2 | -177.1 | 27.5 | -34.6 | 0 | 0 | 0 | 111.1 | S375 S379 I380 K381 | S375-P377 WeakPolarHBondContact O-CD 3.08Å; P377-S379 PolarHBondContact O-N 3.1Å; P377-S379 VanDerWaalsContact O-N 3.12Å; P377-I380 HydrophobicContact CG-CB 4.02Å; P377-I380 HydrophobicContact CG-CG1 3.67Å; P377-I380 PolarHBondContact O-N 3.48Å; P377-K381 PolarHBondContact O-N 2.93Å | ||
| 378 | P | 90.1 | Very high | 75.4 | Confident | 105 Ų | 105 | 94.8 Ų | 94.8 | 68% | 0.682 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -62.2 | -26.1 | -172 | 24.5 | -34.6 | 0 | 0 | 0 | 113.4 | K382 | P378-K382 WeakPolarHBondContact O-CG 3.31Å; P378-K382 PolarHBondContact O-N 2.66Å; P378-K382 VanDerWaalsContact O-N 3.07Å |
| 379 | S | 92.1 | Very high | 78.1 | Confident | 19 Ų | 19 | 89 Ų | 89 | 13% | 0.133 | 47% | 0.47 | C | S | . | . | H | α-helix | trans | -67.9 | -45.5 | 172.7 | 48.3 | 0 | 0 | 0 | 0 | 112.9 | P377 K381 K382 I383 E427 V434 | P377-S379 PolarHBondContact O-N 3.1Å; P377-S379 VanDerWaalsContact O-N 3.12Å; S379-K381 VanDerWaalsContact C-N 3.34Å; S379-K381 PolarHBondContact O-N 3.34Å; S379-K382 WeakPolarHBondContact O-CB 3.16Å; S379-K382 PolarHBondContact O-N 3.08Å; S379-I383 WeakPolarHBondContact O-CG1 3.47Å; S379-I383 PolarHBondContact O-N 3.26Å; S379-E427 VanDerWaalsContact CB-O 3.28Å; S379-E427 WeakPolarHBondContact CB-O 3.44Å; S379-V434 WeakPolarHBondContact OG-CG2 3.36Å |
| 380 | I | 94.5 | Very high | 80.8 | Confident | 29 Ų | 29 | 77.8 Ų | 77.8 | 15% | 0.149 | 43% | 0.428 | C | S | . | . | H | α-helix | trans | -62.5 | -41.3 | 172 | -66.9 | -67.7 | 0 | 0 | 0 | 110.6 | T376 P377 K382 I383 I384 V434 A437 | T376-I380 HydrophobicContact CG2-CB 3.93Å; T376-I380 HydrophobicContact CG2-CG2 3.5Å; T376-I380 VanDerWaalsContact CG2-CG2 3.5Å; P377-I380 HydrophobicContact CG-CB 4.02Å; P377-I380 HydrophobicContact CG-CG1 3.67Å; P377-I380 PolarHBondContact O-N 3.48Å; I380-K382 VanDerWaalsContact C-N 3.29Å; I380-K382 PolarHBondContact O-N 2.86Å; I380-I383 HydrophobicContact CD1-CD1 4.35Å; I380-I383 PolarHBondContact O-N 2.94Å; I380-I383 VanDerWaalsContact O-N 3.09Å; I380-I384 HydrophobicContact CG2-CD1 3.66Å; I380-I384 HydrophobicContact CG2-CG1 4.14Å; I380-I384 WeakPolarHBondContact O-CG1 3.33Å; I380-I384 PolarHBondContact O-N 3.41Å; I380-V434 HydrophobicContact CD1-CB 4.37Å; I380-V434 HydrophobicContact CD1-CG2 4.08Å; I380-V434 HydrophobicContact CG1-CG2 4.03Å; I380-A437 HydrophobicContact CD1-CB 3.91Å |
| 381 | K | 94 | Very high | 83.4 | Confident | 118 Ų | 118 | 76.8 Ų | 76.8 | 51% | 0.513 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -58.3 | -39.8 | 176.1 | -66.8 | -172.5 | 175.9 | -179.2 | 0 | 112.2 | T376 P377 S379 H385 | T376-K381 HydrophobicContact CG2-CG 3.94Å; T376-K381 VanDerWaalsContact O-CE 3.25Å; T376-K381 WeakPolarHBondContact O-CE 3.35Å; P377-K381 PolarHBondContact O-N 2.93Å; S379-K381 VanDerWaalsContact C-N 3.34Å; S379-K381 PolarHBondContact O-N 3.34Å; K381-H385 PolarHBondContact O-N 3.37Å; K381-H385 VanDerWaalsContact O-N 3.12Å |
| 382 | K | 95.5 | Very high | 85.6 | Confident | 113 Ų | 113 | 75.5 Ų | 75.5 | 49% | 0.491 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -64 | -45.4 | 171.4 | -74.2 | -176.2 | 174.7 | -167.9 | 0 | 112.7 | P378 S379 I380 I384 H385 V386 V426 | P378-K382 WeakPolarHBondContact O-CG 3.31Å; P378-K382 PolarHBondContact O-N 2.66Å; P378-K382 VanDerWaalsContact O-N 3.07Å; S379-K382 WeakPolarHBondContact O-CB 3.16Å; S379-K382 PolarHBondContact O-N 3.08Å; I380-K382 VanDerWaalsContact C-N 3.29Å; I380-K382 PolarHBondContact O-N 2.86Å; K382-I384 PolarHBondContact O-N 3.27Å; K382-H385 PolarHBondContact O-N 2.87Å; K382-V386 PolarHBondContact O-N 3.5Å; K382-V426 HydrophobicContact CB-CG2 3.88Å; K382-V426 HydrophobicContact CD-CG2 4.08Å |
| 383 | I | 96.4 | Very high | 88.4 | Confident | 3 Ų | 3 | 71 Ų | 71 | 2% | 0.015 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -62.5 | -42.6 | -179.7 | -65.7 | 160.3 | 0 | 0 | 0 | 110.9 | S379 I380 V386 L387 L423 V426 V434 A437 R438 A441 | S379-I383 WeakPolarHBondContact O-CG1 3.47Å; S379-I383 PolarHBondContact O-N 3.26Å; I380-I383 HydrophobicContact CD1-CD1 4.35Å; I380-I383 PolarHBondContact O-N 2.94Å; I380-I383 VanDerWaalsContact O-N 3.09Å; I383-V386 PolarHBondContact O-N 3.36Å; I383-L387 HydrophobicContact CG2-CD1 4.05Å; I383-L387 WeakPolarHBondContact O-CB 3.43Å; I383-L387 WeakPolarHBondContact O-CG 3.35Å; I383-L387 PolarHBondContact O-N 2.9Å; I383-L423 HydrophobicContact CB-CD1 4.34Å; I383-L423 HydrophobicContact CG1-CD1 3.82Å; I383-L423 HydrophobicContact CG2-CD1 4.2Å; I383-V426 HydrophobicContact CD1-CG1 4.04Å; I383-V426 HydrophobicContact CG1-CB 4.47Å; I383-V426 HydrophobicContact CG1-CG1 4.06Å; I383-V426 HydrophobicContact CG1-CG2 4.3Å; I383-V434 HydrophobicContact CD1-CG1 3.69Å; I383-A437 HydrophobicContact CD1-CB 4.3Å; I383-A437 HydrophobicContact CG2-CB 4.08Å; I383-R438 HydrophobicContact CD1-CB 3.95Å; I383-A441 HydrophobicContact CG2-CB 4.19Å |
| 384 | I | 95.9 | Very high | 90.8 | Very high | 79 Ų | 79 | 66.1 Ų | 66.1 | 41% | 0.405 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -58.2 | -48.6 | 173.3 | -67.9 | 167.2 | 0 | 0 | 0 | 110.2 | T376 I380 K382 V386 L387 E388 | T376-I384 HydrophobicContact CG2-CD1 4.4Å; I380-I384 HydrophobicContact CG2-CD1 3.66Å; I380-I384 HydrophobicContact CG2-CG1 4.14Å; I380-I384 WeakPolarHBondContact O-CG1 3.33Å; I380-I384 PolarHBondContact O-N 3.41Å; K382-I384 PolarHBondContact O-N 3.27Å; I384-V386 VanDerWaalsContact C-N 3.33Å; I384-V386 PolarHBondContact O-N 3.04Å; I384-L387 CarbonylContact O-C 3.58Å; I384-L387 WeakPolarHBondContact O-CA 3.4Å; I384-L387 WeakPolarHBondContact O-CB 3.23Å; I384-L387 PolarHBondContact O-N 3.29Å; I384-E388 WeakPolarHBondContact O-CG 3.31Å; I384-E388 PolarHBondContact O-N 3Å |
| 385 | H | 96.1 | Very high | 92.9 | Very high | 91 Ų | 91 | 64.2 Ų | 64.2 | 42% | 0.421 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -65.8 | -32.8 | -179.2 | -171.2 | 51.4 | 0 | 0 | 0 | 113.8 | K381 K382 E388 K389 | K381-H385 PolarHBondContact O-N 3.37Å; K381-H385 VanDerWaalsContact O-N 3.12Å; K382-H385 PolarHBondContact O-N 2.87Å; H385-E388 WeakPolarHBondContact CA-OE2 3.49Å; H385-E388 IonicContact CE1-OE2 3.8Å; H385-E388 IonicContact CG-OE2 3.75Å; H385-E388 IonicContact ND1-OE2 2.82Å; H385-E388 PolarHBondContact ND1-OE2 2.95Å; H385-K389 WeakPolarHBondContact NE2-CE 3.14Å; H385-K389 WeakPolarHBondContact O-CG 3.37Å; H385-K389 PolarHBondContact O-N 3.49Å |
| 386 | V | 96.6 | Very high | 94.4 | Very high | 1 Ų | 1 | 60.6 Ų | 60.6 | 1% | 0.006 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -67.4 | -43.5 | 169.4 | 174.1 | 0 | 0 | 0 | 0 | 110.7 | K382 I383 I384 E388 K389 V390 E419 E422 L423 I445 | K382-V386 PolarHBondContact O-N 3.5Å; I383-V386 PolarHBondContact O-N 3.36Å; I384-V386 VanDerWaalsContact C-N 3.33Å; I384-V386 PolarHBondContact O-N 3.04Å; V386-E388 VanDerWaalsContact C-N 3.29Å; V386-E388 PolarHBondContact O-N 3.26Å; V386-K389 PolarHBondContact O-N 2.94Å; V386-V390 HydrophobicContact CG1-CG2 3.96Å; V386-V390 WeakPolarHBondContact O-CB 3.43Å; V386-V390 WeakPolarHBondContact O-CG2 3.14Å; V386-V390 PolarHBondContact O-N 3.13Å; V386-E419 HydrophobicContact CG1-CB 4.13Å; V386-E419 HydrophobicContact CG1-CG 4.24Å; V386-E422 HydrophobicContact CG2-CB 4.34Å; V386-E422 HydrophobicContact CG2-CG 4.17Å; V386-L423 HydrophobicContact CG1-CB 4.25Å; V386-I445 HydrophobicContact CG1-CD1 4.39Å |
