| 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 | 36 | Very low | 33.9 | Very low | 215 Ų | 215 | 140.2 Ų | 140.2 | 100% | 1.059 | 65% | 0.647 | S | S | * | * | 0 | -38.5 | 0 | -88.7 | -176.4 | 176 | 0 | 0 | 113.9 | R3 K4 K5 | M1-R3 PolarHBondContact O-N 3.25Å; M1-K4 PolarHBondContact O-N 3.36Å; M1-K4 VanDerWaalsContact O-N 3.12Å; M1-K5 PolarHBondContact O-N 3.12Å | |||
| 2 | H | 31.9 | Very low | 33.5 | Very low | 159 Ų | 159 | 131.4 Ų | 131.4 | 74% | 0.736 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -55.1 | -45.8 | 177.1 | -107.3 | -83.1 | 0 | 0 | 0 | 114.2 | K4 K5 E6 | H2-K4 PolarHBondContact O-N 3.41Å; H2-K4 VanDerWaalsContact O-N 3.15Å; H2-K5 PolarHBondContact O-N 3.07Å; H2-K5 VanDerWaalsContact O-N 3.07Å; H2-E6 PolarHBondContact O-N 3.15Å |
| 3 | R | 32.8 | Very low | 33.4 | Very low | 228 Ų | 228 | 135.9 Ų | 135.9 | 86% | 0.86 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -58.6 | -28.8 | 175.8 | -70.9 | -171.5 | -142.3 | -172.5 | 4.9 | 114.8 | M1 Y7 | M1-R3 PolarHBondContact O-N 3.25Å; R3-Y7 WeakPolarHBondContact O-CB 3.33Å; R3-Y7 PolarHBondContact O-N 3.34Å |
| 4 | K | 31 | Very low | 33.2 | Very low | 156 Ų | 156 | 140.6 Ų | 140.6 | 68% | 0.678 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -84.1 | -19.9 | -179.5 | -149.2 | 175 | -172.7 | 177.3 | 0 | 112.2 | M1 H2 N8 | M1-K4 PolarHBondContact O-N 3.36Å; M1-K4 VanDerWaalsContact O-N 3.12Å; H2-K4 PolarHBondContact O-N 3.41Å; H2-K4 VanDerWaalsContact O-N 3.15Å; K4-N8 WeakPolarHBondContact O-CB 3.45Å; K4-N8 PolarHBondContact O-N 3.42Å; K4-N8 PolarHBondContact O-ND2 2.84Å |
| 5 | K | 33.9 | Very low | 32.8 | Very low | 165 Ų | 165 | 135.9 Ų | 135.9 | 72% | 0.717 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -79.9 | -41.8 | 173.1 | -86.2 | -174.4 | 174.4 | -178.9 | 0 | 111.4 | M1 H2 N8 S9 | M1-K5 PolarHBondContact O-N 3.12Å; H2-K5 PolarHBondContact O-N 3.07Å; H2-K5 VanDerWaalsContact O-N 3.07Å; K5-N8 PolarHBondContact O-N 3.22Å; K5-S9 PolarHBondContact O-N 3.16Å |
| 6 | E | 36 | Very low | 32.5 | Very low | 108 Ų | 108 | 138.3 Ų | 138.3 | 51% | 0.505 | 65% | 0.654 | S | S | . | * | H | α-helix | trans | -67.4 | -40.3 | 174.8 | -84.8 | -179.2 | 132.1 | 0 | 0 | 112.7 | H2 N8 S9 L10 | H2-E6 PolarHBondContact O-N 3.15Å; E6-N8 VanDerWaalsContact C-N 3.28Å; E6-N8 PolarHBondContact O-N 3.02Å; E6-S9 PolarHBondContact O-N 3.04Å; E6-S9 VanDerWaalsContact O-N 3.16Å; E6-S9 PolarHBondContact O-OG 3.18Å; E6-L10 PolarHBondContact O-N 3.36Å |
| 7 | Y | 31.2 | Very low | 32.5 | Very low | 150 Ų | 150 | 134.6 Ų | 134.6 | 59% | 0.588 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -59.9 | -40.4 | 174.2 | -172 | -96.2 | 0 | 0 | 0 | 111.7 | R3 S9 F11 | R3-Y7 WeakPolarHBondContact O-CB 3.33Å; R3-Y7 PolarHBondContact O-N 3.34Å; Y7-S9 PolarHBondContact O-N 2.89Å; Y7-F11 AromaticContact CD2-CD2 3.93Å; Y7-F11 HydrophobicContact CD2-CD2 3.93Å; Y7-F11 HydrophobicContact CD2-CE2 4.36Å; Y7-F11 HydrophobicContact CE1-CB 4.43Å; Y7-F11 AromaticContact CE2-CD2 3.8Å; Y7-F11 HydrophobicContact CE2-CD2 3.8Å; Y7-F11 HydrophobicContact CE2-CE2 4.15Å; Y7-F11 HydrophobicContact CE2-CG 4.49Å; Y7-F11 HydrophobicContact CG-CD2 4.42Å; Y7-F11 WeakPolarHBondContact O-CA 3.47Å; Y7-F11 WeakPolarHBondContact O-CB 3.41Å; Y7-F11 PolarHBondContact O-N 3.5Å |
| 8 | N | 29.8 | Very low | 32.1 | Very low | 63 Ų | 63 | 137.3 Ų | 137.3 | 34% | 0.337 | 65% | 0.651 | S | S | . | * | H | α-helix | trans | -76.7 | -16.8 | 178.1 | -77.5 | -41.5 | 0 | 0 | 0 | 114.4 | K4 K5 E6 F11 | K4-N8 WeakPolarHBondContact O-CB 3.45Å; K4-N8 PolarHBondContact O-N 3.42Å; K4-N8 PolarHBondContact O-ND2 2.84Å; K5-N8 PolarHBondContact O-N 3.22Å; E6-N8 VanDerWaalsContact C-N 3.28Å; E6-N8 PolarHBondContact O-N 3.02Å; N8-F11 CarbonylContact C-O 3.57Å; N8-F11 VanDerWaalsContact CA-O 3.28Å; N8-F11 WeakPolarHBondContact CA-O 3.28Å |
| 9 | S | 39.3 | Very low | 32.1 | Very low | 91 Ų | 91 | 133.7 Ų | 133.7 | 64% | 0.636 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -84.5 | -32.7 | 176.5 | 71.8 | 0 | 0 | 0 | 0 | 112.2 | K5 E6 Y7 | K5-S9 PolarHBondContact O-N 3.16Å; E6-S9 PolarHBondContact O-N 3.04Å; E6-S9 VanDerWaalsContact O-N 3.16Å; E6-S9 PolarHBondContact O-OG 3.18Å; Y7-S9 PolarHBondContact O-N 2.89Å |
| 10 | L | 38.8 | Very low | 32.3 | Very low | 112 Ų | 112 | 132 Ų | 132 | 59% | 0.586 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -85 | -38.4 | 173.5 | -83.8 | 154.7 | 0 | 0 | 0 | 112.3 | E6 | E6-L10 PolarHBondContact O-N 3.36Å |
| 11 | F | 31.8 | Very low | 32.1 | Very low | 95 Ų | 95 | 131.3 Ų | 131.3 | 42% | 0.417 | 63% | 0.631 | S | S | . | * | S | Bend | trans | -112.2 | 96 | 175.5 | -57.3 | -82.9 | 0 | 0 | 0 | 107.2 | Y7 N8 | Y7-F11 AromaticContact CD2-CD2 3.93Å; Y7-F11 HydrophobicContact CD2-CD2 3.93Å; Y7-F11 HydrophobicContact CD2-CE2 4.36Å; Y7-F11 HydrophobicContact CE1-CB 4.43Å; Y7-F11 AromaticContact CE2-CD2 3.8Å; Y7-F11 HydrophobicContact CE2-CD2 3.8Å; Y7-F11 HydrophobicContact CE2-CE2 4.15Å; Y7-F11 HydrophobicContact CE2-CG 4.49Å; Y7-F11 HydrophobicContact CG-CD2 4.42Å; Y7-F11 WeakPolarHBondContact O-CA 3.47Å; Y7-F11 WeakPolarHBondContact O-CB 3.41Å; Y7-F11 PolarHBondContact O-N 3.5Å; N8-F11 CarbonylContact C-O 3.57Å; N8-F11 VanDerWaalsContact CA-O 3.28Å; N8-F11 WeakPolarHBondContact CA-O 3.28Å |
| 12 | G | 29.7 | Very low | 32.2 | Very low | 35 Ų | 35 | 127.3 Ų | 127.3 | 36% | 0.361 | 61% | 0.613 | S | S | . | * | trans | -47.2 | 150.1 | 179.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | R14 G15 | G12-R14 CarbonylContact O-C 3.38Å; G12-R14 WeakPolarHBondContact O-CA 3.01Å; G12-R14 PolarHBondContact O-N 3.44Å; G12-G15 PolarHBondContact O-N 2.68Å | ||
| 13 | K | 32.3 | Very low | 32.3 | Very low | 190 Ų | 190 | 128.1 Ų | 128.1 | 83% | 0.826 | 62% | 0.617 | S | S | * | * | S | Bend | trans | -51.5 | -4.3 | -176.8 | -80.6 | -176 | 175.1 | 179 | 0 | 116.1 | ||
| 14 | R | 30.9 | Very low | 32.4 | Very low | 202 Ų | 202 | 122.8 Ų | 122.8 | 76% | 0.762 | 60% | 0.602 | S | S | * | * | S | Bend | trans | -125.8 | 116.2 | 158.3 | -62.4 | 178.6 | 175.9 | 174.7 | -2.4 | 105.1 | G12 Y16 | G12-R14 CarbonylContact O-C 3.38Å; G12-R14 WeakPolarHBondContact O-CA 3.01Å; G12-R14 PolarHBondContact O-N 3.44Å; R14-Y16 VanDerWaalsContact C-N 3.26Å; R14-Y16 HydrophobicContact CB-CD2 3.64Å; R14-Y16 HydrophobicContact CB-CE2 3.45Å; R14-Y16 VanDerWaalsContact CB-CE2 3.45Å; R14-Y16 WeakPolarHBondContact O-CD2 3.45Å; R14-Y16 PolarHBondContact O-N 2.67Å |
| 15 | G | 26.5 | Very low | 32.7 | Very low | 69 Ų | 69 | 118.8 Ų | 118.8 | 71% | 0.711 | 59% | 0.59 | S | S | * | * | trans | -56.8 | 75.8 | -166 | 0 | 0 | 0 | 0 | 0 | 115.6 | G12 | G12-G15 PolarHBondContact O-N 2.68Š| ||
| 16 | Y | 27.7 | Very low | 32.7 | Very low | 175 Ų | 175 | 118.2 Ų | 118.2 | 69% | 0.686 | 59% | 0.59 | S | S | * | * | trans | -118.2 | 117.4 | -179.6 | -66.7 | -68.7 | 0 | 0 | 0 | 108.8 | R14 K18 | R14-Y16 VanDerWaalsContact C-N 3.26Å; R14-Y16 HydrophobicContact CB-CD2 3.64Å; R14-Y16 HydrophobicContact CB-CE2 3.45Å; R14-Y16 VanDerWaalsContact CB-CE2 3.45Å; R14-Y16 WeakPolarHBondContact O-CD2 3.45Å; R14-Y16 PolarHBondContact O-N 2.67Å; Y16-K18 PolarHBondContact O-N 3.16Å | ||
| 17 | V | 32.4 | Very low | 32.6 | Very low | 76 Ų | 76 | 119.4 Ų | 119.4 | 46% | 0.461 | 60% | 0.595 | S | S | . | * | P | Polyproline II helix | trans | -66.4 | 117 | 168.5 | 179.2 | 0 | 0 | 0 | 0 | 107.2 | M363 | V17-M363 HydrophobicContact CG2-CE 4.41Å; V17-M363 HydrophobicContact CG2-SD 4.11Å |
| 18 | K | 25.6 | Very low | 32.8 | Very low | 183 Ų | 183 | 115 Ų | 115 | 80% | 0.796 | 58% | 0.582 | S | S | * | * | P | Polyproline II helix | trans | -63.4 | 137.8 | 167.9 | -88.6 | -176.1 | 175 | -178.8 | 0 | 108.3 | Y16 I20 | Y16-K18 PolarHBondContact O-N 3.16Å; K18-I20 PolarHBondContact O-N 3.15Å; K18-I20 VanDerWaalsContact O-N 3.13Å |
| 19 | P | 33.3 | Very low | 33 | Very low | 68 Ų | 68 | 117.1 Ų | 117.1 | 44% | 0.442 | 59% | 0.593 | S | S | . | * | P | Polyproline II helix | trans | -59.7 | 118.5 | 174 | -15.5 | 28 | 0 | 0 | 0 | 109 | M21 | P19-M21 PolarHBondContact O-N 2.94Š|
| 20 | I | 34.5 | Very low | 32.8 | Very low | 99 Ų | 99 | 121.6 Ų | 121.6 | 51% | 0.508 | 60% | 0.601 | S | S | . | * | P | Polyproline II helix | trans | -72.7 | 118.4 | -179.7 | -59.1 | 168.1 | 0 | 0 | 0 | 107.6 | K18 E24 V25 | K18-I20 PolarHBondContact O-N 3.15Å; K18-I20 VanDerWaalsContact O-N 3.13Å; I20-E24 HydrophobicContact CG2-CB 4.4Å; I20-V25 HydrophobicContact CG2-CG2 4.1Å |
| 21 | M | 28.7 | Very low | 32.7 | Very low | 118 Ų | 118 | 120.1 Ų | 120.1 | 58% | 0.581 | 59% | 0.593 | S | S | * | * | P | Polyproline II helix | trans | -80.2 | 140.5 | 173.2 | -71.8 | -77.2 | -73.4 | 0 | 0 | 109 | P19 E23 E24 | P19-M21 PolarHBondContact O-N 2.94Å; M21-E23 PolarHBondContact O-N 3.1Å; M21-E24 PolarHBondContact O-N 3.13Å |
| 22 | I | 38 | Very low | 32.9 | Very low | 132 Ų | 132 | 119.2 Ų | 119.2 | 68% | 0.677 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -55.6 | -25.1 | -170.8 | -66.7 | 168.7 | 0 | 0 | 0 | 113.7 | E24 V25 | I22-E24 VanDerWaalsContact C-N 3.29Å; I22-E24 PolarHBondContact O-N 3.11Å; I22-V25 PolarHBondContact O-N 2.88Å |
| 23 | E | 33.2 | Very low | 33.1 | Very low | 175 Ų | 175 | 125.5 Ų | 125.5 | 82% | 0.818 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -67.8 | -26.5 | 176.3 | -74.9 | 178.6 | 164.7 | 0 | 0 | 113.2 | M21 | M21-E23 PolarHBondContact O-N 3.1Å |
| 24 | E | 35.7 | Very low | 33.2 | Very low | 116 Ų | 116 | 119.6 Ų | 119.6 | 54% | 0.542 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -79.7 | -17.3 | 177.2 | -67.9 | -179.5 | 159.5 | 0 | 0 | 112.8 | I20 M21 I22 H26 E27 L28 | I20-E24 HydrophobicContact CG2-CB 4.4Å; M21-E24 PolarHBondContact O-N 3.13Å; I22-E24 VanDerWaalsContact C-N 3.29Å; I22-E24 PolarHBondContact O-N 3.11Å; E24-H26 VanDerWaalsContact C-N 3.3Å; E24-H26 PolarHBondContact O-N 3.4Å; E24-E27 PolarHBondContact O-N 3.33Å; E24-L28 WeakPolarHBondContact O-CG 3.36Å; E24-L28 PolarHBondContact O-N 3.19Å |
