| 1 | M | 56.4 | Low | 70 | Confident | 234 Ų | 234 | 169 Ų | 169 | 100% | 1.153 | 84% | 0.84 | S | S | * | * | | | | 0 | 131.2 | 0 | -62.3 | -170.2 | 94.5 | 0 | 0 | 109.2 | | |
| 2 | P | 68.9 | Low | 70.2 | Confident | 132 Ų | 132 | 168.8 Ų | 168.8 | 86% | 0.857 | 84% | 0.843 | S | S | * | * | P | Polyproline II helix | trans | -68.5 | 138 | 174.9 | -13.4 | 28.5 | 0 | 0 | 0 | 110.3 | | |
| 3 | R | 71.2 | Confident | 70.4 | Confident | 234 Ų | 234 | 169.4 Ų | 169.4 | 88% | 0.883 | 84% | 0.842 | S | S | * | * | P | Polyproline II helix | trans | -67.9 | 138.6 | 179 | -62.4 | -176.6 | -163.6 | -170.1 | 4.5 | 109.8 | K5 | R3-K5 PolarHBondContact O-N 2.85Š|
| 4 | P | 76 | Confident | 70.6 | Confident | 121 Ų | 121 | 168.9 Ų | 168.9 | 79% | 0.786 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -61.4 | 130 | 174.5 | 24.1 | -31.2 | 0 | 0 | 0 | 109.8 | K6 | P4-K6 PolarHBondContact O-N 2.9Š|
| 5 | K | 74.8 | Confident | 70.6 | Confident | 204 Ų | 204 | 169.5 Ų | 169.5 | 89% | 0.887 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -59.4 | 124.8 | 171.4 | -69.9 | 179.9 | 179.1 | 178.1 | 0 | 107.5 | R3 | R3-K5 PolarHBondContact O-N 2.85Š|
| 6 | K | 73 | Confident | 70.3 | Confident | 193 Ų | 193 | 167.4 Ų | 167.4 | 84% | 0.839 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -58.2 | 135.5 | 173.1 | -73.1 | -179.8 | 179 | 179 | 0 | 107.8 | P4 N8 | P4-K6 PolarHBondContact O-N 2.9Å; K6-N8 PolarHBondContact O-N 2.87Å |
| 7 | P | 70.4 | Confident | 70.1 | Confident | 102 Ų | 102 | 163.2 Ų | 163.2 | 66% | 0.662 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -55.5 | 132.2 | 174 | 23.3 | -31.6 | 0 | 0 | 0 | 107.9 | R9 | P7-R9 PolarHBondContact O-N 3.16Š|
| 8 | N | 69.2 | Low | 69.6 | Low | 162 Ų | 162 | 158.8 Ų | 158.8 | 87% | 0.866 | 80% | 0.799 | S | S | * | * | | | trans | -68.9 | 73.5 | 178.7 | -144.2 | 11.2 | 0 | 0 | 0 | 107.6 | K6 L10 | K6-N8 PolarHBondContact O-N 2.87Å; N8-L10 PolarHBondContact O-N 2.93Å |
| 9 | R | 63.6 | Low | 69.3 | Low | 221 Ų | 221 | 160.2 Ų | 160.2 | 83% | 0.834 | 80% | 0.8 | S | S | * | * | | | trans | -73.4 | 108.6 | 173 | -82.5 | -171.9 | 176.7 | 174.8 | -0.9 | 106 | P7 | P7-R9 PolarHBondContact O-N 3.16Š|
| 10 | L | 73 | Confident | 69 | Low | 148 Ų | 148 | 156.2 Ų | 156.2 | 78% | 0.775 | 79% | 0.788 | S | S | * | * | | | trans | -52 | 140.9 | 165.2 | -66.4 | 171.7 | 0 | 0 | 0 | 108.3 | N8 L12 | N8-L10 PolarHBondContact O-N 2.93Å; L10-L12 PolarHBondContact O-N 3.12Å |
| 11 | P | 73.9 | Confident | 68.7 | Low | 108 Ų | 108 | 157.7 Ų | 157.7 | 70% | 0.701 | 79% | 0.789 | S | S | * | * | | | trans | -51.3 | 135.8 | 171.5 | -21.9 | 31.8 | 0 | 0 | 0 | 109.5 | E13 | P11-E13 PolarHBondContact O-N 2.81Š|
| 12 | L | 71.7 | Confident | 68.8 | Low | 167 Ų | 167 | 150.7 Ų | 150.7 | 87% | 0.874 | 76% | 0.761 | S | S | * | * | | | trans | -64.3 | 106.6 | 169.6 | -90.3 | 139.5 | 0 | 0 | 0 | 107.7 | L10 | L10-L12 PolarHBondContact O-N 3.12Š|
| 13 | E | 73.1 | Confident | 68.4 | Low | 176 Ų | 176 | 154.9 Ų | 154.9 | 82% | 0.822 | 77% | 0.766 | S | S | * | * | | | trans | -82.3 | 127.9 | 170.6 | -68.7 | -169.4 | 172.8 | 0 | 0 | 109.2 | P11 M15 | P11-E13 PolarHBondContact O-N 2.81Å; E13-M15 PolarHBondContact O-N 3.01Å |
| 14 | F | 72.9 | Confident | 67.8 | Low | 162 Ų | 162 | 147.1 Ų | 147.1 | 71% | 0.711 | 76% | 0.759 | S | S | * | * | | | trans | -75.3 | 119.3 | 170.9 | -68 | -86.2 | 0 | 0 | 0 | 108.2 | N16 | F14-N16 PolarHBondContact O-N 2.95Š|
| 15 | M | 71 | Confident | 66.9 | Low | 178 Ų | 178 | 148.5 Ų | 148.5 | 88% | 0.877 | 76% | 0.755 | S | S | * | * | S | Bend | trans | -55.5 | -34.6 | 174.7 | -71.9 | -100.6 | 70.6 | 0 | 0 | 111.9 | E13 | E13-M15 PolarHBondContact O-N 3.01Š|
| 16 | N | 66.3 | Low | 65.9 | Low | 136 Ų | 136 | 143.4 Ų | 143.4 | 73% | 0.727 | 74% | 0.741 | S | S | * | * | S | Bend | trans | -123 | 124.1 | 176 | -64.4 | -39.7 | 0 | 0 | 0 | 109.1 | F14 P18 | F14-N16 PolarHBondContact O-N 2.95Å; N16-P18 VanDerWaalsContact O-CD 3.24Å; N16-P18 WeakPolarHBondContact O-CD 3.31Å |
| 17 | V | 66.4 | Low | 65 | Low | 97 Ų | 97 | 140.2 Ų | 140.2 | 59% | 0.588 | 74% | 0.737 | S | S | * | * | | | trans | -64.4 | 115.7 | 171.6 | 179.8 | 0 | 0 | 0 | 0 | 107 | F19 S20 | V17-F19 PolarHBondContact O-N 3.03Å; V17-S20 PolarHBondContact O-N 2.84Å; V17-S20 VanDerWaalsContact O-N 3.12Å; V17-S20 PolarHBondContact O-OG 2.88Å |
| 18 | P | 61.1 | Low | 64 | Low | 84 Ų | 84 | 144.3 Ų | 144.3 | 55% | 0.545 | 74% | 0.741 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -63.9 | -0.7 | -169.7 | 19.8 | -29.1 | 0 | 0 | 0 | 114.9 | N16 | N16-P18 VanDerWaalsContact O-CD 3.24Å; N16-P18 WeakPolarHBondContact O-CD 3.31Å |
| 19 | F | 64.1 | Low | 63.2 | Low | 184 Ų | 184 | 145.6 Ų | 145.6 | 81% | 0.807 | 74% | 0.739 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -140.8 | 20.7 | -177.8 | -50.8 | -72 | 0 | 0 | 0 | 112.8 | V17 K21 | V17-F19 PolarHBondContact O-N 3.03Å; F19-K21 PolarHBondContact O-N 3.24Å |
| 20 | S | 63.8 | Low | 62.7 | Low | 81 Ų | 81 | 140.9 Ų | 140.9 | 57% | 0.566 | 74% | 0.735 | S | S | * | * | P | Polyproline II helix | trans | -65.4 | 124.2 | 169.4 | 52.5 | 0 | 0 | 0 | 0 | 108.6 | V17 | V17-S20 PolarHBondContact O-N 2.84Å; V17-S20 VanDerWaalsContact O-N 3.12Å; V17-S20 PolarHBondContact O-OG 2.88Å |
| 21 | K | 61.5 | Low | 61.7 | Low | 187 Ų | 187 | 139.1 Ų | 139.1 | 81% | 0.813 | 73% | 0.733 | S | S | * | * | P | Polyproline II helix | trans | -56.8 | 132.3 | 171.6 | -69.4 | -178.5 | -179 | 178.7 | 0 | 107.6 | F19 K23 | F19-K21 PolarHBondContact O-N 3.24Å; K21-K23 PolarHBondContact O-N 3.4Å; K21-K23 VanDerWaalsContact O-N 3.15Å |
| 22 | P | 59.2 | Low | 60.6 | Low | 87 Ų | 87 | 136.4 Ų | 136.4 | 57% | 0.565 | 72% | 0.717 | S | S | * | * | P | Polyproline II helix | trans | -53.8 | 126.3 | 176.5 | 20.4 | -30.4 | 0 | 0 | 0 | 108.7 | G24 E25 | P22-G24 PolarHBondContact O-N 2.86Å; P22-E25 HydrophobicContact CB-CB 4.48Å |
| 23 | K | 60.5 | Low | 60 | Low | 221 Ų | 221 | 137.7 Ų | 137.7 | 96% | 0.961 | 72% | 0.719 | S | S | * | * | S | Bend | trans | -70 | 97.6 | 174.7 | -72.1 | -177.4 | 179.9 | 178.1 | 0 | 107.2 | K21 | K21-K23 PolarHBondContact O-N 3.4Å; K21-K23 VanDerWaalsContact O-N 3.15Å |