| 387 | L | 96.3 | Very high | 95.3 | Very high | 59 Ų | 59 | 57.7 Ų | 57.7 | 31% | 0.309 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -60.7 | -35.4 | 176.9 | -78.1 | 169.2 | 0 | 0 | 0 | 112.8 | I383 I384 V390 Q391 A441 K444 | I383-L387 HydrophobicContact CG2-CD1 4.05Å; I383-L387 WeakPolarHBondContact O-CB 3.43Å; I383-L387 WeakPolarHBondContact O-CG 3.35Å; I383-L387 PolarHBondContact O-N 2.9Å; I384-L387 CarbonylContact O-C 3.58Å; I384-L387 WeakPolarHBondContact O-CA 3.4Å; I384-L387 WeakPolarHBondContact O-CB 3.23Å; I384-L387 PolarHBondContact O-N 3.29Å; L387-V390 PolarHBondContact O-N 2.99Å; L387-Q391 WeakPolarHBondContact O-CB 3.22Å; L387-Q391 PolarHBondContact O-N 3.04Å; L387-A441 HydrophobicContact CD1-CB 4.26Å; L387-A441 HydrophobicContact CD2-CB 3.65Å; L387-A441 HydrophobicContact CG-CB 3.87Å; L387-K444 HydrophobicContact CD2-CD 4.37Å |
| 388 | E | 97.3 | Very high | 95.9 | Very high | 96 Ų | 96 | 60.3 Ų | 60.3 | 45% | 0.449 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -58.5 | -54.2 | 170.9 | -70.2 | 165.6 | 173.8 | 0 | 0 | 111.1 | I384 H385 V386 V390 Q391 Y392 | I384-E388 WeakPolarHBondContact O-CG 3.31Å; I384-E388 PolarHBondContact O-N 3Å; H385-E388 WeakPolarHBondContact CA-OE2 3.49Å; H385-E388 IonicContact CE1-OE2 3.8Å; H385-E388 IonicContact CG-OE2 3.75Å; H385-E388 IonicContact ND1-OE2 2.82Å; H385-E388 PolarHBondContact ND1-OE2 2.95Å; V386-E388 VanDerWaalsContact C-N 3.29Å; V386-E388 PolarHBondContact O-N 3.26Å; E388-V390 VanDerWaalsContact C-N 3.32Å; E388-V390 PolarHBondContact O-N 2.99Å; E388-Q391 WeakPolarHBondContact O-CB 3.34Å; E388-Q391 PolarHBondContact O-N 2.72Å; E388-Q391 VanDerWaalsContact O-N 3.12Å; E388-Y392 WeakPolarHBondContact O-CD2 3.32Å; E388-Y392 PolarHBondContact O-N 3.41Å |
| 389 | K | 96.8 | Very high | 96.2 | Very high | 46 Ų | 46 | 61 Ų | 61 | 20% | 0.2 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -57.1 | -45.7 | 176.9 | -62.4 | 171.2 | -174.9 | 175.4 | 0 | 111.9 | H385 V386 Q391 Y392 L393 E419 E422 | H385-K389 WeakPolarHBondContact NE2-CE 3.14Å; H385-K389 WeakPolarHBondContact O-CG 3.37Å; H385-K389 PolarHBondContact O-N 3.49Å; V386-K389 PolarHBondContact O-N 2.94Å; K389-Q391 PolarHBondContact O-N 3.16Å; K389-Y392 PolarHBondContact O-N 2.74Å; K389-L393 PolarHBondContact O-N 3.21Å; K389-E419 HydrophobicContact CB-CG 3.93Å; K389-E419 HydrophobicContact CD-CG 3.78Å; K389-E419 VanDerWaalsContact CD-OE1 3.29Å; K389-E419 WeakPolarHBondContact CD-OE1 3.36Å; K389-E419 IonicContact NZ-OE1 2.72Å; K389-E419 PolarHBondContact NZ-OE1 3.38Å; K389-E422 IonicContact NZ-OE1 3.08Å; K389-E422 PolarHBondContact NZ-OE1 3.24Å; K389-E422 IonicContact NZ-OE2 3.35Å; K389-E422 PolarHBondContact NZ-OE2 3.38Å |
| 390 | V | 97.4 | Very high | 96.4 | Very high | 1 Ų | 1 | 60.5 Ų | 60.5 | 1% | 0.006 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -64.3 | -30.1 | 179.7 | 171.5 | 0 | 0 | 0 | 0 | 111.4 | V386 L387 E388 L393 E394 E419 K444 I445 I448 | V386-V390 HydrophobicContact CG1-CG2 3.96Å; V386-V390 WeakPolarHBondContact O-CB 3.43Å; V386-V390 WeakPolarHBondContact O-CG2 3.14Å; V386-V390 PolarHBondContact O-N 3.13Å; L387-V390 PolarHBondContact O-N 2.99Å; E388-V390 VanDerWaalsContact C-N 3.32Å; E388-V390 PolarHBondContact O-N 2.99Å; V390-L393 PolarHBondContact O-N 3.31Å; V390-E394 WeakPolarHBondContact O-CB 3.42Å; V390-E394 PolarHBondContact O-N 2.83Å; V390-E419 HydrophobicContact CG2-CB 4.07Å; V390-E419 HydrophobicContact CG2-CG 4.23Å; V390-K444 HydrophobicContact CG1-CD 4.27Å; V390-K444 HydrophobicContact CG1-CG 4.07Å; V390-I445 HydrophobicContact CB-CG1 4.41Å; V390-I445 HydrophobicContact CG1-CG1 3.88Å; V390-I445 HydrophobicContact CG2-CD1 3.91Å; V390-I445 HydrophobicContact CG2-CG1 3.56Å; V390-I448 HydrophobicContact CG1-CD1 3.4Å; V390-I448 VanDerWaalsContact CG1-CD1 3.4Å |
| 391 | Q | 97.7 | Very high | 96.3 | Very high | 88 Ų | 88 | 65.7 Ų | 65.7 | 41% | 0.411 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -68.8 | -36.6 | 174.4 | -170.4 | 56.1 | 75.1 | 0 | 0 | 112.7 | L387 E388 K389 E394 Q395 | L387-Q391 WeakPolarHBondContact O-CB 3.22Å; L387-Q391 PolarHBondContact O-N 3.04Å; E388-Q391 WeakPolarHBondContact O-CB 3.34Å; E388-Q391 PolarHBondContact O-N 2.72Å; E388-Q391 VanDerWaalsContact O-N 3.12Å; K389-Q391 PolarHBondContact O-N 3.16Å; Q391-E394 PolarHBondContact NE2-OE2 2.84Å; Q391-E394 PolarHBondContact OE1-OE2 3.46Å; Q391-Q395 PolarHBondContact O-N 2.9Å |
| 392 | Y | 96.2 | Very high | 96.3 | Very high | 88 Ų | 88 | 61 Ų | 61 | 35% | 0.345 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -69.8 | -43.3 | 172 | -63.2 | -69.3 | 0 | 0 | 0 | 111.5 | P46 P47 E388 K389 E394 Q395 E396 | P46-Y392 HydrophobicContact CB-CE1 4.15Å; P47-Y392 HydrophobicContact CG-CD2 4.32Å; E388-Y392 WeakPolarHBondContact O-CD2 3.32Å; E388-Y392 PolarHBondContact O-N 3.41Å; K389-Y392 PolarHBondContact O-N 2.74Å; Y392-E394 VanDerWaalsContact C-N 3.32Å; Y392-E394 PolarHBondContact O-N 3Å; Y392-Q395 WeakPolarHBondContact O-CB 3.3Å; Y392-Q395 PolarHBondContact O-N 3.12Å; Y392-Q395 VanDerWaalsContact O-N 3.12Å; Y392-E396 PolarHBondContact O-N 3.46Å |
| 393 | L | 96.3 | Very high | 96.2 | Very high | 4 Ų | 4 | 61.3 Ų | 61.3 | 2% | 0.021 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -62.8 | -36.3 | 176.2 | -69.4 | 168.2 | 0 | 0 | 0 | 112.4 | K389 V390 Q395 E396 V397 L412 M415 L416 E419 | K389-L393 PolarHBondContact O-N 3.21Å; V390-L393 PolarHBondContact O-N 3.31Å; L393-Q395 VanDerWaalsContact C-N 3.31Å; L393-Q395 PolarHBondContact O-N 3.36Å; L393-E396 PolarHBondContact O-N 3.3Å; L393-V397 WeakPolarHBondContact O-CB 3.43Å; L393-V397 VanDerWaalsContact O-CG2 3.28Å; L393-V397 WeakPolarHBondContact O-CG2 3.35Å; L393-V397 PolarHBondContact O-N 3.43Å; L393-L412 HydrophobicContact CD2-CD2 4.01Å; L393-M415 HydrophobicContact CD1-CB 3.96Å; L393-M415 HydrophobicContact CD2-CB 3.78Å; L393-M415 HydrophobicContact CD2-CE 4.04Å; L393-M415 HydrophobicContact CD2-SD 4.13Å; L393-L416 HydrophobicContact CB-CD2 3.84Å; L393-L416 HydrophobicContact CB-CG 4.33Å; L393-L416 HydrophobicContact CD1-CD2 3.95Å; L393-L416 HydrophobicContact CD1-CG 4.17Å; L393-E419 HydrophobicContact CD1-CG 4.41Å |
| 394 | E | 97.5 | Very high | 96.2 | Very high | 49 Ų | 49 | 64.8 Ų | 64.8 | 23% | 0.229 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -60.4 | -39.7 | 172.5 | -176.2 | 169.8 | -117.5 | 0 | 0 | 112.3 | V390 Q391 Y392 E398 K444 I448 | V390-E394 WeakPolarHBondContact O-CB 3.42Å; V390-E394 PolarHBondContact O-N 2.83Å; Q391-E394 PolarHBondContact NE2-OE2 2.84Å; Q391-E394 PolarHBondContact OE1-OE2 3.46Å; Y392-E394 VanDerWaalsContact C-N 3.32Å; Y392-E394 PolarHBondContact O-N 3Å; E394-E398 PolarHBondContact O-N 3.22Å; E394-K444 WeakPolarHBondContact OE1-CE 3.46Å; E394-K444 IonicContact OE1-NZ 3.96Å; E394-K444 WeakPolarHBondContact OE2-CE 3.39Å; E394-K444 IonicContact OE2-NZ 3.22Å; E394-K444 PolarHBondContact OE2-NZ 3.43Å; E394-I448 HydrophobicContact CB-CD1 3.72Å; E394-I448 HydrophobicContact CB-CG1 4.07Å; E394-I448 HydrophobicContact CG-CD1 4.11Å; E394-I448 HydrophobicContact CG-CG1 4.03Å |
| 395 | Q | 97.4 | Very high | 96.1 | Very high | 137 Ų | 137 | 65.7 Ų | 65.7 | 64% | 0.64 | 32% | 0.322 | S | S | * | . | H | α-helix | trans | -70.3 | -41.8 | 175.7 | -175 | 180 | -3.1 | 0 | 0 | 111.7 | Q391 Y392 L393 V397 E398 E399 | Q391-Q395 PolarHBondContact O-N 2.9Å; Y392-Q395 WeakPolarHBondContact O-CB 3.3Å; Y392-Q395 PolarHBondContact O-N 3.12Å; Y392-Q395 VanDerWaalsContact O-N 3.12Å; L393-Q395 VanDerWaalsContact C-N 3.31Å; L393-Q395 PolarHBondContact O-N 3.36Å; Q395-V397 VanDerWaalsContact C-N 3.32Å; Q395-V397 PolarHBondContact O-N 3.02Å; Q395-E398 CarbonylContact O-C 3.59Å; Q395-E398 PolarHBondContact O-N 3.48Å; Q395-E398 VanDerWaalsContact O-N 3.1Å; Q395-E399 PolarHBondContact O-N 3.22Å |