| 25 | V | 37.4 | Very low | 33.3 | Very low | 73 Ų | 73 | 116 Ų | 116 | 44% | 0.442 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -67.8 | -33.2 | 177.5 | -178.6 | 0 | 0 | 0 | 0 | 111.1 | I20 I22 L28 D29 | I20-V25 HydrophobicContact CG2-CG2 4.1Å; I22-V25 PolarHBondContact O-N 2.88Å; V25-L28 PolarHBondContact O-N 3.39Å; V25-D29 PolarHBondContact O-N 3.02Å |
| 26 | H | 34 | Very low | 33.9 | Very low | 152 Ų | 152 | 120.1 Ų | 120.1 | 70% | 0.704 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -75.6 | -25.8 | 175.9 | -109.1 | -19.9 | 0 | 0 | 0 | 113.6 | E24 | E24-H26 VanDerWaalsContact C-N 3.3Å; E24-H26 PolarHBondContact O-N 3.4Å |
| 27 | E | 33.4 | Very low | 34.6 | Very low | 133 Ų | 133 | 119 Ų | 119 | 62% | 0.621 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -76.2 | -30.9 | 170.3 | -71.7 | -154.4 | 151.6 | 0 | 0 | 112.1 | E24 D29 K30 I31 | E24-E27 PolarHBondContact O-N 3.33Å; E27-D29 VanDerWaalsContact C-N 3.32Å; E27-D29 PolarHBondContact O-N 3.31Å; E27-K30 PolarHBondContact O-N 3.4Å; E27-K30 VanDerWaalsContact O-N 3.11Å; E27-I31 WeakPolarHBondContact O-CG1 3.18Å; E27-I31 PolarHBondContact O-N 3.28Å; E27-I31 VanDerWaalsContact O-N 3.1Å |
| 28 | L | 35 | Very low | 35 | Very low | 59 Ų | 59 | 119.7 Ų | 119.7 | 31% | 0.309 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -63.5 | -34.5 | 175.8 | -75.5 | 165.4 | 0 | 0 | 0 | 112.8 | E24 V25 K30 I31 N32 | E24-L28 WeakPolarHBondContact O-CG 3.36Å; E24-L28 PolarHBondContact O-N 3.19Å; V25-L28 PolarHBondContact O-N 3.39Å; L28-K30 PolarHBondContact O-N 3.31Å; L28-I31 PolarHBondContact O-N 3.44Å; L28-I31 VanDerWaalsContact O-N 3.13Å; L28-N32 WeakPolarHBondContact O-CB 3.42Å; L28-N32 VanDerWaalsContact O-CG 3.26Å; L28-N32 PolarHBondContact O-N 2.93Å |
| 29 | D | 35.1 | Very low | 36 | Very low | 106 Ų | 106 | 116.1 Ų | 116.1 | 57% | 0.567 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -63.4 | -29.6 | 174 | -81.3 | -20.4 | 0 | 0 | 0 | 112.9 | V25 E27 | V25-D29 PolarHBondContact O-N 3.02Å; E27-D29 VanDerWaalsContact C-N 3.32Å; E27-D29 PolarHBondContact O-N 3.31Å |
| 30 | K | 35 | Very low | 37 | Very low | 186 Ų | 186 | 116.4 Ų | 116.4 | 81% | 0.809 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -82.2 | -25 | 174.2 | -73.1 | -173.3 | 178.7 | 177.8 | 0 | 113.1 | E27 L28 | E27-K30 PolarHBondContact O-N 3.4Å; E27-K30 VanDerWaalsContact O-N 3.11Å; L28-K30 PolarHBondContact O-N 3.31Å |
| 31 | I | 36.7 | Very low | 38.1 | Very low | 80 Ų | 80 | 113.1 Ų | 113.1 | 41% | 0.41 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -85.7 | -16 | 178.5 | -63.2 | 167.3 | 0 | 0 | 0 | 111.7 | E27 L28 N33 | E27-I31 WeakPolarHBondContact O-CG1 3.18Å; E27-I31 PolarHBondContact O-N 3.28Å; E27-I31 VanDerWaalsContact O-N 3.1Å; L28-I31 PolarHBondContact O-N 3.44Å; L28-I31 VanDerWaalsContact O-N 3.13Å; I31-N33 PolarHBondContact O-N 3.41Å; I31-N33 VanDerWaalsContact O-N 3.15Å |
| 32 | N | 34.9 | Very low | 40.2 | Very low | 76 Ų | 76 | 113.8 Ų | 113.8 | 41% | 0.406 | 59% | 0.591 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -69.5 | -6.6 | -176.2 | -90.7 | -15.6 | 0 | 0 | 0 | 116.1 | L28 G34 | L28-N32 WeakPolarHBondContact O-CB 3.42Å; L28-N32 VanDerWaalsContact O-CG 3.26Å; L28-N32 PolarHBondContact O-N 2.93Å; N32-G34 PolarHBondContact O-N 3Å; N32-G34 VanDerWaalsContact O-N 3.16Å |
| 33 | N | 35.2 | Very low | 41.9 | Very low | 167 Ų | 167 | 108.4 Ų | 108.4 | 89% | 0.893 | 56% | 0.563 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79 | 14.5 | 176.8 | -84.2 | -8 | 0 | 0 | 0 | 115 | I31 | I31-N33 PolarHBondContact O-N 3.41Å; I31-N33 VanDerWaalsContact O-N 3.15Å |
| 34 | G | 33.1 | Very low | 43.9 | Very low | 66 Ų | 66 | 107 Ų | 107 | 68% | 0.68 | 56% | 0.555 | S | S | * | * | S | Bend | trans | -162.8 | 17 | 176.8 | 0 | 0 | 0 | 0 | 0 | 117.1 | N32 | N32-G34 PolarHBondContact O-N 3Å; N32-G34 VanDerWaalsContact O-N 3.16Å |
| 35 | R | 34.2 | Very low | 46.2 | Very low | 127 Ų | 127 | 106.8 Ų | 106.8 | 48% | 0.479 | 55% | 0.552 | S | S | . | * | trans | -121.8 | 83.4 | 174.7 | -77.2 | -177 | 177.3 | 168 | 0 | 110 | ||||
| 36 | D | 38.3 | Very low | 48.5 | Very low | 155 Ų | 155 | 105.7 Ų | 105.7 | 83% | 0.829 | 55% | 0.545 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -52.8 | 136.6 | 156.9 | -65.8 | -41.2 | 0 | 0 | 0 | 108.7 | ||
| 37 | D | 42.3 | Very low | 51.1 | Low | 153 Ų | 153 | 98.5 Ų | 98.5 | 82% | 0.818 | 51% | 0.512 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 79.9 | 44.4 | 172.7 | -51.3 | -26.3 | 0 | 0 | 0 | 118.8 | P39 | D37-P39 WeakPolarHBondContact O-CD 3.34Š|
| 38 | I | 41.2 | Very low | 53.9 | Low | 89 Ų | 89 | 93.1 Ų | 93.1 | 46% | 0.456 | 49% | 0.492 | S | S | . | . | trans | -75.5 | 111 | 145.5 | -56.6 | 176.7 | 0 | 0 | 0 | 106.2 | V40 | I38-V40 PolarHBondContact O-N 3.1Š| ||
| 39 | P | 46 | Very low | 56.7 | Low | 109 Ų | 109 | 92.6 Ų | 92.6 | 71% | 0.708 | 49% | 0.49 | S | S | * | . | trans | -62.5 | 105.8 | 178.9 | 23.9 | -31.5 | 0 | 0 | 0 | 109 | D37 V41 | D37-P39 WeakPolarHBondContact O-CD 3.34Å; P39-V41 PolarHBondContact O-N 3.24Å | ||
| 40 | V | 54.4 | Low | 59.4 | Low | 73 Ų | 73 | 90.4 Ų | 90.4 | 44% | 0.442 | 49% | 0.486 | S | S | . | . | trans | -66.3 | 117 | 176.2 | -173 | 0 | 0 | 0 | 0 | 107.5 | I38 Q42 N501 | I38-V40 PolarHBondContact O-N 3.1Å; V40-Q42 HydrophobicContact CB-CG 4.35Å; V40-Q42 HydrophobicContact CG1-CG 3.67Å; V40-Q42 PolarHBondContact O-N 3.13Å; V40-N501 HydrophobicContact CG1-CB 4.03Å | ||
| 41 | V | 59 | Low | 62 | Low | 30 Ų | 30 | 82.7 Ų | 82.7 | 18% | 0.182 | 46% | 0.456 | C | S | . | . | trans | -76.9 | 92.9 | -179.5 | -177 | 0 | 0 | 0 | 0 | 108.5 | P39 L361 M366 V498 | P39-V41 PolarHBondContact O-N 3.24Å; V41-L361 HydrophobicContact CG1-CB 3.82Å; V41-L361 HydrophobicContact CG1-CD1 3.83Å; V41-L361 HydrophobicContact CG1-CG 4.42Å; V41-M366 HydrophobicContact CB-CE 3.96Å; V41-M366 HydrophobicContact CG1-CE 3.34Å; V41-M366 HydrophobicContact CG1-SD 3.71Å; V41-V498 HydrophobicContact CG2-CG1 4.47Å | ||
| 42 | Q | 71.4 | Confident | 64.7 | Low | 133 Ų | 133 | 78.9 Ų | 78.9 | 62% | 0.621 | 44% | 0.437 | S | S | * | . | trans | -111.9 | 158.4 | 176.4 | -60.4 | -171.9 | -18 | 0 | 0 | 111.4 | V40 K44 M366 | V40-Q42 HydrophobicContact CB-CG 4.35Å; V40-Q42 HydrophobicContact CG1-CG 3.67Å; V40-Q42 PolarHBondContact O-N 3.13Å; Q42-K44 PolarHBondContact O-N 3.37Å; Q42-M366 WeakPolarHBondContact O-CE 3.46Å | ||
| 43 | L | 73.7 | Confident | 67.5 | Low | 18 Ų | 18 | 76.9 Ų | 76.9 | 9% | 0.094 | 43% | 0.426 | C | S | . | . | trans | -57.9 | 131.2 | 172 | -68.2 | 172.9 | 0 | 0 | 0 | 109.9 | E261 F346 L361 | L43-E261 HydrophobicContact CB-CG 3.89Å; L43-E261 HydrophobicContact CD1-CG 4.26Å; L43-F346 HydrophobicContact CD1-CD1 4.46Å; L43-F346 HydrophobicContact CD1-CE1 4.16Å; L43-F346 HydrophobicContact CG-CE1 4.47Å; L43-L361 HydrophobicContact CD2-CD1 4.4Å; L43-L361 HydrophobicContact CD2-CD2 3.86Å | ||
| 44 | K | 76.8 | Confident | 70.2 | Confident | 146 Ų | 146 | 69.2 Ų | 69.2 | 64% | 0.635 | 38% | 0.384 | S | S | * | . | trans | -77 | 127.4 | -176.6 | -171.6 | 178.6 | 179.7 | 171.5 | 0 | 110.4 | Q42 T46 | Q42-K44 PolarHBondContact O-N 3.37Å; K44-T46 HydrophobicContact CB-CG2 4.29Å; K44-T46 HydrophobicContact CD-CG2 4.02Å; K44-T46 HydrophobicContact CG-CG2 3.88Å; K44-T46 PolarHBondContact O-N 3.34Å; K44-T46 VanDerWaalsContact O-N 3.16Å | ||
| 45 | K | 84.1 | Confident | 72.8 | Confident | 111 Ų | 111 | 66.1 Ų | 66.1 | 48% | 0.483 | 35% | 0.353 | S | S | . | . | trans | -65.9 | 112.3 | 170.8 | -68 | -177.8 | 177.8 | -175 | 0 | 110.5 | E260 E261 M262 N263 | K45-E260 WeakPolarHBondContact CG-O 3.05Å; K45-E261 CarbonylContact C-O 3.26Å; K45-E261 WeakPolarHBondContact CA-O 3.38Å; K45-M262 WeakPolarHBondContact CD-O 3.43Å; K45-N263 PolarHBondContact O-OD1 3.5Å | ||
| 46 | T | 84.6 | Confident | 75.6 | Confident | 50 Ų | 50 | 60.1 Ų | 60.1 | 31% | 0.307 | 33% | 0.33 | S | S | . | . | trans | -136.9 | -15.7 | -177.2 | 55.8 | 0 | 0 | 0 | 0 | 113.1 | K44 E261 | K44-T46 HydrophobicContact CB-CG2 4.29Å; K44-T46 HydrophobicContact CD-CG2 4.02Å; K44-T46 HydrophobicContact CG-CG2 3.88Å; K44-T46 PolarHBondContact O-N 3.34Å; K44-T46 VanDerWaalsContact O-N 3.16Å; T46-E261 PolarHBondContact N-O 2.99Å | ||
| 47 | I | 88.3 | Confident | 78.2 | Confident | 1 Ų | 1 | 52.9 Ų | 52.9 | 1% | 0.005 | 29% | 0.291 | C | S | . | . | B | Isolated β-bridge | trans | -90.6 | 114.1 | -173.9 | -55.3 | 176.1 | 0 | 0 | 0 | 109.2 | I55 T191 M258 E261 M262 N263 | I47-I55 HydrophobicContact CD1-CD1 4.13Å; I47-I55 HydrophobicContact CG2-CD1 4.08Å; I47-T191 HydrophobicContact CG1-CG2 4.34Å; I47-M258 HydrophobicContact CD1-CB 4.13Å; I47-M258 HydrophobicContact CD1-CE 3.56Å; I47-M258 HydrophobicContact CD1-SD 4.26Å; I47-E261 HydrophobicContact CD1-CB 3.76Å; I47-E261 HydrophobicContact CG1-CB 4.19Å; I47-E261 PolarHBondContact N-O 2.91Å; I47-M262 HydrophobicContact CB-CG 4.49Å; I47-M262 WeakPolarHBondContact O-CA 3.34Å; I47-N263 PolarHBondContact O-N 3.26Å; I47-N263 PolarHBondContact O-ND2 3Å |
| 48 | G | 92.2 | Very high | 80.4 | Confident | 20 Ų | 20 | 45.6 Ų | 45.6 | 21% | 0.206 | 25% | 0.252 | C | S | . | . | trans | -93.1 | -177.6 | 171.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | A50 S51 S52 | G48-A50 PolarHBondContact O-N 3.31Å; G48-S51 PolarHBondContact O-N 3.48Å; G48-S52 WeakPolarHBondContact O-CB 3.35Å; G48-S52 PolarHBondContact O-N 2.87Å; G48-S52 PolarHBondContact O-OG 3.35Å | ||
| 49 | L | 93.7 | Very high | 82.6 | Confident | 48 Ų | 48 | 42.2 Ų | 42.2 | 25% | 0.251 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -58.2 | -46 | -179.7 | 177.3 | 60.1 | 0 | 0 | 0 | 113.5 | S51 S52 I53 D268 L271 A272 | L49-S51 PolarHBondContact O-N 2.85Å; L49-S52 WeakPolarHBondContact O-CB 3.48Å; L49-S52 PolarHBondContact O-N 3.2Å; L49-S52 VanDerWaalsContact O-N 3.12Å; L49-I53 HydrophobicContact CD1-CD1 4.02Å; L49-I53 HydrophobicContact CD1-CG1 4.24Å; L49-I53 HydrophobicContact CG-CD1 4.04Å; L49-I53 WeakPolarHBondContact O-CG1 3.33Å; L49-I53 PolarHBondContact O-N 3.32Å; L49-D268 HydrophobicContact CB-CB 4.28Å; L49-D268 HydrophobicContact CD1-CB 4.13Å; L49-L271 HydrophobicContact CD1-CB 3.91Å; L49-L271 HydrophobicContact CD2-CD1 4.33Å; L49-A272 HydrophobicContact CD1-CB 4.3Å |