| 24 | G | 58.8 | Low | 59.5 | Low | 71 Ų | 71 | 135.2 Ų | 135.2 | 73% | 0.732 | 72% | 0.715 | S | S | * | * | S | Bend | trans | 99.1 | 9 | 161.1 | 0 | 0 | 0 | 0 | 0 | 117.7 | P22 T26 | P22-G24 PolarHBondContact O-N 2.86Å; G24-T26 PolarHBondContact O-N 2.94Å; G24-T26 VanDerWaalsContact O-N 3.1Å |
| 25 | E | 55.8 | Low | 58.4 | Low | 149 Ų | 149 | 136.4 Ų | 136.4 | 70% | 0.696 | 72% | 0.716 | S | S | * | * | | | trans | -76 | 105 | 166.6 | -103.3 | 176.1 | 166 | 0 | 0 | 109 | P22 V27 | P22-E25 HydrophobicContact CB-CB 4.48Å; E25-V27 VanDerWaalsContact C-N 3.3Å; E25-V27 PolarHBondContact O-N 3.42Å |
| 26 | T | 54.9 | Low | 57.9 | Low | 97 Ų | 97 | 133.3 Ų | 133.3 | 60% | 0.595 | 71% | 0.71 | S | S | * | * | | | trans | -50.2 | 102.1 | 158.6 | 33.4 | 0 | 0 | 0 | 0 | 107 | G24 Y28 | G24-T26 PolarHBondContact O-N 2.94Å; G24-T26 VanDerWaalsContact O-N 3.1Å; T26-Y28 WeakPolarHBondContact O-CD2 3.38Å; T26-Y28 PolarHBondContact O-N 3.33Å |
| 27 | V | 53.2 | Low | 57.7 | Low | 126 Ų | 126 | 135.4 Ų | 135.4 | 76% | 0.764 | 72% | 0.715 | S | S | * | * | | | trans | -64.9 | 93.6 | 175.5 | -178.9 | 0 | 0 | 0 | 0 | 106.2 | E25 K29 | E25-V27 VanDerWaalsContact C-N 3.3Å; E25-V27 PolarHBondContact O-N 3.42Å; V27-K29 PolarHBondContact O-N 3.23Å |
| 28 | Y | 49.3 | Very low | 57.5 | Low | 188 Ų | 188 | 137 Ų | 137 | 74% | 0.737 | 73% | 0.725 | S | S | * | * | | | trans | -60.1 | 107.7 | 169.2 | -66.3 | -81.9 | 0 | 0 | 0 | 106.1 | T26 T30 | T26-Y28 WeakPolarHBondContact O-CD2 3.38Å; T26-Y28 PolarHBondContact O-N 3.33Å; Y28-T30 PolarHBondContact O-N 2.89Å |
| 29 | K | 53.9 | Low | 57.7 | Low | 190 Ų | 190 | 142 Ų | 142 | 83% | 0.826 | 74% | 0.738 | S | S | * | * | | | trans | -66 | 93.6 | 167.5 | -74.3 | -173.2 | 179.2 | -178.6 | 0 | 106.1 | V27 C31 | V27-K29 PolarHBondContact O-N 3.23Å; K29-C31 VanDerWaalsContact C-N 3.26Å; K29-C31 PolarHBondContact O-N 2.93Å |
| 30 | T | 51.3 | Low | 57.5 | Low | 121 Ų | 121 | 144.4 Ų | 144.4 | 74% | 0.742 | 74% | 0.742 | S | S | * | * | | | trans | -66.6 | 97.8 | 162.2 | 46.3 | 0 | 0 | 0 | 0 | 105.8 | Y28 S32 | Y28-T30 PolarHBondContact O-N 2.89Å; T30-S32 PolarHBondContact O-N 3Å |
| 31 | C | 52.9 | Low | 57.4 | Low | 111 Ų | 111 | 143.6 Ų | 143.6 | 75% | 0.75 | 74% | 0.739 | S | S | * | * | | | trans | -64.7 | 80.5 | 161 | -65.4 | 0 | 0 | 0 | 0 | 105.7 | K29 E33 | K29-C31 VanDerWaalsContact C-N 3.26Å; K29-C31 PolarHBondContact O-N 2.93Å; C31-E33 PolarHBondContact O-N 3.08Å |
| 32 | S | 51.8 | Low | 57.5 | Low | 52 Ų | 52 | 138.9 Ų | 138.9 | 36% | 0.364 | 73% | 0.728 | S | S | . | * | | | trans | -66.6 | 104.9 | 172.2 | 58.4 | 0 | 0 | 0 | 0 | 106.4 | T30 V34 Y35 | T30-S32 PolarHBondContact O-N 3Å; S32-V34 PolarHBondContact O-N 3.1Å; S32-Y35 WeakPolarHBondContact OG-CD2 3.46Å; S32-Y35 WeakPolarHBondContact OG-CE2 3.43Å |
| 33 | E | 57.4 | Low | 57.8 | Low | 194 Ų | 194 | 140.4 Ų | 140.4 | 91% | 0.907 | 74% | 0.736 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.9 | 2.6 | 164.4 | -62.8 | 178.1 | 169.7 | 0 | 0 | 112.1 | C31 | C31-E33 PolarHBondContact O-N 3.08Š|
| 34 | V | 63.3 | Low | 58 | Low | 123 Ų | 123 | 137.2 Ų | 137.2 | 75% | 0.745 | 73% | 0.729 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108.1 | 24.1 | -170.5 | -157.1 | 0 | 0 | 0 | 0 | 112.6 | S32 | S32-V34 PolarHBondContact O-N 3.1Š|
| 35 | Y | 50.3 | Low | 58.3 | Low | 188 Ų | 188 | 139 Ų | 139 | 74% | 0.737 | 72% | 0.722 | S | S | * | * | S | Bend | trans | -105.8 | 117.8 | 159 | -71.6 | -69.3 | 0 | 0 | 0 | 108.2 | S32 E37 | S32-Y35 WeakPolarHBondContact OG-CD2 3.46Å; S32-Y35 WeakPolarHBondContact OG-CE2 3.43Å; Y35-E37 PolarHBondContact O-N 3.34Å; Y35-E37 VanDerWaalsContact O-N 3.09Å |
| 36 | P | 59.1 | Low | 58.9 | Low | 113 Ų | 113 | 135.6 Ų | 135.6 | 73% | 0.734 | 72% | 0.719 | S | S | * | * | | | trans | -56 | 124.8 | 167.9 | 24.6 | -31.1 | 0 | 0 | 0 | 106.6 | V38 | P36-V38 PolarHBondContact O-N 3.02Š|
| 37 | E | 62.5 | Low | 59.6 | Low | 180 Ų | 180 | 138.9 Ų | 138.9 | 84% | 0.841 | 72% | 0.722 | S | S | * | * | | | trans | -51.8 | 108.7 | 178 | -162.9 | 175.3 | -151.8 | 0 | 0 | 107.9 | Y35 K39 | Y35-E37 PolarHBondContact O-N 3.34Å; Y35-E37 VanDerWaalsContact O-N 3.09Å; E37-K39 VanDerWaalsContact C-N 3.33Å; E37-K39 PolarHBondContact O-N 3.4Å |
| 38 | V | 62.3 | Low | 60.6 | Low | 130 Ų | 130 | 141.1 Ų | 141.1 | 79% | 0.788 | 72% | 0.722 | S | S | * | * | | | trans | -69.9 | 98.5 | -179.2 | -178.3 | 0 | 0 | 0 | 0 | 105.8 | P36 R40 | P36-V38 PolarHBondContact O-N 3.02Å; V38-R40 PolarHBondContact O-N 2.96Å |
| 39 | K | 66.1 | Low | 61.7 | Low | 189 Ų | 189 | 143.2 Ų | 143.2 | 82% | 0.822 | 73% | 0.728 | S | S | * | * | | | trans | -55.9 | 109 | 170.5 | -67.6 | -164.1 | 177 | -172.8 | 0 | 106.9 | E37 A41 | E37-K39 VanDerWaalsContact C-N 3.33Å; E37-K39 PolarHBondContact O-N 3.4Å; K39-A41 PolarHBondContact O-N 2.94Å |
| 40 | R | 59.2 | Low | 62.9 | Low | 235 Ų | 235 | 143.3 Ų | 143.3 | 89% | 0.887 | 73% | 0.729 | S | S | * | * | P | Polyproline II helix | trans | -61.3 | 121.9 | 169.9 | -69.5 | -174.9 | 178.7 | 161.3 | 0.5 | 106.3 | V38 | V38-R40 PolarHBondContact O-N 2.96Š|
| 41 | A | 62.2 | Low | 64 | Low | 63 Ų | 63 | 145.7 Ų | 145.7 | 52% | 0.521 | 73% | 0.732 | S | S | . | * | P | Polyproline II helix | trans | -55.9 | 139 | 168.7 | 0 | 0 | 0 | 0 | 0 | 107.9 | K39 T43 | K39-A41 PolarHBondContact O-N 2.94Å; A41-T43 PolarHBondContact O-N 3.49Å |
| 42 | P | 64.5 | Low | 65 | Low | 88 Ų | 88 | 145 Ų | 145 | 57% | 0.571 | 73% | 0.726 | S | S | * | * | P | Polyproline II helix | trans | -55.2 | 117 | 176.2 | 22.4 | -32 | 0 | 0 | 0 | 108.8 | N44 D45 | P42-N44 PolarHBondContact O-N 3.1Å; P42-D45 PolarHBondContact O-N 3.48Å |
| 43 | T | 63.6 | Low | 66.2 | Low | 120 Ų | 120 | 148.1 Ų | 148.1 | 74% | 0.736 | 75% | 0.746 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.3 | -6.8 | -178.8 | -37.8 | 0 | 0 | 0 | 0 | 113.1 | A41 D45 | A41-T43 PolarHBondContact O-N 3.49Å; T43-D45 VanDerWaalsContact C-N 3.31Å; T43-D45 PolarHBondContact O-N 3.44Å |
| 44 | N | 65.8 | Low | 67.1 | Low | 154 Ų | 154 | 147 Ų | 147 | 82% | 0.824 | 74% | 0.739 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.3 | -10.4 | -179 | -83.1 | -2.5 | 0 | 0 | 0 | 114.2 | P42 A46 | P42-N44 PolarHBondContact O-N 3.1Å; N44-A46 PolarHBondContact O-N 2.95Å |