| 396 | E | 96.4 | Very high | 96.1 | Very high | 32 Ų | 32 | 64.2 Ų | 64.2 | 15% | 0.15 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -66.4 | -34.1 | 175.7 | -68.7 | -171.9 | 159.9 | 0 | 0 | 112.1 | W50 Y392 L393 E398 E399 F400 L412 | W50-E396 VanDerWaalsContact NE1-CD 3.29Å; W50-E396 PolarHBondContact NE1-OE1 3.17Å; W50-E396 VanDerWaalsContact NE1-OE1 3.17Å; W50-E396 PolarHBondContact NE1-OE2 3.46Å; Y392-E396 PolarHBondContact O-N 3.46Å; L393-E396 PolarHBondContact O-N 3.3Å; E396-E398 VanDerWaalsContact C-N 3.35Å; E396-E399 PolarHBondContact O-N 3.31Å; E396-F400 WeakPolarHBondContact O-CB 3.28Å; E396-F400 PolarHBondContact O-N 3.09Å; E396-L412 HydrophobicContact CB-CD2 3.77Å |
| 397 | V | 96.9 | Very high | 96.1 | Very high | 0 Ų | 0 | 72.4 Ų | 72.4 | 0% | 0 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -67.9 | -33 | 169.7 | 169.8 | 0 | 0 | 0 | 0 | 111.4 | L393 Q395 F400 L412 L416 I448 K451 L452 K455 | L393-V397 WeakPolarHBondContact O-CB 3.43Å; L393-V397 VanDerWaalsContact O-CG2 3.28Å; L393-V397 WeakPolarHBondContact O-CG2 3.35Å; L393-V397 PolarHBondContact O-N 3.43Å; Q395-V397 VanDerWaalsContact C-N 3.32Å; Q395-V397 PolarHBondContact O-N 3.02Å; V397-F400 PolarHBondContact O-N 2.86Å; V397-L412 HydrophobicContact CG2-CB 4.48Å; V397-L412 HydrophobicContact CG2-CD1 4.19Å; V397-L412 HydrophobicContact CG2-CD2 4.42Å; V397-L416 HydrophobicContact CG2-CD1 4.15Å; V397-I448 HydrophobicContact CB-CG2 4.07Å; V397-I448 HydrophobicContact CG1-CG2 4.22Å; V397-I448 HydrophobicContact CG2-CG2 3.84Å; V397-K451 HydrophobicContact CG1-CB 4.34Å; V397-K451 HydrophobicContact CG1-CD 4.18Å; V397-K451 HydrophobicContact CG1-CG 4.08Å; V397-L452 HydrophobicContact CG1-CB 3.89Å; V397-L452 HydrophobicContact CG2-CB 4.08Å; V397-L452 HydrophobicContact CG2-CD1 4.24Å; V397-L452 HydrophobicContact CG2-CD2 4.27Å; V397-L452 HydrophobicContact CG2-CG 4.41Å; V397-K455 HydrophobicContact CG1-CD 4.43Å; V397-K455 WeakPolarHBondContact O-CD 3.47Å; V397-K455 VanDerWaalsContact O-CE 3.31Å; V397-K455 WeakPolarHBondContact O-CE 3.42Å; V397-K455 PolarHBondContact O-NZ 3.2Å |
| 398 | E | 96.5 | Very high | 96.1 | Very high | 108 Ų | 108 | 70.9 Ų | 70.9 | 51% | 0.505 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -71.3 | -35.1 | 172.8 | -163.7 | 73.6 | -68 | 0 | 0 | 112.9 | E394 Q395 E396 F400 K451 K455 | E394-E398 PolarHBondContact O-N 3.22Å; Q395-E398 CarbonylContact O-C 3.59Å; Q395-E398 PolarHBondContact O-N 3.48Å; Q395-E398 VanDerWaalsContact O-N 3.1Å; E396-E398 VanDerWaalsContact C-N 3.35Å; E398-F400 VanDerWaalsContact C-N 3.35Å; E398-K451 WeakPolarHBondContact OE1-CE 3.49Å; E398-K451 IonicContact OE1-NZ 2.63Å; E398-K451 PolarHBondContact OE1-NZ 2.81Å; E398-K451 WeakPolarHBondContact OE2-CE 3.41Å; E398-K451 IonicContact OE2-NZ 3.43Å; E398-K451 PolarHBondContact OE2-NZ 3.43Å; E398-K455 VanDerWaalsContact C-NZ 3.27Å; E398-K455 PolarHBondContact O-NZ 3.36Å; E398-K455 IonicContact OE1-NZ 2.67Å |
| 399 | E | 95.9 | Very high | 96.1 | Very high | 120 Ų | 120 | 66.5 Ų | 66.5 | 56% | 0.561 | 33% | 0.329 | S | S | * | . | H | α-helix | trans | -74.2 | -24.7 | 170.9 | -163.4 | -173.1 | -143.5 | 0 | 0 | 112.3 | R51 Q395 E396 V401 | R51-E399 IonicContact CZ-OE2 2.81Å; R51-E399 VanDerWaalsContact CZ-OE2 3.26Å; R51-E399 IonicContact NE-OE2 2.76Å; R51-E399 PolarHBondContact NE-OE2 2.96Å; R51-E399 VanDerWaalsContact NE-OE2 3.08Å; R51-E399 IonicContact NH2-OE2 3.51Å; R51-E399 PolarHBondContact NH2-OE2 3.03Å; Q395-E399 PolarHBondContact O-N 3.22Å; E396-E399 PolarHBondContact O-N 3.31Å; E399-V401 PolarHBondContact O-N 3.48Å |
| 400 | F | 96.4 | Very high | 96.1 | Very high | 8 Ų | 8 | 71.3 Ų | 71.3 | 4% | 0.035 | 35% | 0.346 | C | S | . | . | trans | -59.9 | 122.1 | -174.2 | 179 | -95.4 | 0 | 0 | 0 | 112.7 | E396 V397 E398 G402 A408 Y409 L412 L452 K455 | E396-F400 WeakPolarHBondContact O-CB 3.28Å; E396-F400 PolarHBondContact O-N 3.09Å; V397-F400 PolarHBondContact O-N 2.86Å; E398-F400 VanDerWaalsContact C-N 3.35Å; F400-G402 VanDerWaalsContact CZ-C 3.5Å; F400-A408 HydrophobicContact CD2-CB 4.35Å; F400-A408 HydrophobicContact CE2-CB 3.95Å; F400-Y409 HydrophobicContact CE1-CD2 4.34Å; F400-Y409 HydrophobicContact CZ-CD2 4.36Å; F400-L412 HydrophobicContact CB-CD1 4.04Å; F400-L412 HydrophobicContact CD2-CD1 3.79Å; F400-L412 HydrophobicContact CG-CD1 4.07Å; F400-L452 HydrophobicContact CD1-CD1 3.9Å; F400-L452 HydrophobicContact CE1-CD1 4.19Å; F400-L452 HydrophobicContact CG-CD1 4.2Å; F400-K455 HydrophobicContact CD1-CB 4.15Å; F400-K455 PolarHBondContact O-NZ 3.05Å | ||
| 401 | V | 93.1 | Very high | 96.1 | Very high | 138 Ų | 138 | 73.5 Ų | 73.5 | 84% | 0.836 | 36% | 0.357 | S | S | * | . | trans | -130.3 | 118 | 167.8 | 179.9 | 0 | 0 | 0 | 0 | 106.6 | E399 | E399-V401 PolarHBondContact O-N 3.48Š| ||
| 402 | G | 93.1 | Very high | 96.1 | Very high | 19 Ų | 19 | 69.4 Ų | 69.4 | 20% | 0.196 | 34% | 0.338 | C | S | . | . | S | Bend | trans | 166.4 | -167.9 | -172 | 0 | 0 | 0 | 0 | 0 | 110.6 | F400 D406 K455 | F400-G402 VanDerWaalsContact CZ-C 3.5Å; G402-D406 WeakPolarHBondContact CA-OD2 3.31Å; G402-K455 VanDerWaalsContact O-O 3.09Å |
| 403 | K | 94.4 | Very high | 96.2 | Very high | 120 Ų | 120 | 68.5 Ų | 68.5 | 52% | 0.522 | 34% | 0.337 | S | S | . | . | trans | -122.9 | 163.5 | -175 | -63.7 | -174.1 | 177.9 | -169.5 | 0 | 113.1 | T405 D406 Y409 G456 | K403-T405 WeakPolarHBondContact CB-OG1 3.35Å; K403-T405 PolarHBondContact O-N 3.01Å; K403-D406 PolarHBondContact N-OD2 2.89Å; K403-D406 WeakPolarHBondContact O-CB 3.4Å; K403-D406 PolarHBondContact O-N 2.73Å; K403-Y409 VanDerWaalsContact O-CB 3.31Å; K403-Y409 WeakPolarHBondContact O-CB 3.35Å; K403-G456 CarbonylContact C-O 3.46Å; K403-G456 VanDerWaalsContact CA-O 3.25Å; K403-G456 WeakPolarHBondContact CA-O 3.4Å | ||
| 404 | K | 95.4 | Very high | 96.2 | Very high | 77 Ų | 77 | 74.5 Ų | 74.5 | 34% | 0.335 | 37% | 0.365 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60.2 | -8.6 | 172.3 | -55.5 | -166.4 | 76.9 | 178.8 | 0 | 114.3 | Y409 W410 E453 G456 | K404-Y409 HydrophobicContact CB-CD1 4.34Å; K404-Y409 HydrophobicContact CB-CE1 4.29Å; K404-Y409 HydrophobicContact CB-CE2 4.44Å; K404-Y409 HydrophobicContact CD-CE2 4.46Å; K404-Y409 VanDerWaalsContact CE-CZ 3.46Å; K404-Y409 WeakPolarHBondContact CE-OH 3.39Å; K404-Y409 HydrophobicContact CG-CD2 4.22Å; K404-Y409 HydrophobicContact CG-CE1 4.37Å; K404-Y409 HydrophobicContact CG-CE2 3.81Å; K404-W410 PolarHBondContact O-NE1 3.42Å; K404-E453 IonicContact NZ-OE1 3.75Å; K404-E453 PolarHBondContact NZ-OE1 3.24Å; K404-G456 WeakPolarHBondContact CG-O 3.37Å; K404-G456 PolarHBondContact N-O 3.32Å |
| 405 | T | 94.5 | Very high | 96.2 | Very high | 97 Ų | 97 | 74.8 Ų | 74.8 | 60% | 0.595 | 37% | 0.367 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.9 | -13.9 | 172.1 | 48.1 | 0 | 0 | 0 | 0 | 114.2 | K403 | K403-T405 WeakPolarHBondContact CB-OG1 3.35Å; K403-T405 PolarHBondContact O-N 3.01Å |
| 406 | D | 96.4 | Very high | 96.3 | Very high | 60 Ų | 60 | 68.2 Ų | 68.2 | 32% | 0.321 | 34% | 0.336 | S | S | . | . | S | Bend | trans | -92 | 139.1 | -164.5 | -58.6 | -6.8 | 0 | 0 | 0 | 110.2 | G402 K403 A408 Y409 W410 | G402-D406 WeakPolarHBondContact CA-OD2 3.31Å; K403-D406 PolarHBondContact N-OD2 2.89Å; K403-D406 WeakPolarHBondContact O-CB 3.4Å; K403-D406 PolarHBondContact O-N 2.73Å; D406-A408 PolarHBondContact O-N 3.17Å; D406-Y409 WeakPolarHBondContact O-CA 3.26Å; D406-Y409 WeakPolarHBondContact O-CB 3.4Å; D406-Y409 PolarHBondContact O-N 3.05Å; D406-W410 PolarHBondContact O-N 2.97Å |