| 50 | A | 92.4 | Very high | 84.7 | Confident | 60 Ų | 60 | 37.3 Ų | 37.3 | 50% | 0.496 | 20% | 0.204 | S | C | . | . | H | α-helix | trans | -60.2 | -49.7 | -179.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | G48 S52 I53 T54 | G48-A50 PolarHBondContact O-N 3.31Å; A50-S52 VanDerWaalsContact C-N 3.26Å; A50-S52 PolarHBondContact O-N 3.06Å; A50-I53 PolarHBondContact O-N 2.98Å; A50-T54 WeakPolarHBondContact O-CG2 3.48Å; A50-T54 PolarHBondContact O-N 2.88Å; A50-T54 PolarHBondContact O-OG1 2.87Å |
| 51 | S | 90.3 | Very high | 86.3 | Confident | 25 Ų | 25 | 33.9 Ų | 33.9 | 18% | 0.175 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -64.9 | -28.5 | 175.1 | -54.6 | 0 | 0 | 0 | 0 | 112.8 | G48 L49 T54 I55 D195 | G48-S51 PolarHBondContact O-N 3.48Å; L49-S51 PolarHBondContact O-N 2.85Å; S51-T54 VanDerWaalsContact C-OG1 3.29Å; S51-T54 WeakPolarHBondContact CA-OG1 3.45Å; S51-T54 PolarHBondContact O-OG1 3.03Å; S51-I55 WeakPolarHBondContact O-CB 3.36Å; S51-I55 VanDerWaalsContact O-CD1 3.31Å; S51-I55 WeakPolarHBondContact O-CD1 3.42Å; S51-I55 WeakPolarHBondContact O-CG1 3.17Å; S51-I55 PolarHBondContact O-N 3.37Å; S51-D195 PolarHBondContact OG-OD2 3.03Å |
| 52 | S | 92.7 | Very high | 87.3 | Confident | 0 Ų | 0 | 32.9 Ų | 32.9 | 0% | 0 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -67.1 | -43.4 | 173.8 | -58.8 | 0 | 0 | 0 | 0 | 111.6 | G48 L49 A50 I55 I56 | G48-S52 WeakPolarHBondContact O-CB 3.35Å; G48-S52 PolarHBondContact O-N 2.87Å; G48-S52 PolarHBondContact O-OG 3.35Å; L49-S52 WeakPolarHBondContact O-CB 3.48Å; L49-S52 PolarHBondContact O-N 3.2Å; L49-S52 VanDerWaalsContact O-N 3.12Å; A50-S52 VanDerWaalsContact C-N 3.26Å; A50-S52 PolarHBondContact O-N 3.06Å; S52-I55 PolarHBondContact O-N 3.4Å; S52-I56 PolarHBondContact O-N 2.97Å; S52-I56 VanDerWaalsContact O-N 3.14Å |
| 53 | I | 94.2 | Very high | 87.2 | Confident | 34 Ų | 34 | 27.6 Ų | 27.6 | 17% | 0.174 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -62.8 | -49 | 176.5 | -68.8 | 163.6 | 0 | 0 | 0 | 109.6 | L49 A50 I55 I56 V57 A272 I275 S276 | L49-I53 HydrophobicContact CD1-CD1 4.02Å; L49-I53 HydrophobicContact CD1-CG1 4.24Å; L49-I53 HydrophobicContact CG-CD1 4.04Å; L49-I53 WeakPolarHBondContact O-CG1 3.33Å; L49-I53 PolarHBondContact O-N 3.32Å; A50-I53 PolarHBondContact O-N 2.98Å; I53-I55 PolarHBondContact O-N 3.01Å; I53-I56 PolarHBondContact O-N 3.27Å; I53-V57 HydrophobicContact CG2-CG2 4.04Å; I53-V57 WeakPolarHBondContact O-CB 3.33Å; I53-V57 VanDerWaalsContact O-CG2 3.31Å; I53-V57 WeakPolarHBondContact O-CG2 3.32Å; I53-V57 PolarHBondContact O-N 3.49Å; I53-A272 HydrophobicContact CG1-CB 4.02Å; I53-I275 HydrophobicContact CD1-CB 4.45Å; I53-I275 HydrophobicContact CD1-CD1 3.94Å; I53-I275 HydrophobicContact CD1-CG2 4.15Å; I53-I275 HydrophobicContact CG1-CG2 4.44Å; I53-I275 HydrophobicContact CG2-CG2 4.3Å; I53-S276 PolarHBondContact O-OG 3.07Å |
| 54 | T | 91.2 | Very high | 87.5 | Confident | 5 Ų | 5 | 27 Ų | 27 | 3% | 0.031 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -65.3 | -35.1 | 179.9 | 54.2 | 0 | 0 | 0 | 0 | 112.7 | A50 S51 G58 D195 T198 Y199 | A50-T54 WeakPolarHBondContact O-CG2 3.48Å; A50-T54 PolarHBondContact O-N 2.88Å; A50-T54 PolarHBondContact O-OG1 2.87Å; S51-T54 VanDerWaalsContact C-OG1 3.29Å; S51-T54 WeakPolarHBondContact CA-OG1 3.45Å; S51-T54 PolarHBondContact O-OG1 3.03Å; T54-G58 VanDerWaalsContact O-CA 3.3Å; T54-G58 WeakPolarHBondContact O-CA 3.47Å; T54-G58 PolarHBondContact O-N 2.84Å; T54-D195 VanDerWaalsContact CB-OD1 3.28Å; T54-D195 WeakPolarHBondContact CB-OD1 3.44Å; T54-D195 HydrophobicContact CG2-CB 4.41Å; T54-D195 PolarHBondContact OG1-OD1 2.68Å; T54-T198 HydrophobicContact CG2-CG2 4.49Å; T54-T198 PolarHBondContact O-OG1 3.13Å; T54-Y199 HydrophobicContact CG2-CE1 4.02Å |
| 55 | I | 89.2 | Confident | 88 | Confident | 2 Ų | 2 | 20 Ų | 20 | 1% | 0.01 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -61 | -48.8 | 172.7 | -73.4 | 163.9 | 0 | 0 | 0 | 110.2 | I47 S51 S52 I53 S59 T191 Q194 L255 M258 M339 | I47-I55 HydrophobicContact CD1-CD1 4.13Å; I47-I55 HydrophobicContact CG2-CD1 4.08Å; S51-I55 WeakPolarHBondContact O-CB 3.36Å; S51-I55 VanDerWaalsContact O-CD1 3.31Å; S51-I55 WeakPolarHBondContact O-CD1 3.42Å; S51-I55 WeakPolarHBondContact O-CG1 3.17Å; S51-I55 PolarHBondContact O-N 3.37Å; S52-I55 PolarHBondContact O-N 3.4Å; I53-I55 PolarHBondContact O-N 3.01Å; I55-S59 WeakPolarHBondContact O-CB 3.43Å; I55-S59 PolarHBondContact O-N 3.44Å; I55-S59 PolarHBondContact O-OG 2.86Å; I55-T191 HydrophobicContact CD1-CG2 4.39Å; I55-Q194 HydrophobicContact CG1-CG 4.18Å; I55-L255 HydrophobicContact CD1-CD1 4.45Å; I55-L255 HydrophobicContact CG2-CD1 4.44Å; I55-M258 HydrophobicContact CD1-SD 4.48Å; I55-M339 HydrophobicContact CD1-CE 3.95Å; I55-M339 HydrophobicContact CG1-CE 3.95Å |
| 56 | I | 92.2 | Very high | 87.9 | Confident | 0 Ų | 0 | 15 Ų | 15 | 0% | 0 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -65 | -56.5 | 179.1 | -65.5 | 176.6 | 0 | 0 | 0 | 110.5 | S52 I53 G58 S59 M60 W252 L255 A272 I273 | S52-I56 PolarHBondContact O-N 2.97Å; S52-I56 VanDerWaalsContact O-N 3.14Å; I53-I56 PolarHBondContact O-N 3.27Å; I56-G58 VanDerWaalsContact C-N 3.29Å; I56-G58 PolarHBondContact O-N 3.28Å; I56-S59 PolarHBondContact O-N 3.46Å; I56-S59 VanDerWaalsContact O-N 3.14Å; I56-S59 PolarHBondContact O-OG 3.42Å; I56-M60 HydrophobicContact CG2-CG 4.34Å; I56-M60 HydrophobicContact CG2-SD 3.61Å; I56-M60 WeakPolarHBondContact O-CG 3.45Å; I56-M60 PolarHBondContact O-N 3.12Å; I56-W252 HydrophobicContact CG2-CB 4.42Å; I56-L255 HydrophobicContact CD1-CB 4.13Å; I56-L255 HydrophobicContact CD1-CD2 3.68Å; I56-L255 HydrophobicContact CG1-CB 3.87Å; I56-L255 HydrophobicContact CG1-CD2 4.06Å; I56-A272 HydrophobicContact CD1-CB 3.93Å; I56-I273 HydrophobicContact CD1-CG1 3.88Å |
| 57 | V | 92.7 | Very high | 87.7 | Confident | 3 Ų | 3 | 15.7 Ų | 15.7 | 2% | 0.018 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -57.4 | -44.6 | -178.9 | 174.8 | 0 | 0 | 0 | 0 | 110.7 | I53 S59 M60 I61 T198 V202 S276 L279 V280 | I53-V57 HydrophobicContact CG2-CG2 4.04Å; I53-V57 WeakPolarHBondContact O-CB 3.33Å; I53-V57 VanDerWaalsContact O-CG2 3.31Å; I53-V57 WeakPolarHBondContact O-CG2 3.32Å; I53-V57 PolarHBondContact O-N 3.49Å; V57-S59 VanDerWaalsContact C-N 3.34Å; V57-S59 PolarHBondContact O-N 3.34Å; V57-M60 PolarHBondContact O-N 2.96Å; V57-I61 HydrophobicContact CG1-CD1 3.49Å; V57-I61 VanDerWaalsContact CG1-CD1 3.49Å; V57-I61 HydrophobicContact CG1-CG1 4.12Å; V57-I61 VanDerWaalsContact O-CB 3.32Å; V57-I61 WeakPolarHBondContact O-CB 3.34Å; V57-I61 VanDerWaalsContact O-CG1 3.32Å; V57-I61 WeakPolarHBondContact O-CG1 3.41Å; V57-I61 PolarHBondContact O-N 3.09Å; V57-T198 HydrophobicContact CB-CG2 3.92Å; V57-T198 HydrophobicContact CG1-CG2 3.75Å; V57-V202 HydrophobicContact CG1-CG2 3.8Å; V57-S276 WeakPolarHBondContact CG2-OG 3.21Å; V57-L279 HydrophobicContact CG2-CD2 4.09Å; V57-V280 HydrophobicContact CG1-CG2 4.27Å; V57-V280 HydrophobicContact CG2-CG2 4.32Å |
| 58 | G | 89 | Confident | 87.7 | Confident | 0 Ų | 0 | 15.8 Ų | 15.8 | 0% | 0 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -70.7 | -26.6 | -179 | 0 | 0 | 0 | 0 | 0 | 114.2 | T54 I56 T198 K201 | T54-G58 VanDerWaalsContact O-CA 3.3Å; T54-G58 WeakPolarHBondContact O-CA 3.47Å; T54-G58 PolarHBondContact O-N 2.84Å; I56-G58 VanDerWaalsContact C-N 3.29Å; I56-G58 PolarHBondContact O-N 3.28Å; G58-T198 VanDerWaalsContact CA-OG1 3.29Å; G58-T198 WeakPolarHBondContact CA-OG1 3.38Å; G58-K201 PolarHBondContact O-NZ 3.45Å |
| 59 | S | 86.7 | Confident | 87.7 | Confident | 19 Ų | 19 | 15 Ų | 15 | 13% | 0.133 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -79.5 | -35.4 | 173.1 | 67.5 | 0 | 0 | 0 | 0 | 112.6 | I55 I56 V57 G251 | I55-S59 WeakPolarHBondContact O-CB 3.43Å; I55-S59 PolarHBondContact O-N 3.44Å; I55-S59 PolarHBondContact O-OG 2.86Å; I56-S59 PolarHBondContact O-N 3.46Å; I56-S59 VanDerWaalsContact O-N 3.14Å; I56-S59 PolarHBondContact O-OG 3.42Å; V57-S59 VanDerWaalsContact C-N 3.34Å; V57-S59 PolarHBondContact O-N 3.34Å; S59-G251 PolarHBondContact OG-O 3.35Å |
| 60 | M | 89.7 | Confident | 87.6 | Confident | 5 Ų | 5 | 13.2 Ų | 13.2 | 3% | 0.025 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -74.6 | -50.3 | 176.6 | -65.6 | 173.6 | 76.2 | 0 | 0 | 111.8 | I56 V57 G62 Y249 S250 W252 V280 Y284 | I56-M60 HydrophobicContact CG2-CG 4.34Å; I56-M60 HydrophobicContact CG2-SD 3.61Å; I56-M60 WeakPolarHBondContact O-CG 3.45Å; I56-M60 PolarHBondContact O-N 3.12Å; V57-M60 PolarHBondContact O-N 2.96Å; M60-G62 PolarHBondContact O-N 2.94Å; M60-Y249 HydrophobicContact CE-CD1 3.65Å; M60-Y249 HydrophobicContact CE-CG 4.44Å; M60-Y249 WeakPolarHBondContact CE-O 3.36Å; M60-S250 VanDerWaalsContact CA-O 3.32Å; M60-S250 WeakPolarHBondContact CA-O 3.4Å; M60-W252 HydrophobicContact CE-CB 4.49Å; M60-W252 HydrophobicContact CG-CB 4.47Å; M60-W252 HydrophobicContact SD-CB 3.96Å; M60-V280 HydrophobicContact CB-CG1 4.28Å; M60-V280 HydrophobicContact CB-CG2 4.23Å; M60-V280 HydrophobicContact CE-CB 4.11Å; M60-V280 HydrophobicContact CE-CG1 3.9Å; M60-V280 HydrophobicContact CE-CG2 4.41Å; M60-V280 HydrophobicContact SD-CB 4.48Å; M60-V280 HydrophobicContact SD-CG2 4.15Å; M60-Y284 VanDerWaalsContact C-OH 3.32Å; M60-Y284 PolarHBondContact O-OH 3.2Å |