| 45 | D | 64.7 | Low | 67.8 | Low | 109 Ų | 109 | 148.4 Ų | 148.4 | 58% | 0.583 | 74% | 0.742 | S | S | * | * | S | Bend | trans | -70.9 | 103.3 | 172.4 | -70.5 | -13.2 | 0 | 0 | 0 | 108 | P42 T43 Y47 | P42-D45 PolarHBondContact O-N 3.48Å; T43-D45 VanDerWaalsContact C-N 3.31Å; T43-D45 PolarHBondContact O-N 3.44Å; D45-Y47 WeakPolarHBondContact O-CD2 3.35Å; D45-Y47 PolarHBondContact O-N 2.99Å |
| 46 | A | 67.9 | Low | 68.8 | Low | 76 Ų | 76 | 145.2 Ų | 145.2 | 63% | 0.628 | 74% | 0.742 | S | S | * | * | | | trans | -54.4 | 108.5 | 173.7 | 0 | 0 | 0 | 0 | 0 | 108.7 | N44 F48 | N44-A46 PolarHBondContact O-N 2.95Å; A46-F48 HydrophobicContact CB-CE2 4.38Å; A46-F48 WeakPolarHBondContact O-CD2 3.25Å; A46-F48 PolarHBondContact O-N 2.88Å; A46-F48 VanDerWaalsContact O-N 3.1Å |
| 47 | Y | 70 | Confident | 69.4 | Low | 166 Ų | 166 | 145.7 Ų | 145.7 | 65% | 0.651 | 74% | 0.743 | S | S | * | * | | | trans | -67.2 | 110.2 | 177.1 | -62.9 | -82.4 | 0 | 0 | 0 | 108.9 | D45 | D45-Y47 WeakPolarHBondContact O-CD2 3.35Å; D45-Y47 PolarHBondContact O-N 2.99Å |
| 48 | F | 74.6 | Confident | 69.9 | Low | 174 Ų | 174 | 145.8 Ų | 145.8 | 76% | 0.763 | 74% | 0.741 | S | S | * | * | | | trans | -84.2 | 110.8 | 166.4 | -73.7 | -86.3 | 0 | 0 | 0 | 108.5 | A46 F50 | A46-F48 HydrophobicContact CB-CE2 4.38Å; A46-F48 WeakPolarHBondContact O-CD2 3.25Å; A46-F48 PolarHBondContact O-N 2.88Å; A46-F48 VanDerWaalsContact O-N 3.1Å; F48-F50 PolarHBondContact O-N 2.75Å |
| 49 | W | 73.1 | Confident | 70.2 | Confident | 232 Ų | 232 | 145.4 Ų | 145.4 | 88% | 0.879 | 74% | 0.738 | S | S | * | * | | | trans | -76.8 | 119.5 | 166.9 | -70.2 | 97 | 0 | 0 | 0 | 108.5 | E51 | W49-E51 PolarHBondContact O-N 2.91Š|
| 50 | F | 78 | Confident | 70.1 | Confident | 192 Ų | 192 | 144.8 Ų | 144.8 | 84% | 0.842 | 74% | 0.738 | S | S | * | * | | | trans | -76.9 | 111.5 | 170 | -68.1 | -84.7 | 0 | 0 | 0 | 108.3 | F48 P52 | F48-F50 PolarHBondContact O-N 2.75Å; F50-P52 WeakPolarHBondContact O-CD 3.12Å |
| 51 | E | 75.4 | Confident | 70.4 | Confident | 171 Ų | 171 | 142.7 Ų | 142.7 | 80% | 0.799 | 74% | 0.736 | S | S | * | * | | | trans | -75.1 | 119.3 | 165.5 | -70.4 | -171.4 | 168.2 | 0 | 0 | 108.5 | W49 C53 | W49-E51 PolarHBondContact O-N 2.91Å; E51-C53 PolarHBondContact O-N 3.33Å |
| 52 | P | 74.1 | Confident | 70.6 | Confident | 96 Ų | 96 | 148.9 Ų | 148.9 | 62% | 0.623 | 75% | 0.751 | S | S | * | * | | | trans | -68.9 | 106.5 | 178.3 | 25.3 | -29.6 | 0 | 0 | 0 | 109.9 | F50 F54 | F50-P52 WeakPolarHBondContact O-CD 3.12Å; P52-F54 HydrophobicContact CB-CD2 4.49Å; P52-F54 HydrophobicContact CB-CE2 3.73Å; P52-F54 HydrophobicContact CB-CZ 3.86Å; P52-F54 HydrophobicContact CG-CE2 3.98Å; P52-F54 HydrophobicContact CG-CZ 4.37Å; P52-F54 WeakPolarHBondContact O-CD2 3.04Å; P52-F54 PolarHBondContact O-N 2.91Å |
| 53 | C | 75.5 | Confident | 70.2 | Confident | 117 Ų | 117 | 155.7 Ų | 155.7 | 79% | 0.791 | 77% | 0.765 | S | S | * | * | | | trans | -80 | 109.4 | 171.9 | -62.4 | 0 | 0 | 0 | 0 | 110 | E51 | E51-C53 PolarHBondContact O-N 3.33Š|
| 54 | F | 76.6 | Confident | 69.8 | Low | 171 Ų | 171 | 154.3 Ų | 154.3 | 75% | 0.75 | 76% | 0.76 | S | S | * | * | | | trans | -94.1 | 115.8 | 171.4 | -59.3 | -79.4 | 0 | 0 | 0 | 110 | P52 T56 | P52-F54 HydrophobicContact CB-CD2 4.49Å; P52-F54 HydrophobicContact CB-CE2 3.73Å; P52-F54 HydrophobicContact CB-CZ 3.86Å; P52-F54 HydrophobicContact CG-CE2 3.98Å; P52-F54 HydrophobicContact CG-CZ 4.37Å; P52-F54 WeakPolarHBondContact O-CD2 3.04Å; P52-F54 PolarHBondContact O-N 2.91Å; F54-T56 PolarHBondContact O-N 2.88Å |
| 55 | N | 78.1 | Confident | 69.1 | Low | 152 Ų | 152 | 152.8 Ų | 152.8 | 81% | 0.813 | 76% | 0.757 | S | S | * | * | | | trans | -75.8 | 113.6 | 168.8 | -70.3 | -24 | 0 | 0 | 0 | 108.8 | V57 | N55-V57 PolarHBondContact O-N 2.82Š|
| 56 | T | 71.9 | Confident | 68.6 | Low | 121 Ų | 121 | 153.8 Ų | 153.8 | 74% | 0.742 | 76% | 0.762 | S | S | * | * | | | trans | -80.7 | 100.2 | 170.7 | 55.1 | 0 | 0 | 0 | 0 | 108.9 | F54 K58 | F54-T56 PolarHBondContact O-N 2.88Å; T56-K58 PolarHBondContact O-N 3.07Å; T56-K58 VanDerWaalsContact O-N 3.16Å |
| 57 | V | 71.7 | Confident | 67.3 | Low | 124 Ų | 124 | 162 Ų | 162 | 75% | 0.752 | 78% | 0.777 | S | S | * | * | | | trans | -72.1 | 109.6 | 168.2 | -175.8 | 0 | 0 | 0 | 0 | 107 | N55 V59 | N55-V57 PolarHBondContact O-N 2.82Å; V57-V59 VanDerWaalsContact C-N 3.33Å; V57-V59 PolarHBondContact O-N 3.03Å |
| 58 | K | 72.7 | Confident | 66.2 | Low | 181 Ų | 181 | 159.3 Ų | 159.3 | 79% | 0.787 | 78% | 0.783 | S | S | * | * | | | trans | -66 | 95.6 | 169.3 | -66.1 | -83.1 | -176.3 | 173.8 | 0 | 107.3 | T56 E60 | T56-K58 PolarHBondContact O-N 3.07Å; T56-K58 VanDerWaalsContact O-N 3.16Å; K58-E60 PolarHBondContact O-N 3.02Å; K58-E60 VanDerWaalsContact O-N 3.12Å |
| 59 | V | 68.9 | Low | 64.8 | Low | 123 Ų | 123 | 155.5 Ų | 155.5 | 75% | 0.745 | 78% | 0.783 | S | S | * | * | | | trans | -73 | 103.7 | 166.2 | -179.3 | 0 | 0 | 0 | 0 | 106.2 | V57 K61 | V57-V59 VanDerWaalsContact C-N 3.33Å; V57-V59 PolarHBondContact O-N 3.03Å; V59-K61 PolarHBondContact O-N 3.04Å |
| 60 | E | 63.9 | Low | 63.3 | Low | 175 Ų | 175 | 150 Ų | 150 | 82% | 0.818 | 78% | 0.78 | S | S | * | * | | | trans | -63.3 | 89.5 | 168.6 | -70.8 | -167.1 | 167.8 | 0 | 0 | 108.7 | K58 K62 | K58-E60 PolarHBondContact O-N 3.02Å; K58-E60 VanDerWaalsContact O-N 3.12Å; E60-K62 VanDerWaalsContact C-N 3.35Å; E60-K62 PolarHBondContact O-N 3.03Å |
| 61 | K | 66.1 | Low | 61.6 | Low | 192 Ų | 192 | 145.6 Ų | 145.6 | 84% | 0.835 | 77% | 0.773 | S | S | * | * | | | trans | -71.2 | 95.4 | 172.3 | -169.4 | 171.1 | -176.7 | 172.5 | 0 | 107.3 | V59 R63 | V59-K61 PolarHBondContact O-N 3.04Å; K61-R63 PolarHBondContact O-N 3.19Å |
| 62 | K | 65.1 | Low | 60.1 | Low | 193 Ų | 193 | 141.6 Ų | 141.6 | 84% | 0.839 | 77% | 0.77 | S | S | * | * | | | trans | -53.1 | 115.1 | 166.2 | -79.3 | -155.1 | 176.3 | -176.1 | 0 | 108 | E60 S64 | E60-K62 VanDerWaalsContact C-N 3.35Å; E60-K62 PolarHBondContact O-N 3.03Å; K62-S64 PolarHBondContact O-N 2.78Å |