| 407 | K | 96.7 | Very high | 96.3 | Very high | 173 Ų | 173 | 69.6 Ų | 69.6 | 75% | 0.752 | 35% | 0.347 | S | S | * | . | H | α-helix | trans | -56 | -29.5 | -177.9 | -174.7 | 178.3 | 177.3 | -174.9 | 0 | 113.3 | L411 | K407-L411 WeakPolarHBondContact O-CB 3.41Å; K407-L411 PolarHBondContact O-N 3.49Å |
| 408 | A | 95.8 | Very high | 96.3 | Very high | 28 Ų | 28 | 75 Ų | 75 | 23% | 0.231 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -69.2 | -34.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | W50 F400 D406 L412 | W50-A408 HydrophobicContact CH2-CB 4.05Å; F400-A408 HydrophobicContact CD2-CB 4.35Å; F400-A408 HydrophobicContact CE2-CB 3.95Å; D406-A408 PolarHBondContact O-N 3.17Å; A408-L412 VanDerWaalsContact O-CG 3.31Å; A408-L412 WeakPolarHBondContact O-CG 3.4Å; A408-L412 PolarHBondContact O-N 2.85Å; A408-L412 VanDerWaalsContact O-N 3.13Å |
| 409 | Y | 97.4 | Very high | 96.4 | Very high | 4 Ų | 4 | 70 Ų | 70 | 2% | 0.016 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -64.3 | -51 | 172.3 | 175.7 | -80.2 | 0 | 0 | 0 | 110.1 | F400 K403 K404 D406 L411 L412 E413 L452 | F400-Y409 HydrophobicContact CE1-CD2 4.34Å; F400-Y409 HydrophobicContact CZ-CD2 4.36Å; K403-Y409 VanDerWaalsContact O-CB 3.31Å; K403-Y409 WeakPolarHBondContact O-CB 3.35Å; K404-Y409 HydrophobicContact CB-CD1 4.34Å; K404-Y409 HydrophobicContact CB-CE1 4.29Å; K404-Y409 HydrophobicContact CB-CE2 4.44Å; K404-Y409 HydrophobicContact CD-CE2 4.46Å; K404-Y409 VanDerWaalsContact CE-CZ 3.46Å; K404-Y409 WeakPolarHBondContact CE-OH 3.39Å; K404-Y409 HydrophobicContact CG-CD2 4.22Å; K404-Y409 HydrophobicContact CG-CE1 4.37Å; K404-Y409 HydrophobicContact CG-CE2 3.81Å; D406-Y409 WeakPolarHBondContact O-CA 3.26Å; D406-Y409 WeakPolarHBondContact O-CB 3.4Å; D406-Y409 PolarHBondContact O-N 3.05Å; Y409-L411 VanDerWaalsContact C-N 3.29Å; Y409-L411 PolarHBondContact O-N 3.12Å; Y409-L412 PolarHBondContact O-N 3.07Å; Y409-E413 HydrophobicContact CE1-CB 4.3Å; Y409-E413 VanDerWaalsContact CE1-CD 3.45Å; Y409-E413 HydrophobicContact CE1-CG 4.47Å; Y409-E413 VanDerWaalsContact CE1-OE1 3.23Å; Y409-E413 WeakPolarHBondContact CE1-OE1 3.44Å; Y409-E413 WeakPolarHBondContact CE1-OE2 3.31Å; Y409-E413 VanDerWaalsContact CZ-OE1 3.3Å; Y409-E413 WeakPolarHBondContact O-CB 3.4Å; Y409-E413 PolarHBondContact O-N 3.25Å; Y409-E413 PolarHBondContact OH-OE1 3.37Å; Y409-L452 HydrophobicContact CD2-CD1 3.63Å; Y409-L452 HydrophobicContact CD2-CD2 4.5Å; Y409-L452 HydrophobicContact CD2-CG 3.82Å; Y409-L452 HydrophobicContact CE2-CD1 3.93Å; Y409-L452 HydrophobicContact CE2-CD2 4.34Å; Y409-L452 HydrophobicContact CE2-CG 3.6Å; Y409-L452 HydrophobicContact CG-CD1 4.45Å |
| 410 | W | 97.3 | Very high | 96.4 | Very high | 146 Ų | 146 | 66.4 Ų | 66.4 | 55% | 0.553 | 33% | 0.332 | S | S | * | . | H | α-helix | trans | -60.7 | -36.6 | 179.8 | -61.2 | -26.9 | 0 | 0 | 0 | 112.8 | K404 D406 E414 | K404-W410 PolarHBondContact O-NE1 3.42Å; D406-W410 PolarHBondContact O-N 2.97Å; W410-E414 WeakPolarHBondContact O-CB 3.22Å; W410-E414 PolarHBondContact O-N 2.81Å |
| 411 | L | 96.9 | Very high | 96.4 | Very high | 47 Ų | 47 | 72 Ų | 72 | 25% | 0.246 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -70.2 | -40.3 | 177.9 | -177.1 | 60.5 | 0 | 0 | 0 | 112.5 | W50 K407 Y409 E413 E414 M415 | W50-L411 HydrophobicContact CD2-CD2 3.67Å; W50-L411 HydrophobicContact CE3-CD2 3.53Å; W50-L411 HydrophobicContact CG-CD2 4.38Å; W50-L411 HydrophobicContact CH2-CD2 3.99Å; W50-L411 HydrophobicContact CZ2-CD2 4.11Å; W50-L411 HydrophobicContact CZ3-CD2 3.7Å; K407-L411 WeakPolarHBondContact O-CB 3.41Å; K407-L411 PolarHBondContact O-N 3.49Å; Y409-L411 VanDerWaalsContact C-N 3.29Å; Y409-L411 PolarHBondContact O-N 3.12Å; L411-E413 VanDerWaalsContact C-N 3.35Å; L411-E414 PolarHBondContact O-N 3.01Å; L411-M415 HydrophobicContact CD1-CG 4.34Å; L411-M415 HydrophobicContact CD1-SD 4.5Å; L411-M415 WeakPolarHBondContact O-CB 3.45Å; L411-M415 WeakPolarHBondContact O-CG 3.36Å; L411-M415 PolarHBondContact O-N 2.98Å |
| 412 | L | 97.4 | Very high | 96.5 | Very high | 3 Ų | 3 | 68.7 Ų | 68.7 | 2% | 0.016 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -65.1 | -40.3 | 174.8 | -71.3 | 168.8 | 0 | 0 | 0 | 111.2 | W50 L393 E396 V397 F400 A408 Y409 M415 L416 L452 | W50-L412 HydrophobicContact CZ2-CD2 4.38Å; W50-L412 HydrophobicContact CZ2-CG 4.49Å; L393-L412 HydrophobicContact CD2-CD2 4.01Å; E396-L412 HydrophobicContact CB-CD2 3.77Å; V397-L412 HydrophobicContact CG2-CB 4.48Å; V397-L412 HydrophobicContact CG2-CD1 4.19Å; V397-L412 HydrophobicContact CG2-CD2 4.42Å; F400-L412 HydrophobicContact CB-CD1 4.04Å; F400-L412 HydrophobicContact CD2-CD1 3.79Å; F400-L412 HydrophobicContact CG-CD1 4.07Å; A408-L412 VanDerWaalsContact O-CG 3.31Å; A408-L412 WeakPolarHBondContact O-CG 3.4Å; A408-L412 PolarHBondContact O-N 2.85Å; A408-L412 VanDerWaalsContact O-N 3.13Å; Y409-L412 PolarHBondContact O-N 3.07Å; L412-M415 PolarHBondContact O-N 2.92Å; L412-L416 WeakPolarHBondContact O-CB 3.43Å; L412-L416 WeakPolarHBondContact O-CD1 3.21Å; L412-L416 VanDerWaalsContact O-CG 3.26Å; L412-L416 WeakPolarHBondContact O-CG 3.4Å; L412-L416 PolarHBondContact O-N 3.44Å; L412-L452 HydrophobicContact CB-CD1 4.41Å; L412-L452 HydrophobicContact CB-CD2 3.62Å; L412-L452 HydrophobicContact CD1-CD1 4.15Å |
| 413 | E | 97.4 | Very high | 96.6 | Very high | 68 Ų | 68 | 67.8 Ų | 67.8 | 32% | 0.318 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -65.7 | -43.1 | 175 | -170.1 | 172.9 | -110.4 | 0 | 0 | 112 | Y409 L411 T417 L449 L452 | Y409-E413 HydrophobicContact CE1-CB 4.3Å; Y409-E413 VanDerWaalsContact CE1-CD 3.45Å; Y409-E413 HydrophobicContact CE1-CG 4.47Å; Y409-E413 VanDerWaalsContact CE1-OE1 3.23Å; Y409-E413 WeakPolarHBondContact CE1-OE1 3.44Å; Y409-E413 WeakPolarHBondContact CE1-OE2 3.31Å; Y409-E413 VanDerWaalsContact CZ-OE1 3.3Å; Y409-E413 WeakPolarHBondContact O-CB 3.4Å; Y409-E413 PolarHBondContact O-N 3.25Å; Y409-E413 PolarHBondContact OH-OE1 3.37Å; L411-E413 VanDerWaalsContact C-N 3.35Å; E413-T417 WeakPolarHBondContact O-CB 3.4Å; E413-T417 VanDerWaalsContact O-CG2 3.31Å; E413-T417 WeakPolarHBondContact O-CG2 3.43Å; E413-T417 PolarHBondContact O-N 2.96Å; E413-T417 PolarHBondContact O-OG1 3.11Å; E413-L449 HydrophobicContact CG-CD2 4.24Å; E413-L452 HydrophobicContact CB-CD2 4.25Å |
| 414 | E | 97.9 | Very high | 96.6 | Very high | 130 Ų | 130 | 66.6 Ų | 66.6 | 61% | 0.607 | 33% | 0.327 | S | S | * | . | H | α-helix | trans | -62.1 | -42.9 | 174.3 | -179.9 | 176.8 | -134.2 | 0 | 0 | 112 | W410 L411 T417 K418 | W410-E414 WeakPolarHBondContact O-CB 3.22Å; W410-E414 PolarHBondContact O-N 2.81Å; L411-E414 PolarHBondContact O-N 3.01Å; E414-T417 PolarHBondContact O-OG1 2.92Å; E414-K418 WeakPolarHBondContact O-CB 3.16Å; E414-K418 PolarHBondContact O-N 2.97Å |
| 415 | M | 97.8 | Very high | 96.5 | Very high | 55 Ų | 55 | 66.6 Ų | 66.6 | 27% | 0.271 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -68.5 | -50.5 | 176.9 | -71.9 | -170.6 | 67 | 0 | 0 | 111.9 | L393 L411 L412 T417 K418 E419 | L393-M415 HydrophobicContact CD1-CB 3.96Å; L393-M415 HydrophobicContact CD2-CB 3.78Å; L393-M415 HydrophobicContact CD2-CE 4.04Å; L393-M415 HydrophobicContact CD2-SD 4.13Å; L411-M415 HydrophobicContact CD1-CG 4.34Å; L411-M415 HydrophobicContact CD1-SD 4.5Å; L411-M415 WeakPolarHBondContact O-CB 3.45Å; L411-M415 WeakPolarHBondContact O-CG 3.36Å; L411-M415 PolarHBondContact O-N 2.98Å; L412-M415 PolarHBondContact O-N 2.92Å; M415-T417 VanDerWaalsContact C-N 3.28Å; M415-T417 PolarHBondContact O-N 3.13Å; M415-K418 WeakPolarHBondContact O-CB 3.41Å; M415-K418 PolarHBondContact O-N 2.93Å; M415-K418 VanDerWaalsContact O-N 3.07Å; M415-E419 PolarHBondContact O-N 3.39Å |