| 61 | I | 88.8 | Confident | 87.4 | Confident | 1 Ų | 1 | 11 Ų | 11 | 1% | 0.005 | 7% | 0.073 | C | C | . | . | S | Bend | trans | -71.8 | 93.7 | 178.4 | -57.4 | -178.7 | 0 | 0 | 0 | 108.9 | V57 K201 V202 L205 V280 I283 Y284 S329 | V57-I61 HydrophobicContact CG1-CD1 3.49Å; V57-I61 VanDerWaalsContact CG1-CD1 3.49Å; V57-I61 HydrophobicContact CG1-CG1 4.12Å; V57-I61 VanDerWaalsContact O-CB 3.32Å; V57-I61 WeakPolarHBondContact O-CB 3.34Å; V57-I61 VanDerWaalsContact O-CG1 3.32Å; V57-I61 WeakPolarHBondContact O-CG1 3.41Å; V57-I61 PolarHBondContact O-N 3.09Å; I61-K201 HydrophobicContact CB-CD 4.31Å; I61-K201 HydrophobicContact CG2-CB 3.97Å; I61-K201 HydrophobicContact CG2-CD 4.13Å; I61-K201 HydrophobicContact CG2-CG 4.46Å; I61-K201 VanDerWaalsContact O-CD 3.31Å; I61-K201 WeakPolarHBondContact O-CD 3.4Å; I61-K201 PolarHBondContact O-NZ 3.37Å; I61-V202 HydrophobicContact CD1-CG2 3.94Å; I61-L205 HydrophobicContact CD1-CD1 4.02Å; I61-L205 HydrophobicContact CG1-CD1 4.46Å; I61-L205 HydrophobicContact CG2-CD1 3.55Å; I61-V280 HydrophobicContact CD1-CG2 4.24Å; I61-V280 HydrophobicContact CG1-CG1 4.46Å; I61-V280 HydrophobicContact CG1-CG2 4.03Å; I61-I283 HydrophobicContact CD1-CD1 4.37Å; I61-Y284 WeakPolarHBondContact CA-OH 3.34Å; I61-Y284 HydrophobicContact CG1-CE1 3.96Å; I61-S329 PolarHBondContact O-OG 2.84Å |
| 62 | G | 79.4 | Confident | 87.5 | Confident | 10 Ų | 10 | 9.8 Ų | 9.8 | 10% | 0.103 | 6% | 0.064 | C | C | . | . | S | Bend | trans | -130.5 | -143.9 | 179 | 0 | 0 | 0 | 0 | 0 | 112 | M60 G64 F66 | M60-G62 PolarHBondContact O-N 2.94Å; G62-G64 VanDerWaalsContact C-N 3.26Å; G62-G64 PolarHBondContact O-N 2.95Å; G62-F66 WeakPolarHBondContact O-CD2 3.12Å; G62-F66 WeakPolarHBondContact O-CE2 3.34Å |
| 63 | S | 70.1 | Confident | 87.4 | Confident | 22 Ų | 22 | 10.4 Ų | 10.4 | 15% | 0.154 | 7% | 0.067 | C | C | . | . | S | Bend | trans | -69.2 | -23.6 | 174.7 | 49.9 | 0 | 0 | 0 | 0 | 113.3 | I65 F66 V67 | S63-I65 PolarHBondContact O-N 3.49Å; S63-F66 PolarHBondContact O-N 3.49Å; S63-V67 PolarHBondContact O-N 3.32Å |
| 64 | G | 79.6 | Confident | 87.3 | Confident | 4 Ų | 4 | 14.2 Ų | 14.2 | 4% | 0.041 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -55.5 | -46.1 | -174.6 | 0 | 0 | 0 | 0 | 0 | 114.1 | G62 F66 V67 S68 | G62-G64 VanDerWaalsContact C-N 3.26Å; G62-G64 PolarHBondContact O-N 2.95Å; G64-F66 PolarHBondContact O-N 3.16Å; G64-F66 VanDerWaalsContact O-N 3.11Å; G64-V67 PolarHBondContact O-N 3.35Å; G64-S68 WeakPolarHBondContact O-CA 3.05Å; G64-S68 WeakPolarHBondContact O-CB 3.33Å; G64-S68 PolarHBondContact O-N 2.96Å; G64-S68 PolarHBondContact O-OG 3.01Å; G64-S68 VanDerWaalsContact O-OG 3.11Å |
| 65 | I | 87.1 | Confident | 87.3 | Confident | 0 Ų | 0 | 15.1 Ų | 15.1 | 0% | 0 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -64.7 | -18.8 | 179.6 | -172.1 | 51.9 | 0 | 0 | 0 | 114.1 | S63 P69 W86 L205 Y284 A287 N288 | S63-I65 PolarHBondContact O-N 3.49Å; I65-P69 WeakPolarHBondContact O-CD 3.36Å; I65-P69 WeakPolarHBondContact O-CG 3.43Å; I65-W86 HydrophobicContact CD1-CH2 3.74Å; I65-W86 HydrophobicContact CD1-CZ2 4.11Å; I65-W86 HydrophobicContact CD1-CZ3 4.08Å; I65-L205 HydrophobicContact CG1-CD2 4.26Å; I65-L205 HydrophobicContact CG2-CD1 4.43Å; I65-L205 HydrophobicContact CG2-CD2 4.24Å; I65-Y284 HydrophobicContact CB-CD1 3.9Å; I65-Y284 HydrophobicContact CB-CE1 3.51Å; I65-Y284 HydrophobicContact CD1-CD1 3.55Å; I65-Y284 HydrophobicContact CD1-CD2 4.34Å; I65-Y284 HydrophobicContact CD1-CE1 4.1Å; I65-Y284 HydrophobicContact CD1-CG 3.66Å; I65-Y284 HydrophobicContact CG1-CD1 3.55Å; I65-Y284 HydrophobicContact CG1-CE1 3.71Å; I65-Y284 HydrophobicContact CG1-CG 4.19Å; I65-Y284 HydrophobicContact CG2-CE1 4.01Å; I65-A287 HydrophobicContact CD1-CB 4.47Å; I65-N288 WeakPolarHBondContact CD1-ND2 3.41Å |
| 66 | F | 83 | Confident | 87.5 | Confident | 5 Ų | 5 | 15 Ų | 15 | 2% | 0.022 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -92.9 | -25.4 | -179.6 | -53.5 | -55.4 | 0 | 0 | 0 | 112.9 | G62 S63 G64 L205 A305 V306 A307 V326 | G62-F66 WeakPolarHBondContact O-CD2 3.12Å; G62-F66 WeakPolarHBondContact O-CE2 3.34Å; S63-F66 PolarHBondContact O-N 3.49Å; G64-F66 PolarHBondContact O-N 3.16Å; G64-F66 VanDerWaalsContact O-N 3.11Å; F66-L205 HydrophobicContact CE1-CD2 3.84Å; F66-L205 HydrophobicContact CZ-CD2 4.21Å; F66-A305 WeakPolarHBondContact O-CA 3.46Å; F66-V306 PolarHBondContact O-N 2.91Å; F66-A307 HydrophobicContact CB-CB 4.44Å; F66-A307 HydrophobicContact CD1-CB 3.41Å; F66-A307 VanDerWaalsContact CD1-CB 3.41Å; F66-A307 HydrophobicContact CE1-CB 3.98Å; F66-A307 HydrophobicContact CG-CB 4.24Å; F66-V326 HydrophobicContact CD1-CG2 4.35Å; F66-V326 HydrophobicContact CD2-CB 4.45Å; F66-V326 HydrophobicContact CD2-CG1 3.8Å; F66-V326 HydrophobicContact CD2-CG2 3.9Å; F66-V326 HydrophobicContact CE1-CG2 4.23Å; F66-V326 HydrophobicContact CE2-CB 4.3Å; F66-V326 HydrophobicContact CE2-CG1 4.01Å; F66-V326 HydrophobicContact CE2-CG2 3.8Å; F66-V326 HydrophobicContact CG-CG2 4.17Å; F66-V326 HydrophobicContact CZ-CG2 3.95Å |
| 67 | V | 80.2 | Confident | 87.5 | Confident | 65 Ų | 65 | 18.9 Ų | 18.9 | 39% | 0.394 | 11% | 0.109 | S | C | . | . | H | α-helix | trans | -110 | -39.8 | -174.2 | -177.7 | 0 | 0 | 0 | 0 | 112.2 | S63 G64 P69 T70 | S63-V67 PolarHBondContact O-N 3.32Å; G64-V67 PolarHBondContact O-N 3.35Å; V67-P69 VanDerWaalsContact C-N 3.34Å; V67-T70 PolarHBondContact O-N 3.44Å |
| 68 | S | 88.1 | Confident | 87.5 | Confident | 3 Ų | 3 | 18.8 Ų | 18.8 | 2% | 0.021 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -60.4 | -26.9 | -178.8 | -66.6 | 0 | 0 | 0 | 0 | 115.8 | G64 T70 G71 I72 V244 | G64-S68 WeakPolarHBondContact O-CA 3.05Å; G64-S68 WeakPolarHBondContact O-CB 3.33Å; G64-S68 PolarHBondContact O-N 2.96Å; G64-S68 PolarHBondContact O-OG 3.01Å; G64-S68 VanDerWaalsContact O-OG 3.11Å; S68-T70 PolarHBondContact O-N 3.21Å; S68-G71 PolarHBondContact O-N 3.07Å; S68-I72 VanDerWaalsContact O-CG1 3.32Å; S68-I72 WeakPolarHBondContact O-CG1 3.28Å; S68-I72 PolarHBondContact O-N 3.27Å; S68-V244 PolarHBondContact OG-O 2.9Å |
| 69 | P | 92.1 | Very high | 87.6 | Confident | 3 Ų | 3 | 19.4 Ų | 19.4 | 2% | 0.019 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -54.8 | -42.3 | 175 | -27.9 | 36.1 | 0 | 0 | 0 | 112.7 | I65 V67 M73 W86 N288 Y291 V306 | I65-P69 WeakPolarHBondContact O-CD 3.36Å; I65-P69 WeakPolarHBondContact O-CG 3.43Å; V67-P69 VanDerWaalsContact C-N 3.34Å; P69-M73 VanDerWaalsContact O-CB 3.29Å; P69-M73 WeakPolarHBondContact O-CB 3.37Å; P69-M73 PolarHBondContact O-N 2.69Å; P69-W86 HydrophobicContact CG-CZ2 4.05Å; P69-N288 WeakPolarHBondContact CB-OD1 3.27Å; P69-N288 WeakPolarHBondContact CG-OD1 3.31Å; P69-Y291 HydrophobicContact CG-CD2 4.3Å; P69-Y291 HydrophobicContact CG-CE2 4.19Å; P69-V306 HydrophobicContact CB-CG2 3.92Å; P69-V306 HydrophobicContact CG-CG2 4.45Å |
| 70 | T | 90.9 | Very high | 88 | Confident | 12 Ų | 12 | 18.7 Ų | 18.7 | 7% | 0.074 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -61.7 | -54.5 | 176.5 | -58 | 0 | 0 | 0 | 0 | 110.9 | V67 S68 I72 M73 E74 I300 T303 | V67-T70 PolarHBondContact O-N 3.44Å; S68-T70 PolarHBondContact O-N 3.21Å; T70-I72 VanDerWaalsContact C-N 3.31Å; T70-I72 PolarHBondContact O-N 3Å; T70-M73 PolarHBondContact O-N 3.48Å; T70-M73 VanDerWaalsContact O-N 3.14Å; T70-E74 HydrophobicContact CG2-CG 4.41Å; T70-E74 WeakPolarHBondContact CG2-OE1 3.44Å; T70-E74 WeakPolarHBondContact O-CG 3.41Å; T70-E74 PolarHBondContact O-N 3.08Å; T70-I300 WeakPolarHBondContact CB-O 3.45Å; T70-I300 WeakPolarHBondContact CG2-O 3.45Å; T70-I300 PolarHBondContact OG1-O 2.99Å; T70-T303 PolarHBondContact OG1-O 2.93Å |
| 71 | G | 87.9 | Confident | 88.2 | Confident | 12 Ų | 12 | 18.5 Ų | 18.5 | 12% | 0.124 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -66.9 | -26.6 | -177.6 | 0 | 0 | 0 | 0 | 0 | 114.5 | S68 N75 | S68-G71 PolarHBondContact O-N 3.07Å; G71-N75 PolarHBondContact O-ND2 3.29Å |
| 72 | I | 92.7 | Very high | 88.5 | Confident | 0 Ų | 0 | 18.8 Ų | 18.8 | 0% | 0 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -72.1 | -48.9 | 170.9 | -66.1 | 166.4 | 0 | 0 | 0 | 109.5 | S68 T70 E74 N75 V76 S82 I85 W86 A241 V244 | S68-I72 VanDerWaalsContact O-CG1 3.32Å; S68-I72 WeakPolarHBondContact O-CG1 3.28Å; S68-I72 PolarHBondContact O-N 3.27Å; T70-I72 VanDerWaalsContact C-N 3.31Å; T70-I72 PolarHBondContact O-N 3Å; I72-E74 VanDerWaalsContact C-N 3.3Å; I72-E74 PolarHBondContact O-N 2.82Å; I72-N75 PolarHBondContact O-N 3Å; I72-V76 HydrophobicContact CG2-CG2 4.21Å; I72-V76 WeakPolarHBondContact O-CG2 3.27Å; I72-V76 PolarHBondContact O-N 3.46Å; I72-S82 VanDerWaalsContact CG2-OG 3.24Å; I72-S82 WeakPolarHBondContact CG2-OG 3.24Å; I72-I85 HydrophobicContact CD1-CG2 4.39Å; I72-I85 HydrophobicContact CG1-CG2 4.49Å; I72-I85 HydrophobicContact CG2-CB 4.17Å; I72-I85 HydrophobicContact CG2-CG2 4.12Å; I72-W86 HydrophobicContact CD1-CD2 3.97Å; I72-W86 HydrophobicContact CD1-CG 4.35Å; I72-W86 HydrophobicContact CD1-CH2 4.35Å; I72-W86 HydrophobicContact CD1-CZ2 3.63Å; I72-A241 HydrophobicContact CG2-CB 4.31Å; I72-V244 HydrophobicContact CG1-CB 4.21Å; I72-V244 HydrophobicContact CG1-CG1 4.04Å |
| 73 | M | 91.9 | Very high | 89.3 | Confident | 13 Ų | 13 | 19.9 Ų | 19.9 | 6% | 0.064 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -60.1 | -39.4 | -179.5 | -168.9 | 68 | -167.5 | 0 | 0 | 112 | P69 T70 N75 N77 I79 P297 I300 L301 | P69-M73 VanDerWaalsContact O-CB 3.29Å; P69-M73 WeakPolarHBondContact O-CB 3.37Å; P69-M73 PolarHBondContact O-N 2.69Å; T70-M73 PolarHBondContact O-N 3.48Å; T70-M73 VanDerWaalsContact O-N 3.14Å; M73-N75 PolarHBondContact O-N 3.11Å; M73-N77 WeakPolarHBondContact O-CA 3.44Å; M73-N77 PolarHBondContact O-N 2.85Å; M73-I79 HydrophobicContact CE-CG1 4.08Å; M73-I79 HydrophobicContact SD-CG1 4.09Å; M73-P297 HydrophobicContact CE-CB 4.28Å; M73-I300 HydrophobicContact CB-CG2 4.12Å; M73-I300 HydrophobicContact CG-CG2 4.35Å; M73-L301 HydrophobicContact CB-CD2 3.98Å; M73-L301 HydrophobicContact CG-CD2 3.8Å; M73-L301 HydrophobicContact CG-CG 4.26Å |
| 74 | E | 91.7 | Very high | 90.5 | Very high | 114 Ų | 114 | 22.5 Ų | 22.5 | 53% | 0.533 | 12% | 0.124 | S | C | . | . | H | α-helix | trans | -58.1 | -31.4 | 174.8 | -78 | 174.1 | 178.2 | 0 | 0 | 113.3 | T70 I72 L301 | T70-E74 HydrophobicContact CG2-CG 4.41Å; T70-E74 WeakPolarHBondContact CG2-OE1 3.44Å; T70-E74 WeakPolarHBondContact O-CG 3.41Å; T70-E74 PolarHBondContact O-N 3.08Å; I72-E74 VanDerWaalsContact C-N 3.3Å; I72-E74 PolarHBondContact O-N 2.82Å; E74-L301 HydrophobicContact CB-CD2 4.16Å; E74-L301 HydrophobicContact CG-CD2 3.53Å |