| 63 | R | 56.5 | Low | 58.8 | Low | 230 Ų | 230 | 148.2 Ų | 148.2 | 87% | 0.868 | 78% | 0.782 | S | S | * | * | | | trans | -67.1 | 100.9 | 179.1 | -168.3 | 178.2 | -171.7 | 175 | 2.1 | 107.6 | K61 T65 | K61-R63 PolarHBondContact O-N 3.19Å; R63-T65 PolarHBondContact O-N 2.86Å |
| 64 | S | 55.8 | Low | 57.5 | Low | 91 Ų | 91 | 151.5 Ų | 151.5 | 64% | 0.636 | 79% | 0.786 | S | S | * | * | | | trans | -68.6 | 115.9 | 169 | 62.3 | 0 | 0 | 0 | 0 | 108.2 | K62 N66 | K62-S64 PolarHBondContact O-N 2.78Å; S64-N66 PolarHBondContact O-N 3.37Å |
| 65 | T | 51.3 | Low | 56.2 | Low | 123 Ų | 123 | 151.5 Ų | 151.5 | 76% | 0.755 | 79% | 0.788 | S | S | * | * | | | trans | -73.2 | 59.4 | 176.1 | -47.4 | 0 | 0 | 0 | 0 | 110.7 | R63 | R63-T65 PolarHBondContact O-N 2.86Š|
| 66 | N | 53.3 | Low | 54.7 | Low | 130 Ų | 130 | 151.9 Ų | 151.9 | 70% | 0.695 | 79% | 0.789 | S | S | * | * | | | trans | -102.4 | 105.8 | 167.9 | -71.2 | -18.1 | 0 | 0 | 0 | 107.2 | S64 S68 | S64-N66 PolarHBondContact O-N 3.37Å; N66-S68 PolarHBondContact O-N 2.9Å |
| 67 | R | 40.9 | Very low | 53.9 | Low | 247 Ų | 247 | 151.3 Ų | 151.3 | 93% | 0.932 | 79% | 0.788 | S | S | * | * | | | trans | -68.9 | 77.4 | 168.5 | -64.7 | -177.6 | -164.6 | -171.7 | 4.3 | 107.9 | | |
| 68 | S | 47.2 | Very low | 53 | Low | 111 Ų | 111 | 153.3 Ų | 153.3 | 78% | 0.776 | 79% | 0.789 | S | S | * | * | | | trans | -95.1 | 117.1 | 163.5 | -72.3 | 0 | 0 | 0 | 0 | 107.6 | N66 | N66-S68 PolarHBondContact O-N 2.9Š|
| 69 | A | 44.8 | Very low | 52.1 | Low | 93 Ų | 93 | 151.1 Ų | 151.1 | 77% | 0.769 | 79% | 0.785 | S | S | * | * | | | trans | -51.8 | 148.3 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | S71 | A69-S71 PolarHBondContact O-N 2.95Š|
| 70 | S | 41.1 | Very low | 51.5 | Low | 117 Ų | 117 | 153 Ų | 153 | 82% | 0.818 | 79% | 0.785 | S | S | * | * | | | trans | -27.5 | 122 | 173.8 | 53.2 | 0 | 0 | 0 | 0 | 115.7 | | |
| 71 | S | 43.5 | Very low | 50.9 | Low | 99 Ų | 99 | 153.2 Ų | 153.2 | 69% | 0.692 | 78% | 0.784 | S | S | * | * | | | trans | -127 | 98.9 | 139.6 | -174.9 | 0 | 0 | 0 | 0 | 107.6 | A69 | A69-S71 PolarHBondContact O-N 2.95Š|
| 72 | A | 43.4 | Very low | 50.2 | Low | 88 Ų | 88 | 150.8 Ų | 150.8 | 73% | 0.727 | 78% | 0.78 | S | S | * | * | | | trans | -66.9 | 139.7 | 168.1 | 0 | 0 | 0 | 0 | 0 | 108.3 | | |
| 73 | R | 47 | Very low | 49.4 | Very low | 234 Ų | 234 | 149.2 Ų | 149.2 | 88% | 0.883 | 78% | 0.779 | S | S | * | * | | | trans | 83.1 | 60.4 | -169.2 | -54.4 | -178.8 | 175.5 | -171 | -1 | 114.2 | H75 | R73-H75 VanDerWaalsContact C-N 3.3Å; R73-H75 PolarHBondContact O-N 2.88Å |
| 74 | Q | 48.2 | Very low | 49.1 | Very low | 186 Ų | 186 | 145.1 Ų | 145.1 | 87% | 0.869 | 78% | 0.775 | S | S | * | * | | | trans | -71.8 | 100.9 | 151.7 | -71.1 | -169.8 | -20.6 | 0 | 0 | 107.5 | | |
| 75 | H | 48.9 | Very low | 48.4 | Very low | 172 Ų | 172 | 143.7 Ų | 143.7 | 80% | 0.796 | 78% | 0.775 | S | S | * | * | | | trans | -27.7 | 131 | 164 | -112.3 | -115.8 | 0 | 0 | 0 | 111.4 | R73 | R73-H75 VanDerWaalsContact C-N 3.3Å; R73-H75 PolarHBondContact O-N 2.88Å |
| 76 | L | 46.9 | Very low | 48.1 | Very low | 159 Ų | 159 | 144.1 Ų | 144.1 | 83% | 0.832 | 78% | 0.779 | S | S | * | * | | | trans | -48.4 | 137.2 | 161 | -90.9 | 150 | 0 | 0 | 0 | 108.3 | E78 | L76-E78 PolarHBondContact O-N 3.09Š|
| 77 | P | 55 | Low | 47.8 | Very low | 110 Ų | 110 | 143.6 Ų | 143.6 | 71% | 0.714 | 78% | 0.781 | S | S | * | * | | | trans | -55.9 | 118.7 | -179.9 | 22 | -31.1 | 0 | 0 | 0 | 108.5 | L79 | P77-L79 PolarHBondContact O-N 3.07Š|
| 78 | E | 51.8 | Low | 48.1 | Very low | 165 Ų | 165 | 137.2 Ų | 137.2 | 77% | 0.771 | 77% | 0.772 | S | S | * | * | | | trans | -58.2 | 114.5 | 172.5 | -161.7 | 169.3 | -154.1 | 0 | 0 | 106.5 | L76 Q80 | L76-E78 PolarHBondContact O-N 3.09Å; E78-Q80 VanDerWaalsContact C-N 3.28Å; E78-Q80 PolarHBondContact O-N 2.95Å |
| 79 | L | 54.6 | Low | 48.2 | Very low | 136 Ų | 136 | 138.4 Ų | 138.4 | 71% | 0.712 | 77% | 0.768 | S | S | * | * | | | trans | -65.4 | 95.3 | 177.8 | -72.6 | 170.8 | 0 | 0 | 0 | 107 | P77 F81 | P77-L79 PolarHBondContact O-N 3.07Å; L79-F81 VanDerWaalsContact C-N 3.27Å; L79-F81 HydrophobicContact CB-CD2 4.49Å; L79-F81 HydrophobicContact CB-CE2 4Å; L79-F81 HydrophobicContact CB-CZ 4.39Å; L79-F81 VanDerWaalsContact O-CD2 3.25Å; L79-F81 WeakPolarHBondContact O-CD2 3.24Å; L79-F81 PolarHBondContact O-N 2.68Å |
| 80 | Q | 55.2 | Low | 48 | Very low | 161 Ų | 161 | 141.1 Ų | 141.1 | 75% | 0.752 | 77% | 0.769 | S | S | * | * | | | trans | -68.7 | 91.6 | 172.9 | -67.9 | -178.7 | -5.1 | 0 | 0 | 107.4 | E78 L82 | E78-Q80 VanDerWaalsContact C-N 3.28Å; E78-Q80 PolarHBondContact O-N 2.95Å; Q80-L82 PolarHBondContact O-N 2.96Å |
| 81 | F | 51.5 | Low | 48.2 | Very low | 180 Ų | 180 | 140 Ų | 140 | 79% | 0.789 | 76% | 0.762 | S | S | * | * | | | trans | -65.5 | 94.5 | 161.5 | -63.3 | -83.8 | 0 | 0 | 0 | 105.9 | L79 L83 | L79-F81 VanDerWaalsContact C-N 3.27Å; L79-F81 HydrophobicContact CB-CD2 4.49Å; L79-F81 HydrophobicContact CB-CE2 4Å; L79-F81 HydrophobicContact CB-CZ 4.39Å; L79-F81 VanDerWaalsContact O-CD2 3.25Å; L79-F81 WeakPolarHBondContact O-CD2 3.24Å; L79-F81 PolarHBondContact O-N 2.68Å; F81-L83 PolarHBondContact O-N 2.78Å |
| 82 | L | 52.4 | Low | 48.3 | Very low | 142 Ų | 142 | 143.4 Ų | 143.4 | 74% | 0.743 | 77% | 0.77 | S | S | * | * | | | trans | -65.9 | 84.8 | 167.8 | -71.2 | 171.8 | 0 | 0 | 0 | 107 | Q80 N84 | Q80-L82 PolarHBondContact O-N 2.96Å; L82-N84 PolarHBondContact O-N 2.75Å |
| 83 | L | 48.5 | Very low | 48.2 | Very low | 159 Ų | 159 | 143.4 Ų | 143.4 | 83% | 0.832 | 77% | 0.765 | S | S | * | * | | | trans | -73 | 57.7 | 169.3 | -167.2 | 82.4 | 0 | 0 | 0 | 108.3 | F81 | F81-L83 PolarHBondContact O-N 2.78Š|
| 84 | N | 49.8 | Very low | 48 | Very low | 145 Ų | 145 | 138 Ų | 138 | 78% | 0.775 | 76% | 0.76 | S | S | * | * | S | Bend | trans | -147 | 94.8 | 174 | -81 | -36.6 | 0 | 0 | 0 | 108.4 | L82 | L82-N84 PolarHBondContact O-N 2.75Š|
| 85 | G | 40.8 | Very low | 47.7 | Very low | 61 Ų | 61 | 136.4 Ų | 136.4 | 63% | 0.629 | 76% | 0.757 | S | S | * | * | | | trans | 60.5 | 118.5 | 136 | 0 | 0 | 0 | 0 | 0 | 117.6 | T87 | G85-T87 PolarHBondContact O-N 2.79Å; G85-T87 VanDerWaalsContact O-N 3.08Å |