| 416 | L | 97.7 | Very high | 96.5 | Very high | 0 Ų | 0 | 62.1 Ų | 62.1 | 0% | 0 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -57.8 | -39.3 | 178.3 | -73.8 | 163.8 | 0 | 0 | 0 | 112.6 | L393 V397 L412 L420 I445 I448 L449 L452 | L393-L416 HydrophobicContact CB-CD2 3.84Å; L393-L416 HydrophobicContact CB-CG 4.33Å; L393-L416 HydrophobicContact CD1-CD2 3.95Å; L393-L416 HydrophobicContact CD1-CG 4.17Å; V397-L416 HydrophobicContact CG2-CD1 4.15Å; L412-L416 WeakPolarHBondContact O-CB 3.43Å; L412-L416 WeakPolarHBondContact O-CD1 3.21Å; L412-L416 VanDerWaalsContact O-CG 3.26Å; L412-L416 WeakPolarHBondContact O-CG 3.4Å; L412-L416 PolarHBondContact O-N 3.44Å; L416-L420 PolarHBondContact O-N 3.04Å; L416-L420 VanDerWaalsContact O-N 3.12Å; L416-I445 HydrophobicContact CB-CG2 4.34Å; L416-I445 HydrophobicContact CD2-CG2 4.41Å; L416-I445 WeakPolarHBondContact O-CG2 3.29Å; L416-I448 HydrophobicContact CD1-CG2 3.74Å; L416-I448 HydrophobicContact CD2-CB 4.19Å; L416-I448 HydrophobicContact CD2-CG2 3.79Å; L416-I448 HydrophobicContact CG-CG2 4.44Å; L416-L449 HydrophobicContact CB-CD1 4.42Å; L416-L449 HydrophobicContact CB-CD2 3.67Å; L416-L449 HydrophobicContact CB-CG 3.93Å; L416-L449 HydrophobicContact CD1-CD2 3.81Å; L416-L449 HydrophobicContact CD1-CG 4.11Å; L416-L449 HydrophobicContact CG-CD2 4.39Å; L416-L452 HydrophobicContact CD1-CD2 4.07Å |
| 417 | T | 97.6 | Very high | 96.3 | Very high | 61 Ų | 61 | 65.9 Ų | 65.9 | 37% | 0.374 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -73.6 | -32.1 | 176 | 53.5 | 0 | 0 | 0 | 0 | 113.2 | E413 E414 M415 L420 L421 L449 | E413-T417 WeakPolarHBondContact O-CB 3.4Å; E413-T417 VanDerWaalsContact O-CG2 3.31Å; E413-T417 WeakPolarHBondContact O-CG2 3.43Å; E413-T417 PolarHBondContact O-N 2.96Å; E413-T417 PolarHBondContact O-OG1 3.11Å; E414-T417 PolarHBondContact O-OG1 2.92Å; M415-T417 VanDerWaalsContact C-N 3.28Å; M415-T417 PolarHBondContact O-N 3.13Å; T417-L420 WeakPolarHBondContact O-CB 3.47Å; T417-L420 PolarHBondContact O-N 3.25Å; T417-L421 WeakPolarHBondContact O-CG 3.43Å; T417-L421 PolarHBondContact O-N 3.06Å; T417-L421 VanDerWaalsContact O-N 3.11Å; T417-L449 HydrophobicContact CG2-CD1 4.26Å; T417-L449 HydrophobicContact CG2-CD2 4.48Å |
| 418 | K | 97.7 | Very high | 95.9 | Very high | 113 Ų | 113 | 58.1 Ų | 58.1 | 49% | 0.491 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -66.6 | -44.9 | 171 | 177.4 | -164.3 | 167 | -150.2 | 0 | 112.3 | E414 M415 L420 L421 E422 | E414-K418 WeakPolarHBondContact O-CB 3.16Å; E414-K418 PolarHBondContact O-N 2.97Å; M415-K418 WeakPolarHBondContact O-CB 3.41Å; M415-K418 PolarHBondContact O-N 2.93Å; M415-K418 VanDerWaalsContact O-N 3.07Å; K418-L420 PolarHBondContact O-N 3.34Å; K418-L421 WeakPolarHBondContact O-CB 3.29Å; K418-L421 PolarHBondContact O-N 3.07Å; K418-L421 VanDerWaalsContact O-N 3.13Å; K418-E422 PolarHBondContact O-N 3.13Å |
| 419 | E | 97.4 | Very high | 95.3 | Very high | 2 Ų | 2 | 59.6 Ų | 59.6 | 1% | 0.009 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -62.3 | -32.8 | 175.2 | -96 | 59.1 | -110.1 | 0 | 0 | 111.4 | V386 K389 V390 L393 M415 E422 L423 | V386-E419 HydrophobicContact CG1-CB 4.13Å; V386-E419 HydrophobicContact CG1-CG 4.24Å; K389-E419 HydrophobicContact CB-CG 3.93Å; K389-E419 HydrophobicContact CD-CG 3.78Å; K389-E419 VanDerWaalsContact CD-OE1 3.29Å; K389-E419 WeakPolarHBondContact CD-OE1 3.36Å; K389-E419 IonicContact NZ-OE1 2.72Å; K389-E419 PolarHBondContact NZ-OE1 3.38Å; V390-E419 HydrophobicContact CG2-CB 4.07Å; V390-E419 HydrophobicContact CG2-CG 4.23Å; L393-E419 HydrophobicContact CD1-CG 4.41Å; M415-E419 PolarHBondContact O-N 3.39Å; E419-E422 PolarHBondContact O-N 3.36Å; E419-L423 VanDerWaalsContact O-CB 3.29Å; E419-L423 WeakPolarHBondContact O-CB 3.36Å; E419-L423 PolarHBondContact O-N 2.88Å |
| 420 | L | 96.6 | Very high | 94.9 | Very high | 46 Ų | 46 | 61.5 Ų | 61.5 | 24% | 0.241 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -64.4 | -43 | 170.9 | -166.6 | 156.3 | 0 | 0 | 0 | 112.3 | L416 T417 K418 L423 D424 I445 | L416-L420 PolarHBondContact O-N 3.04Å; L416-L420 VanDerWaalsContact O-N 3.12Å; T417-L420 WeakPolarHBondContact O-CB 3.47Å; T417-L420 PolarHBondContact O-N 3.25Å; K418-L420 PolarHBondContact O-N 3.34Å; L420-L423 WeakPolarHBondContact O-CB 3.47Å; L420-L423 PolarHBondContact O-N 3.48Å; L420-D424 PolarHBondContact O-N 2.9Å; L420-I445 HydrophobicContact CB-CD1 4.3Å; L420-I445 HydrophobicContact CB-CG2 4.21Å; L420-I445 HydrophobicContact CD1-CG2 4.15Å |
| 421 | L | 96.3 | Very high | 94.7 | Very high | 126 Ų | 126 | 59.9 Ų | 59.9 | 66% | 0.66 | 33% | 0.329 | S | S | * | . | H | α-helix | trans | -66.4 | -39.6 | 176.2 | -70.5 | 165.4 | 0 | 0 | 0 | 112.3 | T417 K418 L423 S425 | T417-L421 WeakPolarHBondContact O-CG 3.43Å; T417-L421 PolarHBondContact O-N 3.06Å; T417-L421 VanDerWaalsContact O-N 3.11Å; K418-L421 WeakPolarHBondContact O-CB 3.29Å; K418-L421 PolarHBondContact O-N 3.07Å; K418-L421 VanDerWaalsContact O-N 3.13Å; L421-L423 VanDerWaalsContact C-N 3.28Å; L421-L423 PolarHBondContact O-N 2.87Å; L421-S425 PolarHBondContact O-N 3.09Å |
| 422 | E | 95.4 | Very high | 94.5 | Very high | 68 Ų | 68 | 63.2 Ų | 63.2 | 32% | 0.318 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -62.3 | -39.1 | 174.1 | -166.2 | 175.4 | 128.7 | 0 | 0 | 111 | V386 K389 K418 E419 S425 | V386-E422 HydrophobicContact CG2-CB 4.34Å; V386-E422 HydrophobicContact CG2-CG 4.17Å; K389-E422 IonicContact NZ-OE1 3.08Å; K389-E422 PolarHBondContact NZ-OE1 3.24Å; K389-E422 IonicContact NZ-OE2 3.35Å; K389-E422 PolarHBondContact NZ-OE2 3.38Å; K418-E422 PolarHBondContact O-N 3.13Å; E419-E422 PolarHBondContact O-N 3.36Å; E422-S425 PolarHBondContact O-OG 3.21Å |
| 423 | L | 95.5 | Very high | 94.3 | Very high | 0 Ų | 0 | 66.6 Ų | 66.6 | 0% | 0 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -69.6 | -41.2 | 178 | -175.3 | 62.1 | 0 | 0 | 0 | 113.9 | I383 V386 E419 L420 L421 S425 V426 R438 A441 V442 I445 | I383-L423 HydrophobicContact CB-CD1 4.34Å; I383-L423 HydrophobicContact CG1-CD1 3.82Å; I383-L423 HydrophobicContact CG2-CD1 4.2Å; V386-L423 HydrophobicContact CG1-CB 4.25Å; E419-L423 VanDerWaalsContact O-CB 3.29Å; E419-L423 WeakPolarHBondContact O-CB 3.36Å; E419-L423 PolarHBondContact O-N 2.88Å; L420-L423 WeakPolarHBondContact O-CB 3.47Å; L420-L423 PolarHBondContact O-N 3.48Å; L421-L423 VanDerWaalsContact C-N 3.28Å; L421-L423 PolarHBondContact O-N 2.87Å; L423-S425 VanDerWaalsContact C-N 3.27Å; L423-S425 PolarHBondContact O-N 3.01Å; L423-V426 VanDerWaalsContact O-CB 3.29Å; L423-V426 WeakPolarHBondContact O-CB 3.41Å; L423-V426 WeakPolarHBondContact O-CG2 3.49Å; L423-V426 PolarHBondContact O-N 2.93Å; L423-V426 VanDerWaalsContact O-N 3.13Å; L423-R438 HydrophobicContact CD1-CG 3.92Å; L423-R438 HydrophobicContact CG-CG 3.98Å; L423-A441 HydrophobicContact CD1-CB 4.03Å; L423-A441 HydrophobicContact CD2-CB 3.48Å; L423-A441 VanDerWaalsContact CD2-CB 3.48Å; L423-A441 HydrophobicContact CG-CB 4.42Å; L423-V442 HydrophobicContact CD2-CB 4.36Å; L423-V442 HydrophobicContact CD2-CG2 3.53Å; L423-V442 HydrophobicContact CG-CG2 4.22Å; L423-I445 HydrophobicContact CD2-CD1 3.81Å |
| 424 | D | 94.2 | Very high | 94.1 | Very high | 94 Ų | 94 | 63.3 Ų | 63.3 | 50% | 0.503 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -68.6 | -28.6 | 177.6 | -169.9 | 50.9 | 0 | 0 | 0 | 112.1 | L420 V426 R438 | L420-D424 PolarHBondContact O-N 2.9Å; D424-V426 PolarHBondContact O-N 3.35Å; D424-V426 VanDerWaalsContact O-N 3.09Å; D424-R438 PolarHBondContact O-NH1 3.13Å; D424-R438 IonicContact OD1-CZ 3.56Å; D424-R438 IonicContact OD1-NH1 2.66Å; D424-R438 IonicContact OD1-NH2 3.26Å; D424-R438 PolarHBondContact OD1-NH2 3.43Å |