| 75 | N | 90.9 | Very high | 91.3 | Very high | 25 Ų | 25 | 22.6 Ų | 22.6 | 13% | 0.134 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -93.9 | -40.6 | -174.8 | -77.8 | -75.4 | 0 | 0 | 0 | 113.3 | G71 I72 M73 A237 K240 A241 | G71-N75 PolarHBondContact O-ND2 3.29Å; I72-N75 PolarHBondContact O-N 3Å; M73-N75 PolarHBondContact O-N 3.11Å; N75-A237 VanDerWaalsContact O-CB 3.29Å; N75-A237 WeakPolarHBondContact O-CB 3.13Å; N75-K240 HydrophobicContact CB-CB 4.3Å; N75-K240 WeakPolarHBondContact OD1-CB 3.48Å; N75-K240 WeakPolarHBondContact OD1-CD 3.45Å; N75-K240 VanDerWaalsContact OD1-CE 3.26Å; N75-K240 WeakPolarHBondContact OD1-CE 3.44Å; N75-K240 PolarHBondContact OD1-NZ 2.92Å; N75-K240 VanDerWaalsContact OD1-NZ 3.08Å; N75-A241 HydrophobicContact CB-CB 3.89Å |
| 76 | V | 93.4 | Very high | 91.8 | Very high | 0 Ų | 0 | 22.6 Ų | 22.6 | 0% | 0 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -97.1 | -9.4 | 179.6 | -61.1 | 0 | 0 | 0 | 0 | 114 | I72 S78 A81 I85 S231 D232 A241 | I72-V76 HydrophobicContact CG2-CG2 4.21Å; I72-V76 WeakPolarHBondContact O-CG2 3.27Å; I72-V76 PolarHBondContact O-N 3.46Å; V76-S78 PolarHBondContact O-N 2.75Å; V76-A81 HydrophobicContact CB-CB 3.83Å; V76-A81 HydrophobicContact CG2-CB 3.75Å; V76-I85 HydrophobicContact CG1-CG1 4.15Å; V76-S231 WeakPolarHBondContact O-CA 3.49Å; V76-D232 PolarHBondContact O-N 3.46Å; V76-A241 HydrophobicContact CG1-CB 3.69Å |
| 77 | N | 91.6 | Very high | 92.5 | Very high | 80 Ų | 80 | 25 Ų | 25 | 43% | 0.428 | 14% | 0.138 | S | C | . | . | trans | 54.1 | 23.4 | 175.1 | -160.5 | 35.4 | 0 | 0 | 0 | 115.4 | M73 | M73-N77 WeakPolarHBondContact O-CA 3.44Å; M73-N77 PolarHBondContact O-N 2.85Å | ||
| 78 | S | 92.2 | Very high | 93.3 | Very high | 2 Ų | 2 | 23.6 Ų | 23.6 | 1% | 0.014 | 13% | 0.133 | C | C | . | . | trans | -151.5 | 140.7 | -177.4 | 152.9 | 0 | 0 | 0 | 0 | 111.2 | V76 G80 A81 S82 A227 F228 S231 | V76-S78 PolarHBondContact O-N 2.75Å; S78-G80 PolarHBondContact OG-N 3.44Å; S78-A81 PolarHBondContact OG-N 3.43Å; S78-A81 VanDerWaalsContact OG-N 3.11Å; S78-S82 VanDerWaalsContact O-CB 3.27Å; S78-S82 WeakPolarHBondContact O-CB 3.3Å; S78-S82 PolarHBondContact O-N 3.01Å; S78-A227 PolarHBondContact OG-O 2.65Å; S78-F228 WeakPolarHBondContact OG-CA 3.36Å; S78-S231 WeakPolarHBondContact CB-OG 3.5Å; S78-S231 PolarHBondContact OG-OG 3.06Å | ||
| 79 | I | 92.5 | Very high | 93.7 | Very high | 13 Ų | 13 | 23.4 Ų | 23.4 | 7% | 0.067 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -67.1 | -46.6 | 176.4 | -70.6 | 170.9 | 0 | 0 | 0 | 110.7 | M73 A81 S82 L83 G223 L224 A227 V292 P297 | M73-I79 HydrophobicContact CE-CG1 4.08Å; M73-I79 HydrophobicContact SD-CG1 4.09Å; I79-A81 PolarHBondContact O-N 2.83Å; I79-S82 WeakPolarHBondContact O-CB 3.48Å; I79-S82 PolarHBondContact O-N 3.31Å; I79-L83 HydrophobicContact CG2-CD1 4.27Å; I79-L83 WeakPolarHBondContact O-CG 3.44Å; I79-L83 PolarHBondContact O-N 3.43Å; I79-G223 WeakPolarHBondContact CD1-O 3.36Å; I79-L224 HydrophobicContact CG2-CD2 4.43Å; I79-A227 PolarHBondContact N-O 3.05Å; I79-V292 HydrophobicContact CD1-CB 4.02Å; I79-V292 HydrophobicContact CD1-CG1 3.65Å; I79-V292 HydrophobicContact CG1-CG1 3.95Å; I79-V292 HydrophobicContact CG2-CG1 3.91Å; I79-V292 HydrophobicContact CG2-CG2 4.38Å; I79-P297 HydrophobicContact CD1-CG 3.87Å |
| 80 | G | 93.6 | Very high | 93.9 | Very high | 4 Ų | 4 | 23.3 Ų | 23.3 | 4% | 0.041 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -61.1 | -45.2 | 179.8 | 0 | 0 | 0 | 0 | 0 | 112 | S78 L83 I84 A227 | S78-G80 PolarHBondContact OG-N 3.44Å; G80-L83 PolarHBondContact O-N 2.94Å; G80-I84 WeakPolarHBondContact O-CG1 3.48Å; G80-I84 PolarHBondContact O-N 3.21Å; G80-A227 PolarHBondContact N-O 3.07Å |
| 81 | A | 94.5 | Very high | 94.1 | Very high | 0 Ų | 0 | 26.7 Ų | 26.7 | 0% | 0 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -63.1 | -42.5 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | V76 S78 I79 L83 I84 I85 W233 | V76-A81 HydrophobicContact CB-CB 3.83Å; V76-A81 HydrophobicContact CG2-CB 3.75Å; S78-A81 PolarHBondContact OG-N 3.43Å; S78-A81 VanDerWaalsContact OG-N 3.11Å; I79-A81 PolarHBondContact O-N 2.83Å; A81-L83 VanDerWaalsContact C-N 3.35Å; A81-L83 PolarHBondContact O-N 3.41Å; A81-I84 PolarHBondContact O-N 3.15Å; A81-I84 VanDerWaalsContact O-N 3.16Å; A81-I85 WeakPolarHBondContact O-CG1 3.09Å; A81-I85 PolarHBondContact O-N 3.34Å; A81-W233 HydrophobicContact CB-CH2 4.06Å; A81-W233 HydrophobicContact CB-CZ2 3.93Å |
| 82 | S | 95 | Very high | 94.5 | Very high | 8 Ų | 8 | 26.4 Ų | 26.4 | 6% | 0.056 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -57.8 | -44.8 | 176.7 | 177.2 | 0 | 0 | 0 | 0 | 112.1 | I72 S78 I79 I84 I85 W86 | I72-S82 VanDerWaalsContact CG2-OG 3.24Å; I72-S82 WeakPolarHBondContact CG2-OG 3.24Å; S78-S82 VanDerWaalsContact O-CB 3.27Å; S78-S82 WeakPolarHBondContact O-CB 3.3Å; S78-S82 PolarHBondContact O-N 3.01Å; I79-S82 WeakPolarHBondContact O-CB 3.48Å; I79-S82 PolarHBondContact O-N 3.31Å; S82-I84 VanDerWaalsContact C-N 3.34Å; S82-I84 PolarHBondContact O-N 3.48Å; S82-I85 WeakPolarHBondContact O-CB 3.09Å; S82-I85 PolarHBondContact O-N 3.12Å; S82-W86 PolarHBondContact O-N 3.27Å |
| 83 | L | 95.8 | Very high | 94.6 | Very high | 32 Ų | 32 | 26.4 Ų | 26.4 | 17% | 0.168 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -62.4 | -39.2 | 176.5 | -67.8 | 175.2 | 0 | 0 | 0 | 112.6 | I79 G80 A81 W86 V87 T285 N288 V289 | I79-L83 HydrophobicContact CG2-CD1 4.27Å; I79-L83 WeakPolarHBondContact O-CG 3.44Å; I79-L83 PolarHBondContact O-N 3.43Å; G80-L83 PolarHBondContact O-N 2.94Å; A81-L83 VanDerWaalsContact C-N 3.35Å; A81-L83 PolarHBondContact O-N 3.41Å; L83-W86 PolarHBondContact O-N 2.95Å; L83-V87 WeakPolarHBondContact O-CG2 2.99Å; L83-V87 PolarHBondContact O-N 3.07Å; L83-V87 VanDerWaalsContact O-N 3.09Å; L83-T285 HydrophobicContact CD2-CG2 4.28Å; L83-N288 HydrophobicContact CD2-CB 3.79Å; L83-V289 HydrophobicContact CD1-CG2 3.93Å; L83-V289 HydrophobicContact CD2-CG2 3.82Å |
| 84 | I | 96.6 | Very high | 94.8 | Very high | 78 Ų | 78 | 27.9 Ų | 27.9 | 40% | 0.4 | 15% | 0.151 | S | C | . | . | H | α-helix | trans | -63.2 | -43.5 | 174.2 | -68.6 | 175.1 | 0 | 0 | 0 | 110.6 | G80 A81 S82 W86 V87 A88 F228 W233 | G80-I84 WeakPolarHBondContact O-CG1 3.48Å; G80-I84 PolarHBondContact O-N 3.21Å; A81-I84 PolarHBondContact O-N 3.15Å; A81-I84 VanDerWaalsContact O-N 3.16Å; S82-I84 VanDerWaalsContact C-N 3.34Å; S82-I84 PolarHBondContact O-N 3.48Å; I84-W86 VanDerWaalsContact C-N 3.34Å; I84-W86 PolarHBondContact O-N 2.82Å; I84-V87 PolarHBondContact O-N 2.9Å; I84-A88 VanDerWaalsContact O-CB 3.27Å; I84-A88 WeakPolarHBondContact O-CB 3.41Å; I84-A88 PolarHBondContact O-N 2.9Å; I84-F228 HydrophobicContact CD1-CE1 3.67Å; I84-F228 HydrophobicContact CD1-CZ 4Å; I84-W233 HydrophobicContact CD1-CH2 3.93Å; I84-W233 HydrophobicContact CG2-CH2 4.48Å |
| 85 | I | 96.3 | Very high | 95 | Very high | 6 Ų | 6 | 24 Ų | 24 | 3% | 0.031 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -60.4 | -43.1 | 176.2 | -64.9 | -64.3 | 0 | 0 | 0 | 111 | I72 V76 A81 S82 V87 A88 C89 I238 A241 F242 | I72-I85 HydrophobicContact CD1-CG2 4.39Å; I72-I85 HydrophobicContact CG1-CG2 4.49Å; I72-I85 HydrophobicContact CG2-CB 4.17Å; I72-I85 HydrophobicContact CG2-CG2 4.12Å; V76-I85 HydrophobicContact CG1-CG1 4.15Å; A81-I85 WeakPolarHBondContact O-CG1 3.09Å; A81-I85 PolarHBondContact O-N 3.34Å; S82-I85 WeakPolarHBondContact O-CB 3.09Å; S82-I85 PolarHBondContact O-N 3.12Å; I85-V87 PolarHBondContact O-N 3.28Å; I85-A88 PolarHBondContact O-N 3.44Å; I85-C89 WeakPolarHBondContact O-CB 3.44Å; I85-C89 PolarHBondContact O-N 2.97Å; I85-C89 PolarHBondContact O-SG 3.23Å; I85-I238 HydrophobicContact CD1-CG2 4.14Å; I85-A241 HydrophobicContact CG1-CB 4.32Å; I85-A241 HydrophobicContact CG2-CB 4.27Å; I85-F242 HydrophobicContact CD1-CD2 4.28Å; I85-F242 HydrophobicContact CG2-CD2 4.41Å |
| 86 | W | 97 | Very high | 95.2 | Very high | 0 Ų | 0 | 22.8 Ų | 22.8 | 0% | 0 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -58.1 | -47 | 175.6 | -83 | 108.6 | 0 | 0 | 0 | 112.4 | I65 P69 I72 S82 L83 I84 G90 A248 Y249 Y284 N288 | I65-W86 HydrophobicContact CD1-CH2 3.74Å; I65-W86 HydrophobicContact CD1-CZ2 4.11Å; I65-W86 HydrophobicContact CD1-CZ3 4.08Å; P69-W86 HydrophobicContact CG-CZ2 4.05Å; I72-W86 HydrophobicContact CD1-CD2 3.97Å; I72-W86 HydrophobicContact CD1-CG 4.35Å; I72-W86 HydrophobicContact CD1-CH2 4.35Å; I72-W86 HydrophobicContact CD1-CZ2 3.63Å; S82-W86 PolarHBondContact O-N 3.27Å; L83-W86 PolarHBondContact O-N 2.95Å; I84-W86 VanDerWaalsContact C-N 3.34Å; I84-W86 PolarHBondContact O-N 2.82Å; W86-G90 PolarHBondContact O-N 2.61Å; W86-A248 HydrophobicContact CH2-CB 3.62Å; W86-A248 HydrophobicContact CZ3-CB 3.66Å; W86-Y249 HydrophobicContact CE3-CD2 4.41Å; W86-Y249 AromaticContact CE3-CE2 3.58Å; W86-Y249 HydrophobicContact CE3-CE2 3.58Å; W86-Y249 HydrophobicContact CZ3-CD2 4.43Å; W86-Y249 AromaticContact CZ3-CE2 3.99Å; W86-Y249 HydrophobicContact CZ3-CE2 3.99Å; W86-Y249 VanDerWaalsContact O-CE2 3.22Å; W86-Y249 WeakPolarHBondContact O-CE2 3.29Å; W86-Y249 VanDerWaalsContact O-CZ 3.3Å; W86-Y249 PolarHBondContact O-OH 2.86Å; W86-Y284 AromaticContact CE3-CD2 3.8Å; W86-Y284 HydrophobicContact CE3-CD2 3.8Å; W86-Y284 HydrophobicContact CE3-CG 4.22Å; W86-Y284 HydrophobicContact CH2-CD2 4.4Å; W86-Y284 AromaticContact CZ3-CD2 3.37Å; W86-Y284 HydrophobicContact CZ3-CD2 3.37Å; W86-Y284 AromaticContact CZ3-CE2 3.96Å; W86-Y284 HydrophobicContact CZ3-CE2 3.96Å; W86-Y284 AromaticContact CZ3-CG 3.96Å; W86-Y284 HydrophobicContact CZ3-CG 3.96Å; W86-N288 PolarHBondContact NE1-ND2 3.43Å; W86-N288 PolarHBondContact NE1-OD1 2.92Å; W86-N288 VanDerWaalsContact NE1-OD1 3.09Å |
| 87 | V | 97.9 | Very high | 95.3 | Very high | 56 Ų | 56 | 22.8 Ų | 22.8 | 34% | 0.339 | 13% | 0.127 | S | C | . | . | H | α-helix | trans | -66.1 | -45 | 178.5 | 175.1 | 0 | 0 | 0 | 0 | 110.8 | L83 I84 I85 C89 G90 L91 T285 | L83-V87 WeakPolarHBondContact O-CG2 2.99Å; L83-V87 PolarHBondContact O-N 3.07Å; L83-V87 VanDerWaalsContact O-N 3.09Å; I84-V87 PolarHBondContact O-N 2.9Å; I85-V87 PolarHBondContact O-N 3.28Å; V87-C89 PolarHBondContact O-N 3.16Å; V87-G90 PolarHBondContact O-N 3.07Å; V87-G90 VanDerWaalsContact O-N 3.16Å; V87-L91 HydrophobicContact CG1-CD1 4.1Å; V87-L91 HydrophobicContact CG1-CG 4.38Å; V87-L91 WeakPolarHBondContact O-CG 3.38Å; V87-L91 PolarHBondContact O-N 3.48Å; V87-T285 HydrophobicContact CG2-CG2 3.96Å; V87-T285 WeakPolarHBondContact CG2-OG1 3.34Å |