| 86 | P | 46.2 | Very low | 47.7 | Very low | 132 Ų | 132 | 133.9 Ų | 133.9 | 86% | 0.857 | 75% | 0.754 | S | S | * | * | | | trans | -57.6 | 119.6 | 174.2 | 25 | -32.3 | 0 | 0 | 0 | 109.9 | P88 | P86-P88 VanDerWaalsContact O-CD 3.31Å; P86-P88 WeakPolarHBondContact O-CD 3.21Å |
| 87 | T | 45.6 | Very low | 47.8 | Very low | 119 Ų | 119 | 136 Ų | 136 | 73% | 0.73 | 76% | 0.756 | S | S | * | * | | | trans | -76 | 116.4 | 165 | 9.4 | 0 | 0 | 0 | 0 | 107.2 | G85 I89 | G85-T87 PolarHBondContact O-N 2.79Å; G85-T87 VanDerWaalsContact O-N 3.08Å; T87-I89 VanDerWaalsContact C-N 3.33Å; T87-I89 PolarHBondContact O-N 2.72Å |
| 88 | P | 47.5 | Very low | 47.5 | Very low | 113 Ų | 113 | 138.5 Ų | 138.5 | 73% | 0.734 | 76% | 0.758 | S | S | * | * | | | trans | -77 | 86.1 | 180 | 30.2 | -31.6 | 0 | 0 | 0 | 109 | P86 N90 | P86-P88 VanDerWaalsContact O-CD 3.31Å; P86-P88 WeakPolarHBondContact O-CD 3.21Å; P88-N90 PolarHBondContact O-N 2.93Å |
| 89 | I | 48.8 | Very low | 47.6 | Very low | 136 Ų | 136 | 140.5 Ų | 140.5 | 70% | 0.697 | 76% | 0.764 | S | S | * | * | | | trans | -92.8 | 97.1 | 171.5 | -58.6 | 177 | 0 | 0 | 0 | 107.6 | T87 S91 | T87-I89 VanDerWaalsContact C-N 3.33Å; T87-I89 PolarHBondContact O-N 2.72Å; I89-S91 VanDerWaalsContact C-N 3.32Å; I89-S91 PolarHBondContact O-N 2.95Å |
| 90 | N | 41 | Very low | 47.7 | Very low | 150 Ų | 150 | 139.3 Ų | 139.3 | 80% | 0.802 | 77% | 0.767 | S | S | * | * | | | trans | -51.9 | 93.1 | 163.2 | -66.2 | -41.1 | 0 | 0 | 0 | 109.5 | P88 | P88-N90 PolarHBondContact O-N 2.93Š|
| 91 | S | 45.4 | Very low | 47.6 | Very low | 94 Ų | 94 | 136.7 Ų | 136.7 | 66% | 0.657 | 77% | 0.766 | S | S | * | * | | | trans | -120.1 | 84.1 | 162.8 | 64.3 | 0 | 0 | 0 | 0 | 108.1 | I89 S93 | I89-S91 VanDerWaalsContact C-N 3.32Å; I89-S91 PolarHBondContact O-N 2.95Å; S91-S93 PolarHBondContact O-N 2.86Å |
| 92 | I | 44.8 | Very low | 47.7 | Very low | 169 Ų | 169 | 133.1 Ų | 133.1 | 87% | 0.867 | 76% | 0.761 | S | S | * | * | | | trans | -70.4 | 82.9 | 169.4 | -52.8 | 166.2 | 0 | 0 | 0 | 105.8 | | |
| 93 | S | 42 | Very low | 48.2 | Very low | 88 Ų | 88 | 133.7 Ų | 133.7 | 62% | 0.615 | 76% | 0.764 | S | S | * | * | | | trans | -94.6 | 135.1 | 161.3 | 59.8 | 0 | 0 | 0 | 0 | 107.7 | S91 L95 | S91-S93 PolarHBondContact O-N 2.86Å; S93-L95 PolarHBondContact O-N 2.82Å |
| 94 | P | 42.8 | Very low | 48.4 | Very low | 120 Ų | 120 | 134.3 Ų | 134.3 | 78% | 0.779 | 76% | 0.76 | S | S | * | * | | | trans | -64.5 | 104.6 | -175.2 | 23.1 | -30.8 | 0 | 0 | 0 | 109.5 | T96 | P94-T96 VanDerWaalsContact C-N 3.33Å; P94-T96 PolarHBondContact O-N 2.9Å |
| 95 | L | 42 | Very low | 48.8 | Very low | 153 Ų | 153 | 132.4 Ų | 132.4 | 80% | 0.801 | 76% | 0.756 | S | S | * | * | | | trans | -62.8 | 91.7 | 178.1 | -167.2 | 78.3 | 0 | 0 | 0 | 108.9 | S93 K97 | S93-L95 PolarHBondContact O-N 2.82Å; L95-K97 PolarHBondContact O-N 3.12Å |
| 96 | T | 48.6 | Very low | 49.5 | Very low | 120 Ų | 120 | 137.6 Ų | 137.6 | 74% | 0.736 | 77% | 0.768 | S | S | * | * | | | trans | -64.5 | 98.9 | 169.3 | 46.9 | 0 | 0 | 0 | 0 | 108.7 | P94 Q98 | P94-T96 VanDerWaalsContact C-N 3.33Å; P94-T96 PolarHBondContact O-N 2.9Å; T96-Q98 VanDerWaalsContact C-N 3.32Å; T96-Q98 PolarHBondContact O-N 2.78Å |
| 97 | K | 50.2 | Low | 50 | Low | 203 Ų | 203 | 140.2 Ų | 140.2 | 88% | 0.883 | 77% | 0.766 | S | S | * | * | | | trans | 25.1 | 59.9 | 157.4 | -58.4 | -175.6 | -177.7 | -179.3 | 0 | 115 | L95 K99 | L95-K97 PolarHBondContact O-N 3.12Å; K97-K99 PolarHBondContact O-N 3.25Å |
| 98 | Q | 48.8 | Very low | 50.6 | Low | 163 Ų | 163 | 139.2 Ų | 139.2 | 76% | 0.762 | 76% | 0.764 | S | S | * | * | | | trans | -75.2 | 123.9 | 164.2 | -70 | -127.1 | -5.2 | 0 | 0 | 107.1 | T96 S100 | T96-Q98 VanDerWaalsContact C-N 3.32Å; T96-Q98 PolarHBondContact O-N 2.78Å; Q98-S100 PolarHBondContact O-N 3.05Å |
| 99 | K | 53.8 | Low | 51 | Low | 206 Ų | 206 | 139.5 Ų | 139.5 | 90% | 0.896 | 77% | 0.765 | S | S | * | * | | | trans | -53.3 | 112.8 | 173.7 | -69 | 178.1 | 177.9 | 178.9 | 0 | 107 | K97 C101 | K97-K99 PolarHBondContact O-N 3.25Å; K99-C101 PolarHBondContact O-N 3.28Å; K99-C101 VanDerWaalsContact O-N 3.1Å |
| 100 | S | 56.6 | Low | 51.2 | Low | 111 Ų | 111 | 141.5 Ų | 141.5 | 78% | 0.776 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -58.3 | 117 | 174.3 | 53.2 | 0 | 0 | 0 | 0 | 107.9 | Q98 | Q98-S100 PolarHBondContact O-N 3.05Š|
| 101 | C | 52.8 | Low | 51.9 | Low | 106 Ų | 106 | 140.3 Ų | 140.3 | 72% | 0.716 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -56.8 | 135.8 | 165.4 | -66.3 | 0 | 0 | 0 | 0 | 107.7 | K99 L103 | K99-C101 PolarHBondContact O-N 3.28Å; K99-C101 VanDerWaalsContact O-N 3.1Å; C101-L103 PolarHBondContact O-N 2.86Å |
| 102 | P | 52.7 | Low | 52.2 | Low | 105 Ų | 105 | 143.4 Ų | 143.4 | 68% | 0.682 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -58 | 116.1 | 175.9 | 23.5 | -31.4 | 0 | 0 | 0 | 108 | F104 | P102-F104 VanDerWaalsContact C-N 3.32Å; P102-F104 PolarHBondContact O-N 2.78Å |
| 103 | L | 62.4 | Low | 52.6 | Low | 155 Ų | 155 | 140.6 Ų | 140.6 | 81% | 0.812 | 77% | 0.769 | S | S | * | * | | | trans | -63.3 | 102.7 | 163.5 | -88.5 | 103.7 | 0 | 0 | 0 | 105.6 | C101 | C101-L103 PolarHBondContact O-N 2.86Š|
| 104 | F | 53.2 | Low | 53.2 | Low | 172 Ų | 172 | 147.2 Ų | 147.2 | 75% | 0.754 | 78% | 0.781 | S | S | * | * | | | trans | -50.9 | 132 | 163.3 | -76.3 | -84.3 | 0 | 0 | 0 | 107.4 | P102 L106 | P102-F104 VanDerWaalsContact C-N 3.32Å; P102-F104 PolarHBondContact O-N 2.78Å; F104-L106 PolarHBondContact O-N 3.18Å |
| 105 | P | 59 | Low | 53.7 | Low | 105 Ų | 105 | 150.6 Ų | 150.6 | 68% | 0.682 | 78% | 0.783 | S | S | * | * | | | trans | -53.8 | 119.8 | 175.3 | -23 | 31.3 | 0 | 0 | 0 | 108.6 | K107 | P105-K107 HydrophobicContact CB-CG 4.39Å; P105-K107 PolarHBondContact O-N 3.1Å |
| 106 | L | 54.9 | Low | 54.1 | Low | 170 Ų | 170 | 149 Ų | 149 | 89% | 0.89 | 78% | 0.779 | S | S | * | * | | | trans | -70.7 | 54.8 | 168.1 | -62.6 | 174.9 | 0 | 0 | 0 | 109.1 | F104 S108 | F104-L106 PolarHBondContact O-N 3.18Å; L106-S108 PolarHBondContact O-N 2.98Å |
| 107 | K | 56.5 | Low | 54.3 | Low | 186 Ų | 186 | 149 Ų | 149 | 81% | 0.809 | 78% | 0.779 | S | S | * | * | | | trans | -78.3 | 113.2 | 161.5 | -69.7 | -162.2 | 176.9 | -172.4 | 0 | 105.2 | P105 | P105-K107 HydrophobicContact CB-CG 4.39Å; P105-K107 PolarHBondContact O-N 3.1Å |