| 425 | S | 93.8 | Very high | 94 | Very high | 78 Ų | 78 | 63 Ų | 63 | 55% | 0.545 | 35% | 0.349 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -64.4 | -7.5 | 171.2 | 87.9 | 0 | 0 | 0 | 0 | 114.6 | L421 E422 L423 E427 | L421-S425 PolarHBondContact O-N 3.09Å; E422-S425 PolarHBondContact O-OG 3.21Å; L423-S425 VanDerWaalsContact C-N 3.27Å; L423-S425 PolarHBondContact O-N 3.01Å; S425-E427 PolarHBondContact O-N 3.19Å |
| 426 | V | 93.3 | Very high | 93.9 | Very high | 2 Ų | 2 | 64.4 Ų | 64.4 | 1% | 0.012 | 36% | 0.355 | C | S | . | . | trans | -77.6 | 105.3 | 176.3 | -176.9 | 0 | 0 | 0 | 0 | 110.2 | K382 I383 L423 D424 V434 R438 | K382-V426 HydrophobicContact CB-CG2 3.88Å; K382-V426 HydrophobicContact CD-CG2 4.08Å; I383-V426 HydrophobicContact CD1-CG1 4.04Å; I383-V426 HydrophobicContact CG1-CB 4.47Å; I383-V426 HydrophobicContact CG1-CG1 4.06Å; I383-V426 HydrophobicContact CG1-CG2 4.3Å; L423-V426 VanDerWaalsContact O-CB 3.29Å; L423-V426 WeakPolarHBondContact O-CB 3.41Å; L423-V426 WeakPolarHBondContact O-CG2 3.49Å; L423-V426 PolarHBondContact O-N 2.93Å; L423-V426 VanDerWaalsContact O-N 3.13Å; D424-V426 PolarHBondContact O-N 3.35Å; D424-V426 VanDerWaalsContact O-N 3.09Å; V426-V434 HydrophobicContact CG1-CG1 4.31Å; V426-R438 PolarHBondContact O-NH1 2.66Å | ||
| 427 | E | 91.3 | Very high | 93.8 | Very high | 139 Ų | 139 | 65.5 Ų | 65.5 | 65% | 0.65 | 36% | 0.364 | S | S | * | . | trans | -61.3 | 137.6 | 166.6 | -179.1 | 51.6 | -104.2 | 0 | 0 | 110.9 | S379 S425 G429 | S379-E427 VanDerWaalsContact CB-O 3.28Å; S379-E427 WeakPolarHBondContact CB-O 3.44Å; S425-E427 PolarHBondContact O-N 3.19Å; E427-G429 PolarHBondContact OE1-N 3.31Å | ||
| 428 | T | 88.8 | Confident | 93.8 | Very high | 10 Ų | 10 | 65.6 Ų | 65.6 | 6% | 0.061 | 36% | 0.358 | C | S | . | . | trans | -97.3 | -25.2 | -176.4 | 62.5 | 0 | 0 | 0 | 0 | 113 | G430 Q431 V434 R435 | T428-G430 PolarHBondContact O-N 2.97Å; T428-G430 VanDerWaalsContact O-N 3.11Å; T428-Q431 WeakPolarHBondContact O-CB 3.19Å; T428-Q431 PolarHBondContact O-N 3Å; T428-V434 HydrophobicContact CG2-CG1 4.14Å; T428-R435 HydrophobicContact CG2-CG 3.91Å; T428-R435 PolarHBondContact OG1-NH1 3.46Å | ||
| 429 | G | 84.7 | Confident | 93.8 | Very high | 59 Ų | 59 | 66.4 Ų | 66.4 | 61% | 0.608 | 36% | 0.361 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 59.7 | 23 | 177.5 | 0 | 0 | 0 | 0 | 0 | 114.2 | E427 Q431 | E427-G429 PolarHBondContact OE1-N 3.31Å; G429-Q431 VanDerWaalsContact C-N 3.32Å |
| 430 | G | 88.2 | Confident | 93.8 | Very high | 44 Ų | 44 | 71.6 Ų | 71.6 | 45% | 0.454 | 39% | 0.385 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 80.2 | 1.6 | -173.2 | 0 | 0 | 0 | 0 | 0 | 115.5 | T428 D432 | T428-G430 PolarHBondContact O-N 2.97Å; T428-G430 VanDerWaalsContact O-N 3.11Å; G430-D432 PolarHBondContact O-N 2.93Å |
| 431 | Q | 92.6 | Very high | 93.8 | Very high | 112 Ų | 112 | 69.4 Ų | 69.4 | 52% | 0.523 | 37% | 0.374 | S | S | . | . | trans | -82.2 | 112.4 | -178.4 | -62.7 | -66.7 | -43.4 | 0 | 0 | 111.7 | T428 G429 S433 V434 R435 | T428-Q431 WeakPolarHBondContact O-CB 3.19Å; T428-Q431 PolarHBondContact O-N 3Å; G429-Q431 VanDerWaalsContact C-N 3.32Å; Q431-S433 VanDerWaalsContact C-N 3.31Å; Q431-S433 PolarHBondContact O-N 3.46Å; Q431-V434 HydrophobicContact CB-CB 4.11Å; Q431-V434 HydrophobicContact CB-CG2 3.5Å; Q431-V434 HydrophobicContact CG-CG2 4.33Å; Q431-V434 WeakPolarHBondContact O-CB 3.46Å; Q431-V434 PolarHBondContact O-N 2.93Å; Q431-R435 PolarHBondContact O-N 3.04Å | ||
| 432 | D | 93 | Very high | 93.9 | Very high | 117 Ų | 117 | 65 Ų | 65 | 63% | 0.626 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -66.4 | -29.4 | -176.3 | -65 | -48.7 | 0 | 0 | 0 | 113.8 | G430 V434 R435 Q436 | G430-D432 PolarHBondContact O-N 2.93Å; D432-V434 VanDerWaalsContact C-N 3.3Å; D432-V434 PolarHBondContact O-N 3.09Å; D432-R435 PolarHBondContact O-N 3.25Å; D432-R435 WeakPolarHBondContact OD1-CD 3.42Å; D432-R435 IonicContact OD1-NE 2.69Å; D432-Q436 WeakPolarHBondContact O-CB 3.09Å; D432-Q436 PolarHBondContact O-N 3.31Å |
| 433 | S | 92.6 | Very high | 94 | Very high | 74 Ų | 74 | 64.8 Ų | 64.8 | 52% | 0.517 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -60.1 | -39.7 | 170.4 | 54.4 | 0 | 0 | 0 | 0 | 112.2 | Q431 A437 | Q431-S433 VanDerWaalsContact C-N 3.31Å; Q431-S433 PolarHBondContact O-N 3.46Å; S433-A437 WeakPolarHBondContact O-CB 3.42Å; S433-A437 PolarHBondContact O-N 2.72Å |
| 434 | V | 94.6 | Very high | 94.1 | Very high | 0 Ų | 0 | 67.3 Ų | 67.3 | 0% | 0 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -69.7 | -42.1 | 174.8 | -170.1 | 0 | 0 | 0 | 0 | 110.4 | S379 I380 I383 V426 T428 Q431 D432 Q436 R438 | S379-V434 WeakPolarHBondContact OG-CG2 3.36Å; I380-V434 HydrophobicContact CD1-CB 4.37Å; I380-V434 HydrophobicContact CD1-CG2 4.08Å; I380-V434 HydrophobicContact CG1-CG2 4.03Å; I383-V434 HydrophobicContact CD1-CG1 3.69Å; V426-V434 HydrophobicContact CG1-CG1 4.31Å; T428-V434 HydrophobicContact CG2-CG1 4.14Å; Q431-V434 HydrophobicContact CB-CB 4.11Å; Q431-V434 HydrophobicContact CB-CG2 3.5Å; Q431-V434 HydrophobicContact CG-CG2 4.33Å; Q431-V434 WeakPolarHBondContact O-CB 3.46Å; Q431-V434 PolarHBondContact O-N 2.93Å; D432-V434 VanDerWaalsContact C-N 3.3Å; D432-V434 PolarHBondContact O-N 3.09Å; V434-Q436 PolarHBondContact O-N 2.76Å; V434-R438 WeakPolarHBondContact O-CB 3.48Å; V434-R438 PolarHBondContact O-N 3.22Å |
| 435 | R | 95.8 | Very high | 94.3 | Very high | 122 Ų | 122 | 62.8 Ų | 62.8 | 46% | 0.46 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -59.5 | -45.8 | 176.5 | -64.8 | -176.1 | -176.1 | -70.3 | 0 | 111.8 | T428 Q431 D432 K439 | T428-R435 HydrophobicContact CG2-CG 3.91Å; T428-R435 PolarHBondContact OG1-NH1 3.46Å; Q431-R435 PolarHBondContact O-N 3.04Å; D432-R435 PolarHBondContact O-N 3.25Å; D432-R435 WeakPolarHBondContact OD1-CD 3.42Å; D432-R435 IonicContact OD1-NE 2.69Å; R435-K439 WeakPolarHBondContact O-CB 3.43Å; R435-K439 PolarHBondContact O-N 3.11Å |
| 436 | Q | 95.8 | Very high | 94.5 | Very high | 85 Ų | 85 | 64 Ų | 64 | 40% | 0.397 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -69.5 | -49.1 | -178.5 | -177.7 | 61.8 | 14.6 | 0 | 0 | 111.4 | D432 V434 R438 K439 E440 | D432-Q436 WeakPolarHBondContact O-CB 3.09Å; D432-Q436 PolarHBondContact O-N 3.31Å; V434-Q436 PolarHBondContact O-N 2.76Å; Q436-R438 VanDerWaalsContact C-N 3.27Å; Q436-R438 PolarHBondContact O-N 3.09Å; Q436-K439 WeakPolarHBondContact O-CB 3.46Å; Q436-K439 PolarHBondContact O-N 3.35Å; Q436-K439 VanDerWaalsContact O-N 3.09Å; Q436-E440 WeakPolarHBondContact CG-OE1 3.44Å; Q436-E440 PolarHBondContact NE2-OE1 3.18Å; Q436-E440 WeakPolarHBondContact O-CG 3.29Å; Q436-E440 PolarHBondContact O-N 3.24Å |
| 437 | A | 95.7 | Very high | 94.7 | Very high | 23 Ų | 23 | 66.5 Ų | 66.5 | 19% | 0.19 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -59.6 | -38.4 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | I380 I383 S433 A441 | I380-A437 HydrophobicContact CD1-CB 3.91Å; I383-A437 HydrophobicContact CD1-CB 4.3Å; I383-A437 HydrophobicContact CG2-CB 4.08Å; S433-A437 WeakPolarHBondContact O-CB 3.42Å; S433-A437 PolarHBondContact O-N 2.72Å; A437-A441 WeakPolarHBondContact O-CB 3.33Å; A437-A441 PolarHBondContact O-N 2.83Å |