| 88 | A | 96.8 | Very high | 95.5 | Very high | 34 Ų | 34 | 21.6 Ų | 21.6 | 28% | 0.281 | 12% | 0.117 | S | C | . | . | H | α-helix | trans | -63.5 | -41.4 | -178.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | I84 I85 G90 L91 F92 F242 | I84-A88 VanDerWaalsContact O-CB 3.27Å; I84-A88 WeakPolarHBondContact O-CB 3.41Å; I84-A88 PolarHBondContact O-N 2.9Å; I85-A88 PolarHBondContact O-N 3.44Å; A88-G90 VanDerWaalsContact C-N 3.3Å; A88-G90 PolarHBondContact O-N 2.91Å; A88-L91 PolarHBondContact O-N 3.04Å; A88-F92 WeakPolarHBondContact O-CB 3.47Å; A88-F92 PolarHBondContact O-N 3.25Å; A88-F242 HydrophobicContact CB-CE2 3.75Å; A88-F242 HydrophobicContact CB-CZ 4.43Å |
| 89 | C | 95.8 | Very high | 95.7 | Very high | 0 Ų | 0 | 21.5 Ų | 21.5 | 0% | 0 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -61.2 | -39.3 | 173.8 | -70.7 | 0 | 0 | 0 | 0 | 111.8 | I85 V87 S93 L246 Y249 | I85-C89 WeakPolarHBondContact O-CB 3.44Å; I85-C89 PolarHBondContact O-N 2.97Å; I85-C89 PolarHBondContact O-SG 3.23Å; V87-C89 PolarHBondContact O-N 3.16Å; C89-S93 VanDerWaalsContact O-CB 3.27Å; C89-S93 WeakPolarHBondContact O-CB 3.49Å; C89-S93 PolarHBondContact O-N 3.45Å; C89-S93 PolarHBondContact O-OG 3.06Å; C89-L246 HydrophobicContact CB-CD2 3.94Å; C89-Y249 HydrophobicContact CB-CD2 3.47Å; C89-Y249 VanDerWaalsContact CB-CD2 3.47Å; C89-Y249 HydrophobicContact CB-CE2 3.54Å; C89-Y249 HydrophobicContact CB-CG 4.48Å |
| 90 | G | 96.5 | Very high | 95.8 | Very high | 0 Ų | 0 | 20.9 Ų | 20.9 | 0% | 0 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -64.6 | -49.8 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | W86 V87 A88 S93 M94 Y249 T281 | W86-G90 PolarHBondContact O-N 2.61Å; V87-G90 PolarHBondContact O-N 3.07Å; V87-G90 VanDerWaalsContact O-N 3.16Å; A88-G90 VanDerWaalsContact C-N 3.3Å; A88-G90 PolarHBondContact O-N 2.91Å; G90-S93 PolarHBondContact O-N 3.42Å; G90-M94 PolarHBondContact O-N 3.43Å; G90-Y249 VanDerWaalsContact CA-CE1 3.49Å; G90-T281 WeakPolarHBondContact CA-OG1 3.27Å |
| 91 | L | 96.3 | Very high | 95.9 | Very high | 83 Ų | 83 | 20.7 Ų | 20.7 | 44% | 0.435 | 11% | 0.111 | S | C | . | . | H | α-helix | trans | -62.4 | -44 | 176.1 | -67.1 | 177.8 | 0 | 0 | 0 | 111.7 | V87 A88 S93 M94 L95 | V87-L91 HydrophobicContact CG1-CD1 4.1Å; V87-L91 HydrophobicContact CG1-CG 4.38Å; V87-L91 WeakPolarHBondContact O-CG 3.38Å; V87-L91 PolarHBondContact O-N 3.48Å; A88-L91 PolarHBondContact O-N 3.04Å; L91-S93 PolarHBondContact O-N 2.84Å; L91-M94 HydrophobicContact CD2-CE 4.08Å; L91-M94 WeakPolarHBondContact O-CB 3.3Å; L91-M94 PolarHBondContact O-N 2.87Å; L91-L95 WeakPolarHBondContact O-CG 3.23Å; L91-L95 PolarHBondContact O-N 2.82Å; L91-L95 VanDerWaalsContact O-N 3.08Å |
| 92 | F | 95.7 | Very high | 95.9 | Very high | 6 Ų | 6 | 20.7 Ų | 20.7 | 3% | 0.026 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -59.8 | -46.1 | 176.1 | 177.6 | -99.3 | 0 | 0 | 0 | 111.7 | A88 M94 L95 G96 F242 L246 Y434 I437 | A88-F92 WeakPolarHBondContact O-CB 3.47Å; A88-F92 PolarHBondContact O-N 3.25Å; F92-M94 VanDerWaalsContact C-N 3.3Å; F92-M94 PolarHBondContact O-N 3.45Å; F92-L95 WeakPolarHBondContact O-CB 3.5Å; F92-L95 PolarHBondContact O-N 2.78Å; F92-G96 PolarHBondContact O-N 2.92Å; F92-G96 VanDerWaalsContact O-N 3.14Å; F92-F242 HydrophobicContact CB-CE1 4.21Å; F92-F242 HydrophobicContact CB-CZ 3.91Å; F92-F242 AromaticContact CD1-CE1 3.93Å; F92-F242 HydrophobicContact CD1-CE1 3.93Å; F92-F242 HydrophobicContact CD1-CZ 4.49Å; F92-F242 HydrophobicContact CE1-CE1 4.4Å; F92-F242 AromaticContact CG-CE1 3.98Å; F92-F242 HydrophobicContact CG-CE1 3.98Å; F92-F242 HydrophobicContact CG-CZ 4.15Å; F92-L246 HydrophobicContact CD1-CD1 4.12Å; F92-L246 HydrophobicContact CD1-CD2 3.48Å; F92-L246 VanDerWaalsContact CD1-CD2 3.48Å; F92-L246 HydrophobicContact CD1-CG 4.44Å; F92-L246 HydrophobicContact CE1-CD1 3.86Å; F92-L246 HydrophobicContact CE1-CD2 4.03Å; F92-L246 HydrophobicContact CG-CD2 4.46Å; F92-Y434 HydrophobicContact CD1-CD2 4.39Å; F92-Y434 AromaticContact CD1-CE2 3.74Å; F92-Y434 HydrophobicContact CD1-CE2 3.74Å; F92-Y434 AromaticContact CD2-CD2 3.87Å; F92-Y434 HydrophobicContact CD2-CD2 3.87Å; F92-Y434 HydrophobicContact CD2-CE2 4.05Å; F92-Y434 HydrophobicContact CE1-CD2 4.11Å; F92-Y434 HydrophobicContact CE1-CE1 4.24Å; F92-Y434 AromaticContact CE1-CE2 3.37Å; F92-Y434 HydrophobicContact CE1-CE2 3.37Å; F92-Y434 AromaticContact CE1-CZ 3.44Å; F92-Y434 VanDerWaalsContact CE1-CZ 3.44Å; F92-Y434 WeakPolarHBondContact CE1-OH 3.46Å; F92-Y434 HydrophobicContact CE2-CD1 4.26Å; F92-Y434 AromaticContact CE2-CD2 3.47Å; F92-Y434 HydrophobicContact CE2-CD2 3.47Å; F92-Y434 VanDerWaalsContact CE2-CD2 3.47Å; F92-Y434 HydrophobicContact CE2-CE1 4.38Å; F92-Y434 AromaticContact CE2-CE2 3.65Å; F92-Y434 HydrophobicContact CE2-CE2 3.65Å; F92-Y434 AromaticContact CE2-CG 3.81Å; F92-Y434 HydrophobicContact CE2-CG 3.81Å; F92-Y434 HydrophobicContact CG-CD2 4.33Å; F92-Y434 HydrophobicContact CG-CE2 4.11Å; F92-Y434 HydrophobicContact CZ-CD1 4.03Å; F92-Y434 AromaticContact CZ-CD2 3.64Å; F92-Y434 HydrophobicContact CZ-CD2 3.64Å; F92-Y434 AromaticContact CZ-CE1 3.73Å; F92-Y434 HydrophobicContact CZ-CE1 3.73Å; F92-Y434 AromaticContact CZ-CE2 3.33Å; F92-Y434 HydrophobicContact CZ-CE2 3.33Å; F92-Y434 AromaticContact CZ-CG 3.99Å; F92-Y434 HydrophobicContact CZ-CG 3.99Å; F92-Y434 AromaticContact CZ-CZ 3.37Å; F92-Y434 WeakPolarHBondContact O-CD2 3.5Å; F92-Y434 VanDerWaalsContact O-CE2 3.27Å; F92-Y434 WeakPolarHBondContact O-CE2 3.26Å; F92-I437 HydrophobicContact CD2-CB 4.14Å; F92-I437 HydrophobicContact CD2-CD1 3.94Å; F92-I437 HydrophobicContact CD2-CG2 3.78Å; F92-I437 HydrophobicContact CE2-CB 3.62Å; F92-I437 HydrophobicContact CE2-CD1 4.25Å; F92-I437 HydrophobicContact CE2-CG2 3.43Å; F92-I437 VanDerWaalsContact CE2-CG2 3.43Å; F92-I437 HydrophobicContact CZ-CB 4.48Å; F92-I437 HydrophobicContact CZ-CG2 4.05Å |
| 93 | S | 95.3 | Very high | 95.9 | Very high | 0 Ų | 0 | 20.4 Ų | 20.4 | 0% | 0 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -60.5 | -39.5 | 176.6 | -62.4 | 0 | 0 | 0 | 0 | 112 | C89 G90 L91 L95 G96 A97 Y249 | C89-S93 VanDerWaalsContact O-CB 3.27Å; C89-S93 WeakPolarHBondContact O-CB 3.49Å; C89-S93 PolarHBondContact O-N 3.45Å; C89-S93 PolarHBondContact O-OG 3.06Å; G90-S93 PolarHBondContact O-N 3.42Å; L91-S93 PolarHBondContact O-N 2.84Å; S93-L95 PolarHBondContact O-N 2.87Å; S93-G96 PolarHBondContact O-N 3.48Å; S93-A97 VanDerWaalsContact O-CB 3.29Å; S93-A97 WeakPolarHBondContact O-CB 3.39Å; S93-A97 PolarHBondContact O-N 3.3Å; S93-Y249 WeakPolarHBondContact OG-CB 3.37Å |
| 94 | M | 95.5 | Very high | 95.8 | Very high | 45 Ų | 45 | 18.9 Ų | 18.9 | 22% | 0.222 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -62.2 | -41.5 | 175.5 | -173.1 | 178.7 | 64.6 | 0 | 0 | 112.4 | G90 L91 F92 A97 Y98 C277 L278 | G90-M94 PolarHBondContact O-N 3.43Å; L91-M94 HydrophobicContact CD2-CE 4.08Å; L91-M94 WeakPolarHBondContact O-CB 3.3Å; L91-M94 PolarHBondContact O-N 2.87Å; F92-M94 VanDerWaalsContact C-N 3.3Å; F92-M94 PolarHBondContact O-N 3.45Å; M94-A97 PolarHBondContact O-N 3.14Å; M94-Y98 WeakPolarHBondContact O-CB 3.35Å; M94-Y98 PolarHBondContact O-N 3.26Å; M94-C277 HydrophobicContact CB-CB 3.87Å; M94-C277 HydrophobicContact CG-CB 4.01Å; M94-L278 HydrophobicContact SD-CD2 4.03Å; M94-L278 HydrophobicContact SD-CG 4.2Å |
| 95 | L | 95.9 | Very high | 95.6 | Very high | 31 Ų | 31 | 15.8 Ų | 15.8 | 16% | 0.162 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -61.7 | -45.6 | 176.5 | -64.6 | 176.6 | 0 | 0 | 0 | 111.5 | L91 F92 S93 Y98 C99 F430 I433 Y434 | L91-L95 WeakPolarHBondContact O-CG 3.23Å; L91-L95 PolarHBondContact O-N 2.82Å; L91-L95 VanDerWaalsContact O-N 3.08Å; F92-L95 WeakPolarHBondContact O-CB 3.5Å; F92-L95 PolarHBondContact O-N 2.78Å; S93-L95 PolarHBondContact O-N 2.87Å; L95-Y98 PolarHBondContact O-N 3.17Å; L95-C99 PolarHBondContact O-N 2.85Å; L95-C99 PolarHBondContact O-SG 2.98Å; L95-F430 HydrophobicContact CD2-CB 4.02Å; L95-F430 HydrophobicContact CD2-CD1 3.68Å; L95-F430 HydrophobicContact CD2-CD2 3.87Å; L95-F430 HydrophobicContact CD2-CE1 4.04Å; L95-F430 HydrophobicContact CD2-CE2 4.21Å; L95-F430 HydrophobicContact CD2-CG 3.6Å; L95-F430 HydrophobicContact CD2-CZ 4.3Å; L95-I433 HydrophobicContact CD1-CG2 4.07Å; L95-Y434 HydrophobicContact CB-CD2 4.23Å |
| 96 | G | 95.3 | Very high | 95.4 | Very high | 0 Ų | 0 | 16.2 Ų | 16.2 | 0% | 0 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -63 | -46.2 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | F92 S93 Y98 C99 Y100 Y434 | F92-G96 PolarHBondContact O-N 2.92Å; F92-G96 VanDerWaalsContact O-N 3.14Å; S93-G96 PolarHBondContact O-N 3.48Å; G96-Y98 VanDerWaalsContact C-N 3.34Å; G96-Y98 PolarHBondContact O-N 3.09Å; G96-C99 WeakPolarHBondContact O-CB 3.16Å; G96-C99 PolarHBondContact O-N 3.45Å; G96-C99 VanDerWaalsContact O-N 3.16Å; G96-Y100 WeakPolarHBondContact O-CD2 3.36Å; G96-Y100 PolarHBondContact O-N 3.48Å; G96-Y434 VanDerWaalsContact CA-CD2 3.43Å; G96-Y434 VanDerWaalsContact N-CD2 3.34Å |
| 97 | A | 95.6 | Very high | 95.2 | Very high | 0 Ų | 0 | 17 Ų | 17 | 0% | 0 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -60 | -42.8 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | S93 M94 C99 Y100 A101 W252 I273 | S93-A97 VanDerWaalsContact O-CB 3.29Å; S93-A97 WeakPolarHBondContact O-CB 3.39Å; S93-A97 PolarHBondContact O-N 3.3Å; M94-A97 PolarHBondContact O-N 3.14Å; A97-C99 VanDerWaalsContact C-N 3.32Å; A97-C99 PolarHBondContact O-N 3.31Å; A97-Y100 CarbonylContact O-C 3.58Å; A97-Y100 WeakPolarHBondContact O-CA 3.25Å; A97-Y100 WeakPolarHBondContact O-CB 3.4Å; A97-Y100 PolarHBondContact O-N 2.95Å; A97-Y100 VanDerWaalsContact O-N 3.08Å; A97-A101 PolarHBondContact O-N 3.18Å; A97-W252 VanDerWaalsContact CA-CZ3 3.46Å; A97-W252 HydrophobicContact CB-CB 4.19Å; A97-W252 HydrophobicContact CB-CD2 3.79Å; A97-W252 HydrophobicContact CB-CE3 3.44Å; A97-W252 VanDerWaalsContact CB-CE3 3.44Å; A97-W252 HydrophobicContact CB-CG 4.11Å; A97-W252 HydrophobicContact CB-CZ3 4.09Å; A97-I273 HydrophobicContact CB-CB 4.42Å; A97-I273 HydrophobicContact CB-CD1 4.46Å; A97-I273 HydrophobicContact CB-CG1 4.26Å; A97-I273 HydrophobicContact CB-CG2 3.36Å; A97-I273 WeakPolarHBondContact O-CD1 3.24Å |