| 108 | S | 59.2 | Low | 54.3 | Low | 99 Ų | 99 | 144.2 Ų | 144.2 | 69% | 0.692 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -47.5 | 134.8 | 172.3 | 58.4 | 0 | 0 | 0 | 0 | 108.2 | L106 E110 | L106-S108 PolarHBondContact O-N 2.98Å; S108-E110 PolarHBondContact O-N 3.15Å |
| 109 | P | 55.1 | Low | 54.2 | Low | 118 Ų | 118 | 144 Ų | 144 | 77% | 0.766 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -51.2 | 117.9 | 179.9 | 20.9 | -31.5 | 0 | 0 | 0 | 108 | V111 | P109-V111 PolarHBondContact O-N 3.29Å; P109-V111 VanDerWaalsContact O-N 3.07Å |
| 110 | E | 54.1 | Low | 54.3 | Low | 179 Ų | 179 | 139.5 Ų | 139.5 | 84% | 0.836 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -49 | 120.6 | 173.7 | -146.4 | 163.8 | -153.7 | 0 | 0 | 105.7 | S108 L112 | S108-E110 PolarHBondContact O-N 3.15Å; E110-L112 PolarHBondContact O-N 3.21Å |
| 111 | V | 53.9 | Low | 54 | Low | 125 Ų | 125 | 142.6 Ų | 142.6 | 76% | 0.758 | 76% | 0.761 | S | S | * | * | | | trans | -62 | 95 | -177.6 | 178.8 | 0 | 0 | 0 | 0 | 105.4 | P109 T113 | P109-V111 PolarHBondContact O-N 3.29Å; P109-V111 VanDerWaalsContact O-N 3.07Å; V111-T113 HydrophobicContact CG1-CG2 4.43Å; V111-T113 PolarHBondContact O-N 3.4Å |
| 112 | L | 51.9 | Low | 53.8 | Low | 158 Ų | 158 | 145.8 Ų | 145.8 | 83% | 0.827 | 77% | 0.766 | S | S | * | * | | | trans | -63.4 | 88.2 | 169.3 | -79.5 | 160.1 | 0 | 0 | 0 | 104.3 | E110 R114 | E110-L112 PolarHBondContact O-N 3.21Å; L112-R114 PolarHBondContact O-N 3.36Å |
| 113 | T | 53.6 | Low | 53.6 | Low | 111 Ų | 111 | 146.1 Ų | 146.1 | 68% | 0.681 | 77% | 0.766 | S | S | * | * | | | trans | -55.7 | 97.8 | 166.9 | 49.4 | 0 | 0 | 0 | 0 | 104.3 | V111 K115 | V111-T113 HydrophobicContact CG1-CG2 4.43Å; V111-T113 PolarHBondContact O-N 3.4Å; T113-K115 VanDerWaalsContact C-N 3.29Å; T113-K115 PolarHBondContact O-N 3.02Å |
| 114 | R | 54.7 | Low | 53.1 | Low | 227 Ų | 227 | 144.3 Ų | 144.3 | 86% | 0.857 | 76% | 0.763 | S | S | * | * | | | trans | -57.4 | 102.7 | 177.3 | -69.2 | 178 | 179.4 | 169.6 | -0.8 | 104.5 | L112 V116 | L112-R114 PolarHBondContact O-N 3.36Å; R114-V116 PolarHBondContact O-N 2.72Å |
| 115 | K | 53.3 | Low | 52.9 | Low | 190 Ų | 190 | 144.2 Ų | 144.2 | 83% | 0.826 | 77% | 0.766 | S | S | * | * | | | trans | -61.3 | 98.2 | 166.9 | -74.1 | -177.6 | 177.5 | 179.7 | 0 | 104 | T113 V117 | T113-K115 VanDerWaalsContact C-N 3.29Å; T113-K115 PolarHBondContact O-N 3.02Å; K115-V117 VanDerWaalsContact C-N 3.26Å; K115-V117 PolarHBondContact O-N 3.19Å |
| 116 | V | 51.1 | Low | 52.3 | Low | 120 Ų | 120 | 144.4 Ų | 144.4 | 73% | 0.727 | 77% | 0.769 | S | S | * | * | | | trans | -66.5 | 96.5 | 174.6 | 179.4 | 0 | 0 | 0 | 0 | 104.7 | R114 V118 | R114-V116 PolarHBondContact O-N 2.72Å; V116-V118 VanDerWaalsContact C-N 3.29Å; V116-V118 HydrophobicContact CG1-CG2 3.79Å; V116-V118 PolarHBondContact O-N 3.25Å |
| 117 | V | 52 | Low | 51.9 | Low | 119 Ų | 119 | 140.8 Ų | 140.8 | 72% | 0.721 | 75% | 0.754 | S | S | * | * | | | trans | -74.5 | 94.2 | 169.6 | -178.6 | 0 | 0 | 0 | 0 | 105.1 | K115 L119 | K115-V117 VanDerWaalsContact C-N 3.26Å; K115-V117 PolarHBondContact O-N 3.19Å; V117-L119 PolarHBondContact O-N 3.34Å |
| 118 | V | 50.1 | Low | 51.4 | Low | 104 Ų | 104 | 139.1 Ų | 139.1 | 63% | 0.63 | 75% | 0.754 | S | S | * | * | | | trans | -72.9 | 104.1 | 169.9 | -176.4 | 0 | 0 | 0 | 0 | 105.9 | V116 V120 | V116-V118 VanDerWaalsContact C-N 3.29Å; V116-V118 HydrophobicContact CG1-CG2 3.79Å; V116-V118 PolarHBondContact O-N 3.25Å; V118-V120 HydrophobicContact CG1-CG2 3.97Å; V118-V120 PolarHBondContact O-N 3.13Å; V118-V120 VanDerWaalsContact O-N 3.08Å |
| 119 | L | 47.8 | Very low | 50.7 | Low | 159 Ų | 159 | 146 Ų | 146 | 83% | 0.832 | 77% | 0.765 | S | S | * | * | | | trans | -69.4 | 100.6 | 163.9 | -121.3 | 99.1 | 0 | 0 | 0 | 106.2 | V117 E121 | V117-L119 PolarHBondContact O-N 3.34Å; L119-E121 PolarHBondContact O-N 3.32Å |
| 120 | V | 54.6 | Low | 50 | Low | 110 Ų | 110 | 146.1 Ų | 146.1 | 67% | 0.667 | 76% | 0.757 | S | S | * | * | | | trans | -77.1 | 104.7 | 168.2 | 177.9 | 0 | 0 | 0 | 0 | 105.8 | V118 E122 | V118-V120 HydrophobicContact CG1-CG2 3.97Å; V118-V120 PolarHBondContact O-N 3.13Å; V118-V120 VanDerWaalsContact O-N 3.08Å; V120-E122 HydrophobicContact CG1-CG 4.45Å; V120-E122 PolarHBondContact O-N 2.89Å; V120-E122 VanDerWaalsContact O-N 3.12Å |
| 121 | E | 50.2 | Low | 49.5 | Very low | 176 Ų | 176 | 142.5 Ų | 142.5 | 82% | 0.822 | 75% | 0.747 | S | S | * | * | | | trans | -72.4 | 100 | 167.5 | -155.5 | -178.9 | -158.8 | 0 | 0 | 106.3 | L119 T123 | L119-E121 PolarHBondContact O-N 3.32Å; E121-T123 VanDerWaalsContact C-N 3.33Å; E121-T123 PolarHBondContact O-N 3.09Å |
| 122 | E | 49.8 | Very low | 49 | Very low | 174 Ų | 174 | 148.2 Ų | 148.2 | 81% | 0.813 | 76% | 0.755 | S | S | * | * | | | trans | -66.1 | 97.1 | 170.4 | -75.3 | -168.7 | 162.2 | 0 | 0 | 107.7 | V120 P124 | V120-E122 HydrophobicContact CG1-CG 4.45Å; V120-E122 PolarHBondContact O-N 2.89Å; V120-E122 VanDerWaalsContact O-N 3.12Å; E122-P124 WeakPolarHBondContact O-CD 3.41Å |
| 123 | T | 47.7 | Very low | 48.5 | Very low | 111 Ų | 111 | 151.3 Ų | 151.3 | 68% | 0.681 | 76% | 0.756 | S | S | * | * | | | trans | -55.5 | 122.9 | 163.4 | 24.4 | 0 | 0 | 0 | 0 | 107.6 | E121 E125 | E121-T123 VanDerWaalsContact C-N 3.33Å; E121-T123 PolarHBondContact O-N 3.09Å; T123-E125 VanDerWaalsContact C-N 3.31Å; T123-E125 PolarHBondContact O-N 3.47Å |
| 124 | P | 52.6 | Low | 47.9 | Very low | 117 Ų | 117 | 153.1 Ų | 153.1 | 76% | 0.76 | 75% | 0.751 | S | S | * | * | | | trans | -66 | 97 | 176.1 | 26.3 | -32.3 | 0 | 0 | 0 | 107.6 | E122 S126 | E122-P124 WeakPolarHBondContact O-CD 3.41Å; P124-S126 VanDerWaalsContact C-N 3.34Å; P124-S126 PolarHBondContact O-N 3.13Å |
| 125 | E | 49.7 | Very low | 47.4 | Very low | 171 Ų | 171 | 146.6 Ų | 146.6 | 80% | 0.799 | 75% | 0.746 | S | S | * | * | | | trans | -58.3 | 103.1 | 168 | -76.2 | -170.9 | 164 | 0 | 0 | 107.4 | T123 T127 | T123-E125 VanDerWaalsContact C-N 3.31Å; T123-E125 PolarHBondContact O-N 3.47Å; E125-T127 PolarHBondContact O-N 3.27Å |