| 438 | R | 96.9 | Very high | 95.1 | Very high | 64 Ų | 64 | 60 Ų | 60 | 24% | 0.242 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -64.5 | -43.6 | 174.2 | -163.8 | 178.9 | 90.5 | 139.1 | 26.4 | 111.8 | I383 L423 D424 V426 V434 Q436 A441 V442 | I383-R438 HydrophobicContact CD1-CB 3.95Å; L423-R438 HydrophobicContact CD1-CG 3.92Å; L423-R438 HydrophobicContact CG-CG 3.98Å; D424-R438 PolarHBondContact O-NH1 3.13Å; D424-R438 IonicContact OD1-CZ 3.56Å; D424-R438 IonicContact OD1-NH1 2.66Å; D424-R438 IonicContact OD1-NH2 3.26Å; D424-R438 PolarHBondContact OD1-NH2 3.43Å; V426-R438 PolarHBondContact O-NH1 2.66Å; V434-R438 WeakPolarHBondContact O-CB 3.48Å; V434-R438 PolarHBondContact O-N 3.22Å; Q436-R438 VanDerWaalsContact C-N 3.27Å; Q436-R438 PolarHBondContact O-N 3.09Å; R438-A441 PolarHBondContact O-N 2.82Å; R438-V442 WeakPolarHBondContact O-CG2 3.33Å; R438-V442 PolarHBondContact O-N 3.04Å |
| 439 | K | 97.3 | Very high | 95.5 | Very high | 130 Ų | 130 | 61.2 Ų | 61.2 | 57% | 0.565 | 34% | 0.338 | S | S | * | . | H | α-helix | trans | -62.1 | -47 | 176.4 | 178.3 | -173.3 | 168.7 | -168.4 | 0 | 111.7 | R435 Q436 A441 V442 C443 | R435-K439 WeakPolarHBondContact O-CB 3.43Å; R435-K439 PolarHBondContact O-N 3.11Å; Q436-K439 WeakPolarHBondContact O-CB 3.46Å; Q436-K439 PolarHBondContact O-N 3.35Å; Q436-K439 VanDerWaalsContact O-N 3.09Å; K439-A441 PolarHBondContact O-N 3.24Å; K439-V442 PolarHBondContact O-N 3.3Å; K439-C443 PolarHBondContact O-N 3.14Å; K439-C443 PolarHBondContact O-SG 3.12Å; K439-C443 VanDerWaalsContact O-SG 3.35Å |
| 440 | E | 97.4 | Very high | 96.1 | Very high | 110 Ų | 110 | 63.3 Ų | 63.3 | 51% | 0.514 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -61.2 | -43.6 | 178.2 | -72.5 | 168.6 | 178.4 | 0 | 0 | 111.6 | Q436 C443 K444 | Q436-E440 WeakPolarHBondContact CG-OE1 3.44Å; Q436-E440 PolarHBondContact NE2-OE1 3.18Å; Q436-E440 WeakPolarHBondContact O-CG 3.29Å; Q436-E440 PolarHBondContact O-N 3.24Å; E440-C443 PolarHBondContact O-N 3.34Å; E440-K444 PolarHBondContact O-N 3.27Å |
| 441 | A | 97.3 | Very high | 96.5 | Very high | 1 Ų | 1 | 64 Ų | 64 | 1% | 0.008 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -64.1 | -39 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | I383 L387 L423 A437 R438 K439 K444 I445 | I383-A441 HydrophobicContact CG2-CB 4.19Å; L387-A441 HydrophobicContact CD1-CB 4.26Å; L387-A441 HydrophobicContact CD2-CB 3.65Å; L387-A441 HydrophobicContact CG-CB 3.87Å; L423-A441 HydrophobicContact CD1-CB 4.03Å; L423-A441 HydrophobicContact CD2-CB 3.48Å; L423-A441 VanDerWaalsContact CD2-CB 3.48Å; L423-A441 HydrophobicContact CG-CB 4.42Å; A437-A441 WeakPolarHBondContact O-CB 3.33Å; A437-A441 PolarHBondContact O-N 2.83Å; R438-A441 PolarHBondContact O-N 2.82Å; K439-A441 PolarHBondContact O-N 3.24Å; A441-K444 PolarHBondContact O-N 3.07Å; A441-I445 WeakPolarHBondContact O-CG1 3.47Å; A441-I445 PolarHBondContact O-N 3.2Å |
| 442 | V | 97.9 | Very high | 96.7 | Very high | 32 Ų | 32 | 58.7 Ų | 58.7 | 19% | 0.194 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -62.3 | -46 | 172.1 | 169.2 | 0 | 0 | 0 | 0 | 110.9 | L423 R438 K439 K444 I445 Q446 | L423-V442 HydrophobicContact CD2-CB 4.36Å; L423-V442 HydrophobicContact CD2-CG2 3.53Å; L423-V442 HydrophobicContact CG-CG2 4.22Å; R438-V442 WeakPolarHBondContact O-CG2 3.33Å; R438-V442 PolarHBondContact O-N 3.04Å; K439-V442 PolarHBondContact O-N 3.3Å; V442-K444 VanDerWaalsContact C-N 3.31Å; V442-K444 PolarHBondContact O-N 3.26Å; V442-I445 PolarHBondContact O-N 3Å; V442-Q446 HydrophobicContact CG1-CG 4.41Å; V442-Q446 WeakPolarHBondContact O-CG 3.34Å; V442-Q446 PolarHBondContact O-N 3.49Å |
| 443 | C | 97.8 | Very high | 96.8 | Very high | 65 Ų | 65 | 57.5 Ų | 57.5 | 44% | 0.439 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -61.2 | -38.8 | 177.5 | -69.3 | 0 | 0 | 0 | 0 | 112.2 | K439 E440 Q446 A447 | K439-C443 PolarHBondContact O-N 3.14Å; K439-C443 PolarHBondContact O-SG 3.12Å; K439-C443 VanDerWaalsContact O-SG 3.35Å; E440-C443 PolarHBondContact O-N 3.34Å; C443-Q446 PolarHBondContact O-N 3.04Å; C443-A447 PolarHBondContact O-N 3.12Å |
| 444 | K | 97.9 | Very high | 97 | Very high | 52 Ų | 52 | 60 Ų | 60 | 23% | 0.226 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -63 | -48.4 | 174.7 | -178.7 | 164.9 | -177.6 | 161.5 | 0 | 111.7 | L387 V390 E394 E440 A441 V442 Q446 A447 I448 | L387-K444 HydrophobicContact CD2-CD 4.37Å; V390-K444 HydrophobicContact CG1-CD 4.27Å; V390-K444 HydrophobicContact CG1-CG 4.07Å; E394-K444 WeakPolarHBondContact OE1-CE 3.46Å; E394-K444 IonicContact OE1-NZ 3.96Å; E394-K444 WeakPolarHBondContact OE2-CE 3.39Å; E394-K444 IonicContact OE2-NZ 3.22Å; E394-K444 PolarHBondContact OE2-NZ 3.43Å; E440-K444 PolarHBondContact O-N 3.27Å; A441-K444 PolarHBondContact O-N 3.07Å; V442-K444 VanDerWaalsContact C-N 3.31Å; V442-K444 PolarHBondContact O-N 3.26Å; K444-Q446 VanDerWaalsContact C-N 3.3Å; K444-Q446 PolarHBondContact O-N 3.22Å; K444-A447 PolarHBondContact O-N 3.11Å; K444-I448 HydrophobicContact CD-CD1 4.48Å; K444-I448 HydrophobicContact CG-CD1 3.75Å; K444-I448 HydrophobicContact CG-CG1 4.49Å; K444-I448 WeakPolarHBondContact O-CD1 3.45Å; K444-I448 VanDerWaalsContact O-CG1 3.3Å; K444-I448 WeakPolarHBondContact O-CG1 3.47Å; K444-I448 PolarHBondContact O-N 3.26Å |
| 445 | I | 97.8 | Very high | 96.9 | Very high | 0 Ų | 0 | 62.9 Ų | 62.9 | 0% | 0 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -58.8 | -43 | 177.8 | -65.8 | 161.3 | 0 | 0 | 0 | 111.2 | V386 V390 L416 L420 L423 A441 V442 I448 L449 | V386-I445 HydrophobicContact CG1-CD1 4.39Å; V390-I445 HydrophobicContact CB-CG1 4.41Å; V390-I445 HydrophobicContact CG1-CG1 3.88Å; V390-I445 HydrophobicContact CG2-CD1 3.91Å; V390-I445 HydrophobicContact CG2-CG1 3.56Å; L416-I445 HydrophobicContact CB-CG2 4.34Å; L416-I445 HydrophobicContact CD2-CG2 4.41Å; L416-I445 WeakPolarHBondContact O-CG2 3.29Å; L420-I445 HydrophobicContact CB-CD1 4.3Å; L420-I445 HydrophobicContact CB-CG2 4.21Å; L420-I445 HydrophobicContact CD1-CG2 4.15Å; L423-I445 HydrophobicContact CD2-CD1 3.81Å; A441-I445 WeakPolarHBondContact O-CG1 3.47Å; A441-I445 PolarHBondContact O-N 3.2Å; V442-I445 PolarHBondContact O-N 3Å; I445-I448 PolarHBondContact O-N 2.84Å; I445-L449 HydrophobicContact CG2-CD1 4.06Å; I445-L449 PolarHBondContact O-N 2.98Å |
| 446 | Q | 98.2 | Very high | 96.5 | Very high | 104 Ų | 104 | 57.2 Ų | 57.2 | 49% | 0.486 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -62.8 | -42.7 | 178 | -73.2 | 175 | -13.1 | 0 | 0 | 112.5 | V442 C443 K444 I448 L449 E450 | V442-Q446 HydrophobicContact CG1-CG 4.41Å; V442-Q446 WeakPolarHBondContact O-CG 3.34Å; V442-Q446 PolarHBondContact O-N 3.49Å; C443-Q446 PolarHBondContact O-N 3.04Å; K444-Q446 VanDerWaalsContact C-N 3.3Å; K444-Q446 PolarHBondContact O-N 3.22Å; Q446-I448 VanDerWaalsContact C-N 3.32Å; Q446-I448 PolarHBondContact O-N 3.08Å; Q446-L449 PolarHBondContact O-N 3.46Å; Q446-E450 PolarHBondContact O-N 2.77Å |
| 447 | A | 98.2 | Very high | 95.9 | Very high | 54 Ų | 54 | 61.5 Ų | 61.5 | 45% | 0.446 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -63.8 | -35.9 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | C443 K444 K451 | C443-A447 PolarHBondContact O-N 3.12Å; K444-A447 PolarHBondContact O-N 3.11Å; A447-K451 WeakPolarHBondContact O-CB 3.36Å; A447-K451 PolarHBondContact O-N 3.23Å |
| 448 | I | 97.8 | Very high | 95.9 | Very high | 1 Ų | 1 | 63.5 Ų | 63.5 | 1% | 0.005 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -71.4 | -38.7 | 176.7 | -60.9 | 158 | 0 | 0 | 0 | 111.1 | V390 E394 V397 L416 K444 I445 Q446 K451 L452 | V390-I448 HydrophobicContact CG1-CD1 3.4Å; V390-I448 VanDerWaalsContact CG1-CD1 3.4Å; E394-I448 HydrophobicContact CB-CD1 3.72Å; E394-I448 HydrophobicContact CB-CG1 4.07Å; E394-I448 HydrophobicContact CG-CD1 4.11Å; E394-I448 HydrophobicContact CG-CG1 4.03Å; V397-I448 HydrophobicContact CB-CG2 4.07Å; V397-I448 HydrophobicContact CG1-CG2 4.22Å; V397-I448 HydrophobicContact CG2-CG2 3.84Å; L416-I448 HydrophobicContact CD1-CG2 3.74Å; L416-I448 HydrophobicContact CD2-CB 4.19Å; L416-I448 HydrophobicContact CD2-CG2 3.79Å; L416-I448 HydrophobicContact CG-CG2 4.44Å; K444-I448 HydrophobicContact CD-CD1 4.48Å; K444-I448 HydrophobicContact CG-CD1 3.75Å; K444-I448 HydrophobicContact CG-CG1 4.49Å; K444-I448 WeakPolarHBondContact O-CD1 3.45Å; K444-I448 VanDerWaalsContact O-CG1 3.3Å; K444-I448 WeakPolarHBondContact O-CG1 3.47Å; K444-I448 PolarHBondContact O-N 3.26Å; I445-I448 PolarHBondContact O-N 2.84Å; Q446-I448 VanDerWaalsContact C-N 3.32Å; Q446-I448 PolarHBondContact O-N 3.08Å; I448-K451 WeakPolarHBondContact O-CB 3.5Å; I448-K451 PolarHBondContact O-N 2.98Å; I448-L452 WeakPolarHBondContact O-CB 3.26Å; I448-L452 PolarHBondContact O-N 3.49Å |