| 98 | Y | 95.6 | Very high | 94.6 | Very high | 56 Ų | 56 | 18.1 Ų | 18.1 | 22% | 0.22 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -65.6 | -34.4 | 177.7 | -155 | -98.7 | 0 | 0 | 0 | 112.7 | M94 L95 G96 Y100 A101 E102 P270 I274 A426 F430 | M94-Y98 WeakPolarHBondContact O-CB 3.35Å; M94-Y98 PolarHBondContact O-N 3.26Å; L95-Y98 PolarHBondContact O-N 3.17Å; G96-Y98 VanDerWaalsContact C-N 3.34Å; G96-Y98 PolarHBondContact O-N 3.09Å; Y98-Y100 VanDerWaalsContact C-N 3.34Å; Y98-A101 WeakPolarHBondContact O-CB 3.39Å; Y98-A101 PolarHBondContact O-N 3.43Å; Y98-E102 PolarHBondContact O-N 3.29Å; Y98-P270 HydrophobicContact CE2-CB 4.04Å; Y98-I274 HydrophobicContact CD2-CD1 4.29Å; Y98-I274 HydrophobicContact CD2-CG1 4.31Å; Y98-I274 HydrophobicContact CE2-CD1 3.87Å; Y98-I274 HydrophobicContact CE2-CG1 4.37Å; Y98-A426 HydrophobicContact CD1-CB 3.82Å; Y98-A426 HydrophobicContact CE1-CB 4.3Å; Y98-F430 HydrophobicContact CD1-CD2 4.21Å; Y98-F430 HydrophobicContact CD1-CE2 4.34Å |
| 99 | C | 96.3 | Very high | 94 | Very high | 0 Ų | 0 | 21.3 Ų | 21.3 | 0% | 0 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -64.5 | -39.4 | 171 | -65.3 | 0 | 0 | 0 | 0 | 111.7 | L95 G96 A97 A101 E102 L103 V407 V410 | L95-C99 PolarHBondContact O-N 2.85Å; L95-C99 PolarHBondContact O-SG 2.98Å; G96-C99 WeakPolarHBondContact O-CB 3.16Å; G96-C99 PolarHBondContact O-N 3.45Å; G96-C99 VanDerWaalsContact O-N 3.16Å; A97-C99 VanDerWaalsContact C-N 3.32Å; A97-C99 PolarHBondContact O-N 3.31Å; C99-A101 VanDerWaalsContact C-N 3.31Å; C99-A101 PolarHBondContact O-N 3.05Å; C99-E102 PolarHBondContact O-N 2.97Å; C99-L103 PolarHBondContact O-N 3.39Å; C99-V407 HydrophobicContact CB-CG1 3.94Å; C99-V407 HydrophobicContact CB-CG2 4.3Å; C99-V410 HydrophobicContact CB-CG2 4.07Å |
| 100 | Y | 95 | Very high | 93.2 | Very high | 0 Ų | 0 | 21.3 Ų | 21.3 | 0% | 0 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -65.9 | -31.3 | 172.9 | -91.3 | -122.4 | 0 | 0 | 0 | 112.7 | G96 A97 Y98 E102 L103 G104 D113 Y116 W252 N253 N256 I403 C406 V407 | G96-Y100 WeakPolarHBondContact O-CD2 3.36Å; G96-Y100 PolarHBondContact O-N 3.48Å; A97-Y100 CarbonylContact O-C 3.58Å; A97-Y100 WeakPolarHBondContact O-CA 3.25Å; A97-Y100 WeakPolarHBondContact O-CB 3.4Å; A97-Y100 PolarHBondContact O-N 2.95Å; A97-Y100 VanDerWaalsContact O-N 3.08Å; Y98-Y100 VanDerWaalsContact C-N 3.34Å; Y100-E102 VanDerWaalsContact C-N 3.29Å; Y100-E102 PolarHBondContact O-N 2.98Å; Y100-L103 PolarHBondContact O-N 3.1Å; Y100-G104 PolarHBondContact O-N 3.16Å; Y100-D113 HydrophobicContact CE1-CB 4.05Å; Y100-Y116 HydrophobicContact CD1-CD2 4.43Å; Y100-Y116 AromaticContact CD1-CE2 3.9Å; Y100-Y116 HydrophobicContact CD1-CE2 3.9Å; Y100-Y116 HydrophobicContact CE1-CD2 4.41Å; Y100-Y116 HydrophobicContact CE1-CE2 4.23Å; Y100-W252 AromaticContact CD1-CZ3 3.9Å; Y100-W252 HydrophobicContact CD1-CZ3 3.9Å; Y100-W252 AromaticContact CD2-CH2 3.74Å; Y100-W252 HydrophobicContact CD2-CH2 3.74Å; Y100-W252 AromaticContact CD2-CZ3 3.57Å; Y100-W252 HydrophobicContact CD2-CZ3 3.57Å; Y100-W252 HydrophobicContact CE1-CZ3 4.24Å; Y100-W252 AromaticContact CE2-CH2 3.7Å; Y100-W252 HydrophobicContact CE2-CH2 3.7Å; Y100-W252 AromaticContact CE2-CZ3 3.94Å; Y100-W252 HydrophobicContact CE2-CZ3 3.94Å; Y100-W252 HydrophobicContact CG-CH2 4.18Å; Y100-W252 AromaticContact CG-CZ3 3.54Å; Y100-W252 HydrophobicContact CG-CZ3 3.54Å; Y100-N253 HydrophobicContact CD1-CB 3.84Å; Y100-N253 HydrophobicContact CE1-CB 3.71Å; Y100-N256 HydrophobicContact CD1-CB 4.43Å; Y100-N256 PolarHBondContact O-ND2 3.45Å; Y100-I403 HydrophobicContact CE2-CG2 4.13Å; Y100-C406 HydrophobicContact CE2-CB 3.99Å; Y100-C406 VanDerWaalsContact CZ-SG 3.56Å; Y100-C406 VanDerWaalsContact OH-CB 3.24Å; Y100-C406 WeakPolarHBondContact OH-CB 3.41Å; Y100-C406 PolarHBondContact OH-SG 2.87Å; Y100-V407 HydrophobicContact CD2-CG2 4.16Å; Y100-V407 HydrophobicContact CE2-CG2 3.87Å |
| 101 | A | 95.2 | Very high | 92.5 | Very high | 0 Ų | 0 | 21.3 Ų | 21.3 | 0% | 0 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -60.6 | -40.9 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | A97 Y98 C99 T105 L269 I273 V424 | A97-A101 PolarHBondContact O-N 3.18Å; Y98-A101 WeakPolarHBondContact O-CB 3.39Å; Y98-A101 PolarHBondContact O-N 3.43Å; C99-A101 VanDerWaalsContact C-N 3.31Å; C99-A101 PolarHBondContact O-N 3.05Å; A101-T105 WeakPolarHBondContact O-CB 3.34Å; A101-T105 WeakPolarHBondContact O-CG2 3.41Å; A101-T105 PolarHBondContact O-N 2.96Å; A101-T105 PolarHBondContact O-OG1 3.44Å; A101-L269 HydrophobicContact CB-CD2 4.27Å; A101-L269 HydrophobicContact CB-CG 4.17Å; A101-I273 HydrophobicContact CB-CD1 3.63Å; A101-V424 HydrophobicContact CB-CG1 4.06Å |
| 102 | E | 95.4 | Very high | 92.3 | Very high | 0 Ų | 0 | 17.4 Ų | 17.4 | 0% | 0 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -63.6 | -51.1 | 172.5 | 169.8 | 171.8 | 165.5 | 0 | 0 | 111.7 | Y98 C99 Y100 G104 T105 M106 R414 R422 V424 A426 | Y98-E102 PolarHBondContact O-N 3.29Å; C99-E102 PolarHBondContact O-N 2.97Å; Y100-E102 VanDerWaalsContact C-N 3.29Å; Y100-E102 PolarHBondContact O-N 2.98Å; E102-G104 VanDerWaalsContact C-N 3.31Å; E102-G104 PolarHBondContact O-N 2.98Å; E102-T105 PolarHBondContact O-N 3.34Å; E102-T105 PolarHBondContact O-OG1 3Å; E102-M106 VanDerWaalsContact O-CB 3.28Å; E102-M106 WeakPolarHBondContact O-CB 3.47Å; E102-M106 PolarHBondContact O-N 3.28Å; E102-R414 IonicContact OE1-CZ 3.27Å; E102-R414 IonicContact OE1-NH1 3.19Å; E102-R414 PolarHBondContact OE1-NH1 3.43Å; E102-R414 IonicContact OE1-NH2 2.6Å; E102-R414 PolarHBondContact OE1-NH2 3.3Å; E102-R414 IonicContact OE2-CZ 3.57Å; E102-R414 IonicContact OE2-NH1 3.59Å; E102-R414 IonicContact OE2-NH2 3.8Å; E102-R414 PolarHBondContact OE2-NH2 3.33Å; E102-R422 WeakPolarHBondContact OE1-CD 3.27Å; E102-R422 IonicContact OE1-NE 2.82Å; E102-V424 WeakPolarHBondContact CB-O 3.21Å; E102-V424 WeakPolarHBondContact CG-O 3.27Å; E102-A426 HydrophobicContact CB-CB 4.33Å; E102-A426 WeakPolarHBondContact OE2-CB 3.44Å; E102-A426 PolarHBondContact OE2-N 3.49Å |
| 103 | L | 94.8 | Very high | 92.1 | Very high | 1 Ų | 1 | 17.1 Ų | 17.1 | 1% | 0.005 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -60 | -42.2 | -178.8 | -67.5 | 176.9 | 0 | 0 | 0 | 111.7 | C99 Y100 M106 I107 Y116 C406 I409 V410 F413 | C99-L103 PolarHBondContact O-N 3.39Å; Y100-L103 PolarHBondContact O-N 3.1Å; L103-M106 PolarHBondContact O-N 2.87Å; L103-I107 PolarHBondContact O-N 2.86Å; L103-Y116 HydrophobicContact CB-CD1 4.16Å; L103-Y116 HydrophobicContact CB-CD2 3.8Å; L103-Y116 HydrophobicContact CB-CE1 4.19Å; L103-Y116 HydrophobicContact CB-CE2 3.82Å; L103-Y116 HydrophobicContact CB-CG 4.01Å; L103-Y116 HydrophobicContact CD1-CD2 3.87Å; L103-Y116 HydrophobicContact CD1-CG 4.23Å; L103-Y116 HydrophobicContact CG-CD2 4.48Å; L103-C406 WeakPolarHBondContact CD1-O 3.42Å; L103-I409 HydrophobicContact CD1-CB 4.49Å; L103-I409 HydrophobicContact CD2-CB 4.36Å; L103-I409 HydrophobicContact CD2-CG2 3.91Å; L103-V410 HydrophobicContact CD1-CG2 4.01Å; L103-V410 HydrophobicContact CD2-CG2 3.83Å; L103-V410 HydrophobicContact CG-CG2 3.72Å; L103-F413 HydrophobicContact CD2-CD2 4.13Å; L103-F413 HydrophobicContact CD2-CE2 4.34Å |
| 104 | G | 92.5 | Very high | 91.9 | Very high | 0 Ų | 0 | 17.1 Ų | 17.1 | 0% | 0 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -66.9 | -37.8 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | Y100 E102 M106 I107 Y116 I259 | Y100-G104 PolarHBondContact O-N 3.16Å; E102-G104 VanDerWaalsContact C-N 3.31Å; E102-G104 PolarHBondContact O-N 2.98Å; G104-M106 VanDerWaalsContact C-N 3.34Å; G104-I107 CarbonylContact O-C 3.53Å; G104-I107 VanDerWaalsContact O-O 3.09Å; G104-Y116 WeakPolarHBondContact CA-OH 3.31Å; G104-Y116 PolarHBondContact N-OH 3.44Å; G104-I259 VanDerWaalsContact CA-CD1 3.47Å; G104-I259 WeakPolarHBondContact O-CD1 3.39Å |
| 105 | T | 92.9 | Very high | 91.8 | Very high | 14 Ų | 14 | 15 Ų | 15 | 9% | 0.086 | 7% | 0.066 | C | C | . | . | H | α-helix | trans | -78.9 | -20.1 | 177.3 | 57.5 | 0 | 0 | 0 | 0 | 113.4 | A101 E102 L269 V424 | A101-T105 WeakPolarHBondContact O-CB 3.34Å; A101-T105 WeakPolarHBondContact O-CG2 3.41Å; A101-T105 PolarHBondContact O-N 2.96Å; A101-T105 PolarHBondContact O-OG1 3.44Å; E102-T105 PolarHBondContact O-N 3.34Å; E102-T105 PolarHBondContact O-OG1 3Å; T105-L269 HydrophobicContact CG2-CD2 4.13Å; T105-V424 HydrophobicContact CG2-CB 4.29Å; T105-V424 HydrophobicContact CG2-CG2 3.79Å; T105-V424 WeakPolarHBondContact OG1-CB 3.27Å; T105-V424 PolarHBondContact OG1-N 3.17Å |
| 106 | M | 93.2 | Very high | 91.8 | Very high | 15 Ų | 15 | 13.5 Ų | 13.5 | 7% | 0.074 | 6% | 0.058 | C | C | . | . | H | α-helix | trans | -84.1 | -43.8 | 173.2 | -177.4 | 172.1 | 161.7 | 0 | 0 | 112.3 | E102 L103 G104 F413 K417 H420 R422 | E102-M106 VanDerWaalsContact O-CB 3.28Å; E102-M106 WeakPolarHBondContact O-CB 3.47Å; E102-M106 PolarHBondContact O-N 3.28Å; L103-M106 PolarHBondContact O-N 2.87Å; G104-M106 VanDerWaalsContact C-N 3.34Å; M106-F413 HydrophobicContact CE-CB 4.33Å; M106-F413 HydrophobicContact CE-CD2 3.68Å; M106-F413 HydrophobicContact CE-CE2 4.23Å; M106-F413 HydrophobicContact CE-CG 4.16Å; M106-F413 HydrophobicContact SD-CD2 4.02Å; M106-K417 HydrophobicContact CE-CB 3.85Å; M106-K417 HydrophobicContact CE-CD 3.68Å; M106-K417 HydrophobicContact CE-CG 4.39Å; M106-H420 HydrophobicContact CE-CB 3.7Å; M106-R422 HydrophobicContact SD-CG 4.17Å |