| 126 | S | 44.9 | Very low | 47 | Very low | 108 Ų | 108 | 146.3 Ų | 146.3 | 76% | 0.755 | 74% | 0.744 | S | S | * | * | | | trans | -0.7 | 81.3 | 168.2 | 63.9 | 0 | 0 | 0 | 0 | 115.1 | P124 D128 | P124-S126 VanDerWaalsContact C-N 3.34Å; P124-S126 PolarHBondContact O-N 3.13Å; S126-D128 PolarHBondContact O-N 3.08Å; S126-D128 VanDerWaalsContact O-N 3.08Å |
| 127 | T | 46.9 | Very low | 46.6 | Very low | 95 Ų | 95 | 148.9 Ų | 148.9 | 58% | 0.583 | 74% | 0.742 | S | S | * | * | G | 310 helix | trans | -77.6 | 18.9 | 176 | 32.5 | 0 | 0 | 0 | 0 | 113.3 | E125 R129 M130 | E125-T127 PolarHBondContact O-N 3.27Å; T127-R129 PolarHBondContact O-N 3.33Å; T127-R129 VanDerWaalsContact O-N 3.08Å; T127-M130 PolarHBondContact O-N 3.4Å |
| 128 | D | 45.6 | Very low | 46.2 | Very low | 150 Ų | 150 | 148.8 Ų | 148.8 | 80% | 0.802 | 74% | 0.738 | S | S | * | * | G | 310 helix | trans | -67.4 | -11.9 | -178.6 | -151.8 | 25.7 | 0 | 0 | 0 | 112.8 | S126 | S126-D128 PolarHBondContact O-N 3.08Å; S126-D128 VanDerWaalsContact O-N 3.08Å |
| 129 | R | 44.8 | Very low | 46 | Very low | 244 Ų | 244 | 148.3 Ų | 148.3 | 92% | 0.921 | 74% | 0.739 | S | S | * | * | G | 310 helix | trans | -104.1 | -9.2 | 175.6 | -79.5 | -171.1 | 170.9 | -168.9 | -1.2 | 116.3 | T127 | T127-R129 PolarHBondContact O-N 3.33Å; T127-R129 VanDerWaalsContact O-N 3.08Å |
| 130 | M | 40.1 | Very low | 45.9 | Very low | 120 Ų | 120 | 144.5 Ų | 144.5 | 59% | 0.591 | 72% | 0.723 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -107.1 | -11.3 | -172.9 | -149.5 | 171.3 | -99.2 | 0 | 0 | 115.3 | T127 R132 R133 Y134 | T127-M130 PolarHBondContact O-N 3.4Å; M130-R132 PolarHBondContact O-N 3.04Å; M130-R132 VanDerWaalsContact O-N 3.1Å; M130-R133 PolarHBondContact O-N 2.76Å; M130-Y134 HydrophobicContact CG-CE2 3.93Å; M130-Y134 HydrophobicContact SD-CE2 4.2Å |
| 131 | T | 43.7 | Very low | 45.3 | Very low | 104 Ų | 104 | 143.4 Ų | 143.4 | 64% | 0.638 | 72% | 0.716 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.5 | -13.7 | 179.2 | 35.1 | 0 | 0 | 0 | 0 | 114.7 | R133 | T131-R133 VanDerWaalsContact C-N 3.29Å; T131-R133 PolarHBondContact O-N 3.12Å |
| 132 | R | 43.8 | Very low | 45.1 | Very low | 244 Ų | 244 | 140.5 Ų | 140.5 | 92% | 0.921 | 71% | 0.706 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.8 | -12.1 | 178 | -100.1 | -173.1 | -173.8 | -133 | 1.6 | 115.5 | M130 | M130-R132 PolarHBondContact O-N 3.04Å; M130-R132 VanDerWaalsContact O-N 3.1Å |
| 133 | R | 41.2 | Very low | 44.8 | Very low | 223 Ų | 223 | 134.9 Ų | 134.9 | 84% | 0.842 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -111.4 | -13.1 | -176.7 | -66.7 | -164.5 | -177.3 | -174.3 | 2.4 | 116.4 | M130 T131 | M130-R133 PolarHBondContact O-N 2.76Å; T131-R133 VanDerWaalsContact C-N 3.29Å; T131-R133 PolarHBondContact O-N 3.12Å |
| 134 | Y | 42.4 | Very low | 44.5 | Very low | 149 Ų | 149 | 134.2 Ų | 134.2 | 58% | 0.584 | 68% | 0.681 | S | S | * | * | G | 310 helix | trans | -88.2 | -10.9 | -176.4 | -69.9 | -75.2 | 0 | 0 | 0 | 115.5 | M130 K136 Y137 | M130-Y134 HydrophobicContact CG-CE2 3.93Å; M130-Y134 HydrophobicContact SD-CE2 4.2Å; Y134-K136 PolarHBondContact O-N 2.93Å; Y134-Y137 PolarHBondContact O-N 3.03Å |
| 135 | A | 42.6 | Very low | 44.2 | Very low | 90 Ų | 90 | 132.2 Ų | 132.2 | 74% | 0.744 | 67% | 0.67 | S | S | * | * | G | 310 helix | trans | -62 | -16.7 | 176 | 0 | 0 | 0 | 0 | 0 | 113.6 | | |
| 136 | K | 45.9 | Very low | 44 | Very low | 184 Ų | 184 | 131.5 Ų | 131.5 | 80% | 0.8 | 67% | 0.666 | S | S | * | * | G | 310 helix | trans | -89.7 | -14.9 | -178.3 | -138.2 | 173.8 | -173.8 | -179.7 | 0 | 115 | Y134 | Y134-K136 PolarHBondContact O-N 2.93Š|
| 137 | Y | 41.6 | Very low | 44.1 | Very low | 174 Ų | 174 | 133.7 Ų | 133.7 | 68% | 0.682 | 67% | 0.665 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.3 | -21.5 | -179.2 | -104.8 | -87.6 | 0 | 0 | 0 | 114.2 | Y134 S139 T140 | Y134-Y137 PolarHBondContact O-N 3.03Å; Y137-S139 VanDerWaalsContact C-N 3.26Å; Y137-S139 PolarHBondContact O-N 3.03Å; Y137-T140 PolarHBondContact O-N 3.44Å |
| 138 | N | 43.4 | Very low | 43.9 | Very low | 117 Ų | 117 | 134.7 Ų | 134.7 | 63% | 0.626 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -74.7 | -14.2 | -179.4 | -73.4 | -9.5 | 0 | 0 | 0 | 114 | | |
| 139 | S | 46.4 | Very low | 43.8 | Very low | 95 Ų | 95 | 132.6 Ų | 132.6 | 66% | 0.664 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -72.1 | -28.7 | 174.1 | -176.3 | 0 | 0 | 0 | 0 | 112.8 | Y137 | Y137-S139 VanDerWaalsContact C-N 3.26Å; Y137-S139 PolarHBondContact O-N 3.03Å |
| 140 | T | 45.3 | Very low | 43.5 | Very low | 79 Ų | 79 | 123.8 Ų | 123.8 | 49% | 0.485 | 65% | 0.648 | S | S | . | * | H | α-helix | trans | -87.9 | -27.2 | -175.4 | -6.4 | 0 | 0 | 0 | 0 | 112.8 | Y137 A143 L144 | Y137-T140 PolarHBondContact O-N 3.44Å; T140-A143 PolarHBondContact O-N 3.49Å; T140-L144 PolarHBondContact O-N 3.01Å; T140-L144 VanDerWaalsContact O-N 3.16Å |
| 141 | V | 43.7 | Very low | 43.4 | Very low | 86 Ų | 86 | 122.5 Ų | 122.5 | 52% | 0.521 | 65% | 0.65 | S | S | . | * | H | α-helix | trans | -68.7 | -37.5 | 178.9 | -176.6 | 0 | 0 | 0 | 0 | 111.1 | A143 L144 S145 | V141-A143 VanDerWaalsContact C-N 3.31Å; V141-A143 PolarHBondContact O-N 2.83Å; V141-L144 PolarHBondContact O-N 2.8Å; V141-S145 WeakPolarHBondContact O-CB 3.44Å; V141-S145 PolarHBondContact O-N 3.47Å |
| 142 | N | 45 | Very low | 43.4 | Very low | 116 Ų | 116 | 124.2 Ų | 124.2 | 62% | 0.62 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -66.4 | -34.7 | 175.4 | -72.7 | -3.9 | 0 | 0 | 0 | 112 | S145 E146 | N142-S145 PolarHBondContact O-N 3.25Å; N142-E146 PolarHBondContact O-N 3.47Å |
| 143 | A | 43 | Very low | 43.7 | Very low | 55 Ų | 55 | 121.8 Ų | 121.8 | 46% | 0.455 | 65% | 0.654 | S | S | . | * | H | α-helix | trans | -67.3 | -36.5 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | T140 V141 Q147 | T140-A143 PolarHBondContact O-N 3.49Å; V141-A143 VanDerWaalsContact C-N 3.31Å; V141-A143 PolarHBondContact O-N 2.83Å; A143-Q147 PolarHBondContact O-N 3.38Å |