| 449 | L | 97.4 | Very high | 95.8 | Very high | 36 Ų | 36 | 63.4 Ų | 63.4 | 19% | 0.188 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -62.2 | -43.7 | 172.4 | -77.5 | 167.1 | 0 | 0 | 0 | 111.8 | E413 L416 T417 I445 Q446 K451 L452 E453 | E413-L449 HydrophobicContact CG-CD2 4.24Å; L416-L449 HydrophobicContact CB-CD1 4.42Å; L416-L449 HydrophobicContact CB-CD2 3.67Å; L416-L449 HydrophobicContact CB-CG 3.93Å; L416-L449 HydrophobicContact CD1-CD2 3.81Å; L416-L449 HydrophobicContact CD1-CG 4.11Å; L416-L449 HydrophobicContact CG-CD2 4.39Å; T417-L449 HydrophobicContact CG2-CD1 4.26Å; T417-L449 HydrophobicContact CG2-CD2 4.48Å; I445-L449 HydrophobicContact CG2-CD1 4.06Å; I445-L449 PolarHBondContact O-N 2.98Å; Q446-L449 PolarHBondContact O-N 3.46Å; L449-K451 VanDerWaalsContact C-N 3.31Å; L449-K451 PolarHBondContact O-N 3.19Å; L449-L452 PolarHBondContact O-N 3.48Å; L449-E453 PolarHBondContact O-N 3.04Å |
| 450 | E | 97.6 | Very high | 95.8 | Very high | 104 Ų | 104 | 59.7 Ų | 59.7 | 49% | 0.486 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -63.4 | -37 | 175.5 | -163.4 | -164.9 | 155.7 | 0 | 0 | 111.9 | Q446 K454 | Q446-E450 PolarHBondContact O-N 2.77Å; E450-K454 VanDerWaalsContact CD-NZ 3.32Å; E450-K454 WeakPolarHBondContact O-CD 3.34Å; E450-K454 VanDerWaalsContact O-CG 3.29Å; E450-K454 WeakPolarHBondContact O-CG 3.45Å; E450-K454 PolarHBondContact O-N 2.91Å; E450-K454 VanDerWaalsContact O-N 3.09Å; E450-K454 WeakPolarHBondContact OE1-CE 3.28Å; E450-K454 IonicContact OE1-NZ 2.61Å; E450-K454 PolarHBondContact OE1-NZ 3.06Å |
| 451 | K | 97.2 | Very high | 95.7 | Very high | 59 Ų | 59 | 56.8 Ų | 56.8 | 26% | 0.257 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -66.7 | -42 | 174.3 | -174.3 | -178.1 | -175.4 | 179.1 | 0 | 112.1 | V397 E398 A447 I448 L449 K454 K455 | V397-K451 HydrophobicContact CG1-CB 4.34Å; V397-K451 HydrophobicContact CG1-CD 4.18Å; V397-K451 HydrophobicContact CG1-CG 4.08Å; E398-K451 WeakPolarHBondContact OE1-CE 3.49Å; E398-K451 IonicContact OE1-NZ 2.63Å; E398-K451 PolarHBondContact OE1-NZ 2.81Å; E398-K451 WeakPolarHBondContact OE2-CE 3.41Å; E398-K451 IonicContact OE2-NZ 3.43Å; E398-K451 PolarHBondContact OE2-NZ 3.43Å; A447-K451 WeakPolarHBondContact O-CB 3.36Å; A447-K451 PolarHBondContact O-N 3.23Å; I448-K451 WeakPolarHBondContact O-CB 3.5Å; I448-K451 PolarHBondContact O-N 2.98Å; L449-K451 VanDerWaalsContact C-N 3.31Å; L449-K451 PolarHBondContact O-N 3.19Å; K451-K454 PolarHBondContact O-N 3.36Å; K451-K455 WeakPolarHBondContact O-CG 3.25Å; K451-K455 PolarHBondContact O-N 2.94Å; K451-K455 VanDerWaalsContact O-N 3.1Å |
| 452 | L | 97 | Very high | 95.6 | Very high | 0 Ų | 0 | 60.3 Ų | 60.3 | 0% | 0 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -63.6 | -44.4 | 175.3 | 175.9 | 57.1 | 0 | 0 | 0 | 111.2 | V397 F400 Y409 L412 E413 L416 I448 L449 K454 K455 G456 | V397-L452 HydrophobicContact CG1-CB 3.89Å; V397-L452 HydrophobicContact CG2-CB 4.08Å; V397-L452 HydrophobicContact CG2-CD1 4.24Å; V397-L452 HydrophobicContact CG2-CD2 4.27Å; V397-L452 HydrophobicContact CG2-CG 4.41Å; F400-L452 HydrophobicContact CD1-CD1 3.9Å; F400-L452 HydrophobicContact CE1-CD1 4.19Å; F400-L452 HydrophobicContact CG-CD1 4.2Å; Y409-L452 HydrophobicContact CD2-CD1 3.63Å; Y409-L452 HydrophobicContact CD2-CD2 4.5Å; Y409-L452 HydrophobicContact CD2-CG 3.82Å; Y409-L452 HydrophobicContact CE2-CD1 3.93Å; Y409-L452 HydrophobicContact CE2-CD2 4.34Å; Y409-L452 HydrophobicContact CE2-CG 3.6Å; Y409-L452 HydrophobicContact CG-CD1 4.45Å; L412-L452 HydrophobicContact CB-CD1 4.41Å; L412-L452 HydrophobicContact CB-CD2 3.62Å; L412-L452 HydrophobicContact CD1-CD1 4.15Å; E413-L452 HydrophobicContact CB-CD2 4.25Å; L416-L452 HydrophobicContact CD1-CD2 4.07Å; I448-L452 WeakPolarHBondContact O-CB 3.26Å; I448-L452 PolarHBondContact O-N 3.49Å; L449-L452 PolarHBondContact O-N 3.48Å; L452-K454 PolarHBondContact O-N 3.43Å; L452-K455 PolarHBondContact O-N 3.47Å; L452-G456 PolarHBondContact O-N 3.01Å; L452-G456 VanDerWaalsContact O-N 3.13Å |
| 453 | E | 95.4 | Very high | 95.4 | Very high | 92 Ų | 92 | 62.1 Ų | 62.1 | 43% | 0.43 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -57.8 | -49 | 174.4 | 173.2 | 159 | -122.5 | 0 | 0 | 111.8 | K404 L449 K455 G456 | K404-E453 IonicContact NZ-OE1 3.75Å; K404-E453 PolarHBondContact NZ-OE1 3.24Å; L449-E453 PolarHBondContact O-N 3.04Å; E453-K455 PolarHBondContact O-N 3.27Å; E453-G456 PolarHBondContact O-N 3.19Å; E453-G456 VanDerWaalsContact O-N 3.08Å |
| 454 | K | 95.5 | Very high | 95.2 | Very high | 127 Ų | 127 | 61.9 Ų | 61.9 | 55% | 0.552 | 31% | 0.306 | S | S | * | . | H | α-helix | trans | -59.7 | -31.4 | 177.7 | -72.8 | 166.4 | -174.9 | 167.6 | 0 | 113.4 | E450 K451 L452 | E450-K454 VanDerWaalsContact CD-NZ 3.32Å; E450-K454 WeakPolarHBondContact O-CD 3.34Å; E450-K454 VanDerWaalsContact O-CG 3.29Å; E450-K454 WeakPolarHBondContact O-CG 3.45Å; E450-K454 PolarHBondContact O-N 2.91Å; E450-K454 VanDerWaalsContact O-N 3.09Å; E450-K454 WeakPolarHBondContact OE1-CE 3.28Å; E450-K454 IonicContact OE1-NZ 2.61Å; E450-K454 PolarHBondContact OE1-NZ 3.06Å; K451-K454 PolarHBondContact O-N 3.36Å; L452-K454 PolarHBondContact O-N 3.43Å |
| 455 | K | 92.8 | Very high | 95 | Very high | 60 Ų | 60 | 62.7 Ų | 62.7 | 26% | 0.261 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -82 | -13.7 | 177.5 | -78.8 | 178.2 | 137.3 | -125.6 | 0 | 114.3 | V397 E398 F400 G402 K451 L452 E453 | V397-K455 HydrophobicContact CG1-CD 4.43Å; V397-K455 WeakPolarHBondContact O-CD 3.47Å; V397-K455 VanDerWaalsContact O-CE 3.31Å; V397-K455 WeakPolarHBondContact O-CE 3.42Å; V397-K455 PolarHBondContact O-NZ 3.2Å; E398-K455 VanDerWaalsContact C-NZ 3.27Å; E398-K455 PolarHBondContact O-NZ 3.36Å; E398-K455 IonicContact OE1-NZ 2.67Å; F400-K455 HydrophobicContact CD1-CB 4.15Å; F400-K455 PolarHBondContact O-NZ 3.05Å; G402-K455 VanDerWaalsContact O-O 3.09Å; K451-K455 WeakPolarHBondContact O-CG 3.25Å; K451-K455 PolarHBondContact O-N 2.94Å; K451-K455 VanDerWaalsContact O-N 3.1Å; L452-K455 PolarHBondContact O-N 3.47Å; E453-K455 PolarHBondContact O-N 3.27Å |
| 456 | G | 87.5 | Confident | 94.8 | Very high | 2 Ų | 2 | 67.9 Ų | 67.9 | 2% | 0.021 | 34% | 0.338 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -94.1 | 3.6 | -177.9 | 0 | 0 | 0 | 0 | 0 | 115.9 | K403 K404 L452 E453 | K403-G456 CarbonylContact C-O 3.46Å; K403-G456 VanDerWaalsContact CA-O 3.25Å; K403-G456 WeakPolarHBondContact CA-O 3.4Å; K404-G456 WeakPolarHBondContact CG-O 3.37Å; K404-G456 PolarHBondContact N-O 3.32Å; L452-G456 PolarHBondContact O-N 3.01Å; L452-G456 VanDerWaalsContact O-N 3.13Å; E453-G456 PolarHBondContact O-N 3.19Å; E453-G456 VanDerWaalsContact O-N 3.08Å |
| 457 | L | 83.3 | Confident | 94.5 | Very high | 176 Ų | 176 | 64.6 Ų | 64.6 | 92% | 0.921 | 32% | 0.324 | S | S | * | . | trans | -73.2 | 0 | -173.3 | -62.7 | 175.3 | 0 | 0 | 0 | 113.8 |
Retrieved 457 of 457 residues in 88.6 ms
(Link to these results)