| 144 | L | 41.8 | Very low | 43.9 | Very low | 98 Ų | 98 | 118.4 Ų | 118.4 | 51% | 0.513 | 65% | 0.653 | S | S | . | * | H | α-helix | trans | -75.8 | -31.6 | 175.2 | -71.9 | 172.4 | 0 | 0 | 0 | 112.6 | T140 V141 E146 Q147 L148 | T140-L144 PolarHBondContact O-N 3.01Å; T140-L144 VanDerWaalsContact O-N 3.16Å; V141-L144 PolarHBondContact O-N 2.8Å; L144-E146 VanDerWaalsContact C-N 3.32Å; L144-E146 PolarHBondContact O-N 3.2Å; L144-Q147 PolarHBondContact O-N 2.89Å; L144-L148 WeakPolarHBondContact O-CG 3.43Å; L144-L148 PolarHBondContact O-N 3.29Å |
| 145 | S | 46.1 | Very low | 44.1 | Very low | 75 Ų | 75 | 118.9 Ų | 118.9 | 52% | 0.524 | 66% | 0.662 | S | S | . | * | H | α-helix | trans | -61.9 | -39.3 | 174.8 | -177.9 | 0 | 0 | 0 | 0 | 111.9 | V141 N142 L148 S149 | V141-S145 WeakPolarHBondContact O-CB 3.44Å; V141-S145 PolarHBondContact O-N 3.47Å; N142-S145 PolarHBondContact O-N 3.25Å; S145-L148 PolarHBondContact O-N 3.44Å; S145-S149 PolarHBondContact O-N 2.86Å |
| 146 | E | 46.4 | Very low | 44.3 | Very low | 155 Ų | 155 | 122.3 Ų | 122.3 | 72% | 0.724 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -69.3 | -35.7 | 176.3 | -75.1 | -176.4 | 172.3 | 0 | 0 | 111.7 | N142 L144 S149 | N142-E146 PolarHBondContact O-N 3.47Å; L144-E146 VanDerWaalsContact C-N 3.32Å; L144-E146 PolarHBondContact O-N 3.2Å; E146-S149 PolarHBondContact O-OG 2.86Å |
| 147 | Q | 45.6 | Very low | 44.2 | Very low | 155 Ų | 155 | 122.4 Ų | 122.4 | 72% | 0.724 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -71.4 | -28.1 | 176.2 | -74.1 | -169.1 | -40.9 | 0 | 0 | 114.1 | A143 L144 | A143-Q147 PolarHBondContact O-N 3.38Å; L144-Q147 PolarHBondContact O-N 2.89Å |
| 148 | L | 43.3 | Very low | 44.5 | Very low | 115 Ų | 115 | 121.3 Ų | 121.3 | 60% | 0.602 | 67% | 0.673 | S | S | * | * | H | α-helix | trans | -85.6 | -9.2 | -179.6 | -71.9 | 170.1 | 0 | 0 | 0 | 114.1 | L144 S145 G150 C151 | L144-L148 WeakPolarHBondContact O-CG 3.43Å; L144-L148 PolarHBondContact O-N 3.29Å; S145-L148 PolarHBondContact O-N 3.44Å; L148-G150 PolarHBondContact O-N 3.16Å; L148-C151 PolarHBondContact O-N 3.31Å |
| 149 | S | 43.9 | Very low | 44.3 | Very low | 107 Ų | 107 | 121.6 Ų | 121.6 | 75% | 0.748 | 68% | 0.679 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.4 | -10.9 | 175.1 | 68.5 | 0 | 0 | 0 | 0 | 114 | S145 E146 | S145-S149 PolarHBondContact O-N 2.86Å; E146-S149 PolarHBondContact O-OG 2.86Å |
| 150 | G | 38.4 | Very low | 44.2 | Very low | 58 Ų | 58 | 124.7 Ų | 124.7 | 60% | 0.598 | 69% | 0.686 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.1 | 0.2 | 173.2 | 0 | 0 | 0 | 0 | 0 | 116 | L148 N152 | L148-G150 PolarHBondContact O-N 3.16Å; G150-N152 PolarHBondContact O-N 3.37Å |
| 151 | C | 38 | Very low | 44.1 | Very low | 93 Ų | 93 | 130.2 Ų | 130.2 | 63% | 0.628 | 70% | 0.704 | S | S | * | * | | | trans | -82.5 | 84 | 177.8 | -100.7 | 0 | 0 | 0 | 0 | 110.6 | L148 | L148-C151 PolarHBondContact O-N 3.31Š|
| 152 | N | 43 | Very low | 43.9 | Very low | 141 Ų | 141 | 139.2 Ų | 139.2 | 75% | 0.754 | 74% | 0.736 | S | S | * | * | | | trans | -54.9 | 152.8 | 164.9 | -74.6 | -35.8 | 0 | 0 | 0 | 110.8 | G150 D154 | G150-N152 PolarHBondContact O-N 3.37Å; N152-D154 PolarHBondContact O-N 3.33Å |
| 153 | E | 50.6 | Low | 43.9 | Very low | 193 Ų | 193 | 140.4 Ų | 140.4 | 90% | 0.902 | 74% | 0.741 | S | S | * | * | S | Bend | trans | -63.8 | 17.2 | -152.7 | -63.7 | 169.3 | 150.5 | 0 | 0 | 117.8 | M155 | E153-M155 PolarHBondContact O-N 3.04Š|
| 154 | D | 46.1 | Very low | 43.9 | Very low | 151 Ų | 151 | 144.8 Ų | 144.8 | 81% | 0.807 | 76% | 0.757 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.5 | 2.2 | -166.6 | -76.1 | -20.8 | 0 | 0 | 0 | 115.8 | N152 | N152-D154 PolarHBondContact O-N 3.33Š|
| 155 | M | 45.7 | Very low | 44 | Very low | 160 Ų | 160 | 147.4 Ų | 147.4 | 79% | 0.788 | 77% | 0.77 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.7 | 1.1 | -169.4 | -92.9 | -124 | 54.6 | 0 | 0 | 117.5 | E153 K157 | E153-M155 PolarHBondContact O-N 3.04Å; M155-K157 PolarHBondContact O-N 3.08Å |
| 156 | L | 47.8 | Very low | 43.9 | Very low | 161 Ų | 161 | 151.7 Ų | 151.7 | 84% | 0.843 | 79% | 0.785 | S | S | * | * | | | trans | -99.6 | 39.4 | 174.6 | -64.9 | 176.8 | 0 | 0 | 0 | 113.3 | L158 | L156-L158 PolarHBondContact O-N 3.27Å; L156-L158 VanDerWaalsContact O-N 3.13Å |
| 157 | K | 43.8 | Very low | 43.8 | Very low | 186 Ų | 186 | 151.5 Ų | 151.5 | 81% | 0.809 | 79% | 0.788 | S | S | * | * | | | trans | -85.3 | 70.9 | 163.7 | -152.7 | 165.1 | -172.1 | 178.3 | 0 | 109.6 | M155 T159 | M155-K157 PolarHBondContact O-N 3.08Å; K157-T159 VanDerWaalsContact C-N 3.35Å; K157-T159 PolarHBondContact O-N 3.08Å; K157-T159 PolarHBondContact O-OG1 3.28Å |
| 158 | L | 48.2 | Very low | 43.6 | Very low | 152 Ų | 152 | 151.3 Ų | 151.3 | 80% | 0.796 | 79% | 0.793 | S | S | * | * | | | trans | -61.3 | 98.5 | 169.2 | -89 | 156.8 | 0 | 0 | 0 | 108.4 | L156 I160 | L156-L158 PolarHBondContact O-N 3.27Å; L156-L158 VanDerWaalsContact O-N 3.13Å; L158-I160 PolarHBondContact O-N 3.29Å; L158-I160 VanDerWaalsContact O-N 3.13Å |
| 159 | T | 39.4 | Very low | 43.7 | Very low | 122 Ų | 122 | 153.9 Ų | 153.9 | 75% | 0.748 | 81% | 0.806 | S | S | * | * | | | trans | -73.7 | 103.6 | 177.9 | -51.1 | 0 | 0 | 0 | 0 | 107.4 | K157 K161 | K157-T159 VanDerWaalsContact C-N 3.35Å; K157-T159 PolarHBondContact O-N 3.08Å; K157-T159 PolarHBondContact O-OG1 3.28Å; T159-K161 PolarHBondContact O-N 3.42Å; T159-K161 VanDerWaalsContact O-N 3.09Å |
| 160 | I | 43.7 | Very low | 43.6 | Very low | 160 Ų | 160 | 157.5 Ų | 157.5 | 82% | 0.821 | 81% | 0.811 | S | S | * | * | | | trans | -67.1 | 105.7 | 172.3 | -59 | 171.2 | 0 | 0 | 0 | 106.7 | L158 K162 | L158-I160 PolarHBondContact O-N 3.29Å; L158-I160 VanDerWaalsContact O-N 3.13Å; I160-K162 PolarHBondContact O-N 3.1Å |
| 161 | K | 43.6 | Very low | 44.1 | Very low | 195 Ų | 195 | 165.8 Ų | 165.8 | 85% | 0.848 | 83% | 0.828 | S | S | * | * | | | trans | -63 | 122.9 | 171.2 | -73.8 | -177.2 | 175.9 | -179.6 | 0 | 108.4 | T159 | T159-K161 PolarHBondContact O-N 3.42Å; T159-K161 VanDerWaalsContact O-N 3.09Å |
| 162 | K | 39 | Very low | 44.6 | Very low | 275 Ų | 275 | 172.4 Ų | 172.4 | 100% | 1.196 | 85% | 0.846 | S | S | * | * | | | trans | -70 | 0 | 160.9 | -92.1 | -175.6 | 174.4 | 179.9 | 0 | 110.1 | I160 | I160-K162 PolarHBondContact O-N 3.1Š|