| 107 | I | 91 | Very high | 91.8 | Very high | 17 Ų | 17 | 13.9 Ų | 13.9 | 9% | 0.087 | 6% | 0.061 | C | C | . | . | S | Bend | trans | -107.9 | 88.3 | 176.1 | -57.1 | 169.5 | 0 | 0 | 0 | 108 | L103 G104 R109 I115 Y116 E119 F413 | L103-I107 PolarHBondContact O-N 2.86Å; G104-I107 CarbonylContact O-C 3.53Å; G104-I107 VanDerWaalsContact O-O 3.09Å; I107-R109 PolarHBondContact O-N 3.46Å; I107-I115 HydrophobicContact CG2-CG1 4.24Å; I107-I115 HydrophobicContact CG2-CG2 4.22Å; I107-Y116 HydrophobicContact CB-CD1 4.04Å; I107-Y116 HydrophobicContact CB-CE1 4.07Å; I107-Y116 HydrophobicContact CD1-CD1 3.82Å; I107-Y116 HydrophobicContact CG1-CD1 4.48Å; I107-Y116 HydrophobicContact CG2-CD1 4.33Å; I107-Y116 HydrophobicContact CG2-CE1 4.46Å; I107-E119 HydrophobicContact CD1-CB 3.76Å; I107-E119 HydrophobicContact CD1-CG 4.06Å; I107-E119 HydrophobicContact CG2-CG 4.1Å; I107-F413 HydrophobicContact CD1-CE2 3.72Å; I107-F413 HydrophobicContact CD1-CZ 4.25Å |
| 108 | H | 85.5 | Confident | 91.7 | Very high | 79 Ų | 79 | 16.5 Ų | 16.5 | 37% | 0.366 | 7% | 0.071 | S | C | . | . | trans | -80.7 | 66.2 | -175.1 | -164.3 | 55.9 | 0 | 0 | 0 | 112.3 | I259 | H108-I259 PolarHBondContact CE1-O 3.15Å; H108-I259 VanDerWaalsContact CE1-O 3.28Å | ||
| 109 | R | 85.4 | Confident | 91.6 | Very high | 101 Ų | 101 | 16.9 Ų | 16.9 | 38% | 0.381 | 7% | 0.074 | S | C | . | . | S | Bend | trans | -135.7 | 141 | 174.9 | -70.9 | -175.1 | 177.2 | 168.2 | -1.9 | 110.4 | I107 G111 I115 E119 | I107-R109 PolarHBondContact O-N 3.46Å; R109-G111 PolarHBondContact O-N 3.24Å; R109-I115 HydrophobicContact CB-CG1 4.09Å; R109-I115 HydrophobicContact CB-CG2 4.34Å; R109-E119 IonicContact NH1-OE1 3.27Å; R109-E119 PolarHBondContact NH1-OE1 3.07Å |
| 110 | S | 78.6 | Confident | 91.6 | Very high | 0 Ų | 0 | 18.1 Ų | 18.1 | 0% | 0 | 9% | 0.085 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -73.3 | 26.4 | -174.1 | -61.1 | 0 | 0 | 0 | 0 | 115.7 | C257 E260 | S110-C257 WeakPolarHBondContact CB-O 3.47Å; S110-C257 CarbonylContact O-C 3.54Å; S110-C257 WeakPolarHBondContact O-CA 3.38Å; S110-E260 WeakPolarHBondContact CB-OE2 3.32Å; S110-E260 PolarHBondContact N-OE2 3.29Å; S110-E260 VanDerWaalsContact N-OE2 3.07Å; S110-E260 VanDerWaalsContact OG-CB 3.24Å; S110-E260 WeakPolarHBondContact OG-CB 3.24Å; S110-E260 VanDerWaalsContact OG-CG 3.3Å; S110-E260 WeakPolarHBondContact OG-CG 3.44Å; S110-E260 PolarHBondContact OG-N 3.43Å; S110-E260 PolarHBondContact OG-OE2 3.2Å |
| 111 | G | 82.9 | Confident | 91.6 | Very high | 0 Ų | 0 | 22 Ų | 22 | 0% | 0 | 10% | 0.102 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -92.6 | -7.1 | -178.3 | 0 | 0 | 0 | 0 | 0 | 114.8 | R109 Y114 | R109-G111 PolarHBondContact O-N 3.24Å; G111-Y114 WeakPolarHBondContact O-CB 3.35Å; G111-Y114 PolarHBondContact O-N 2.92Å |
| 112 | G | 90.3 | Very high | 91.5 | Very high | 0 Ų | 0 | 23 Ų | 23 | 0% | 0 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | 55.6 | -137.8 | -176.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | Y114 I115 Y116 | G112-Y114 VanDerWaalsContact C-N 3.27Å; G112-Y114 PolarHBondContact O-N 3.18Å; G112-I115 VanDerWaalsContact O-CG2 3.29Å; G112-I115 WeakPolarHBondContact O-CG2 3.39Å; G112-I115 PolarHBondContact O-N 2.89Å; G112-Y116 WeakPolarHBondContact O-CD1 3.06Å; G112-Y116 WeakPolarHBondContact O-CD2 3.35Å; G112-Y116 WeakPolarHBondContact O-CE2 3.49Å; G112-Y116 PolarHBondContact O-N 3.12Å |
| 113 | D | 91.4 | Very high | 91.5 | Very high | 1 Ų | 1 | 25.9 Ų | 25.9 | 1% | 0.005 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -56 | -37.7 | 179.1 | 39.4 | 36.5 | 0 | 0 | 0 | 113.9 | Y100 I115 Y116 V117 R129 N253 | Y100-D113 HydrophobicContact CE1-CB 4.05Å; D113-I115 PolarHBondContact O-N 2.85Å; D113-Y116 PolarHBondContact O-N 3.12Å; D113-V117 WeakPolarHBondContact O-CG2 3.09Å; D113-V117 PolarHBondContact O-N 3.32Å; D113-R129 IonicContact OD1-CZ 2.65Å; D113-R129 IonicContact OD1-NH1 3.56Å; D113-R129 PolarHBondContact OD1-NH1 3.28Å; D113-R129 IonicContact OD1-NH2 3.34Å; D113-R129 PolarHBondContact OD1-NH2 3.36Å; D113-R129 IonicContact OD2-CZ 3.77Å; D113-R129 VanDerWaalsContact OD2-CZ 3.3Å; D113-R129 IonicContact OD2-NH1 3.42Å; D113-R129 PolarHBondContact OD2-NH1 2.95Å; D113-R129 IonicContact OD2-NH2 3.3Å; D113-R129 PolarHBondContact OD2-NH2 2.97Å; D113-N253 PolarHBondContact OD2-ND2 3.39Å |
| 114 | Y | 92.6 | Very high | 91.5 | Very high | 0 Ų | 0 | 29 Ų | 29 | 0% | 0 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -54.2 | -53.6 | 175.8 | 156.8 | -112.3 | 0 | 0 | 0 | 112 | G111 G112 Y116 V117 Y118 G126 L130 V347 A348 V351 Q353 | G111-Y114 WeakPolarHBondContact O-CB 3.35Å; G111-Y114 PolarHBondContact O-N 2.92Å; G112-Y114 VanDerWaalsContact C-N 3.27Å; G112-Y114 PolarHBondContact O-N 3.18Å; Y114-Y116 VanDerWaalsContact C-N 3.3Å; Y114-Y116 PolarHBondContact O-N 3.33Å; Y114-V117 PolarHBondContact O-N 3.43Å; Y114-Y118 HydrophobicContact CE2-CD2 4.48Å; Y114-Y118 WeakPolarHBondContact O-CB 3.13Å; Y114-Y118 PolarHBondContact O-N 2.9Å; Y114-G126 WeakPolarHBondContact CD2-O 3.48Å; Y114-G126 WeakPolarHBondContact CE2-O 3.47Å; Y114-L130 HydrophobicContact CD2-CB 3.71Å; Y114-L130 HydrophobicContact CD2-CD1 4.36Å; Y114-L130 HydrophobicContact CE2-CB 3.87Å; Y114-L130 HydrophobicContact CE2-CD2 4.35Å; Y114-L130 HydrophobicContact CE2-CG 4.5Å; Y114-L130 HydrophobicContact CG-CB 4.44Å; Y114-L130 HydrophobicContact CG-CD1 4.37Å; Y114-V347 HydrophobicContact CE1-CG1 4.29Å; Y114-A348 HydrophobicContact CD1-CB 4.47Å; Y114-A348 HydrophobicContact CE1-CB 3.75Å; Y114-V351 HydrophobicContact CE1-CG2 4.47Å; Y114-V351 WeakPolarHBondContact OH-CG2 3.5Å; Y114-Q353 VanDerWaalsContact CZ-OE1 3.29Å; Y114-Q353 VanDerWaalsContact OH-CD 3.28Å; Y114-Q353 PolarHBondContact OH-OE1 3.27Å |
| 115 | I | 93.8 | Very high | 91.6 | Very high | 0 Ų | 0 | 34.3 Ų | 34.3 | 0% | 0 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -71 | -30.3 | -176.6 | -164.1 | 64.5 | 0 | 0 | 0 | 111.3 | I107 R109 G112 D113 Y118 E119 V347 | I107-I115 HydrophobicContact CG2-CG1 4.24Å; I107-I115 HydrophobicContact CG2-CG2 4.22Å; R109-I115 HydrophobicContact CB-CG1 4.09Å; R109-I115 HydrophobicContact CB-CG2 4.34Å; G112-I115 VanDerWaalsContact O-CG2 3.29Å; G112-I115 WeakPolarHBondContact O-CG2 3.39Å; G112-I115 PolarHBondContact O-N 2.89Å; D113-I115 PolarHBondContact O-N 2.85Å; I115-Y118 HydrophobicContact CD1-CD1 4.08Å; I115-Y118 HydrophobicContact CD1-CG 4.37Å; I115-Y118 PolarHBondContact O-N 3.37Å; I115-E119 HydrophobicContact CD1-CG 4.5Å; I115-E119 HydrophobicContact CG1-CG 4.26Å; I115-E119 WeakPolarHBondContact O-CB 3.31Å; I115-E119 VanDerWaalsContact O-CG 3.24Å; I115-E119 WeakPolarHBondContact O-CG 3.43Å; I115-E119 PolarHBondContact O-N 3.39Å; I115-V347 HydrophobicContact CD1-CG1 4.2Å |
| 116 | Y | 94.6 | Very high | 91.6 | Very high | 0 Ų | 0 | 33.7 Ų | 33.7 | 0% | 0 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -64.2 | -47.7 | 175.3 | -53.5 | -24.8 | 0 | 0 | 0 | 111 | Y100 L103 G104 I107 G112 D113 Y114 Y118 E119 A120 N256 I409 | Y100-Y116 HydrophobicContact CD1-CD2 4.43Å; Y100-Y116 AromaticContact CD1-CE2 3.9Å; Y100-Y116 HydrophobicContact CD1-CE2 3.9Å; Y100-Y116 HydrophobicContact CE1-CD2 4.41Å; Y100-Y116 HydrophobicContact CE1-CE2 4.23Å; L103-Y116 HydrophobicContact CB-CD1 4.16Å; L103-Y116 HydrophobicContact CB-CD2 3.8Å; L103-Y116 HydrophobicContact CB-CE1 4.19Å; L103-Y116 HydrophobicContact CB-CE2 3.82Å; L103-Y116 HydrophobicContact CB-CG 4.01Å; L103-Y116 HydrophobicContact CD1-CD2 3.87Å; L103-Y116 HydrophobicContact CD1-CG 4.23Å; L103-Y116 HydrophobicContact CG-CD2 4.48Å; G104-Y116 WeakPolarHBondContact CA-OH 3.31Å; G104-Y116 PolarHBondContact N-OH 3.44Å; I107-Y116 HydrophobicContact CB-CD1 4.04Å; I107-Y116 HydrophobicContact CB-CE1 4.07Å; I107-Y116 HydrophobicContact CD1-CD1 3.82Å; I107-Y116 HydrophobicContact CG1-CD1 4.48Å; I107-Y116 HydrophobicContact CG2-CD1 4.33Å; I107-Y116 HydrophobicContact CG2-CE1 4.46Å; G112-Y116 WeakPolarHBondContact O-CD1 3.06Å; G112-Y116 WeakPolarHBondContact O-CD2 3.35Å; G112-Y116 WeakPolarHBondContact O-CE2 3.49Å; G112-Y116 PolarHBondContact O-N 3.12Å; D113-Y116 PolarHBondContact O-N 3.12Å; Y114-Y116 VanDerWaalsContact C-N 3.3Å; Y114-Y116 PolarHBondContact O-N 3.33Å; Y116-Y118 VanDerWaalsContact C-N 3.35Å; Y116-E119 PolarHBondContact O-N 3.5Å; Y116-A120 WeakPolarHBondContact O-CB 3.43Å; Y116-A120 PolarHBondContact O-N 3.24Å; Y116-N256 HydrophobicContact CE2-CB 4.46Å; Y116-N256 WeakPolarHBondContact OH-CB 3.19Å; Y116-N256 PolarHBondContact OH-ND2 3.24Å; Y116-I409 WeakPolarHBondContact O-CD1 3.4Å |
| 117 | V | 95.1 | Very high | 91.7 | Very high | 8 Ų | 8 | 33.2 Ų | 33.2 | 5% | 0.048 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -63.9 | -41 | 176.5 | 173.9 | 0 | 0 | 0 | 0 | 110.9 | D113 Y114 A120 F121 F125 R129 I409 | D113-V117 WeakPolarHBondContact O-CG2 3.09Å; D113-V117 PolarHBondContact O-N 3.32Å; Y114-V117 PolarHBondContact O-N 3.43Å; V117-A120 PolarHBondContact O-N 2.79Å; V117-F121 HydrophobicContact CG1-CD2 4.12Å; V117-F121 PolarHBondContact O-N 2.89Å; V117-F125 HydrophobicContact CG1-CB 3.91Å; V117-F125 WeakPolarHBondContact CG1-O 3.29Å; V117-R129 HydrophobicContact CB-CB 4.47Å; V117-R129 HydrophobicContact CG1-CB 4.3Å; V117-R129 HydrophobicContact CG2-CG 4.34Å; V117-I409 HydrophobicContact CG2-CD1 4.1Å |
| 118 | Y | 94.8 | Very high | 91.8 | Very high | 54 Ų | 54 | 33.5 Ų | 33.5 | 21% | 0.212 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -59 | -46.9 | 175.5 | -179.1 | -83.3 | 0 | 0 | 0 | 112.2 | Y114 I115 Y116 A120 G122 P123 V351 | Y114-Y118 HydrophobicContact CE2-CD2 4.48Å; Y114-Y118 WeakPolarHBondContact O-CB 3.13Å; Y114-Y118 PolarHBondContact O-N 2.9Å; I115-Y118 HydrophobicContact CD1-CD1 4.08Å; I115-Y118 HydrophobicContact CD1-CG 4.37Å; I115-Y118 PolarHBondContact O-N 3.37Å; Y116-Y118 VanDerWaalsContact C-N 3.35Å; Y118-A120 VanDerWaalsContact C-N 3.34Å; Y118-A120 PolarHBondContact O-N 3.37Å; Y118-G122 CarbonylContact O-C 3.58Å; Y118-G122 WeakPolarHBondContact O-CA 3.33Å; Y118-G122 PolarHBondContact O-N 3.2Å; Y118-P123 HydrophobicContact CD2-CB 4.46Å; Y118-P123 HydrophobicContact CE2-CB 3.84Å; Y118-V351 HydrophobicContact CE1-CG1 4.42Å; Y118-V351 HydrophobicContact CE2-CB 4.28Å; Y118-V351 HydrophobicContact CE2-CG2 4.12Å |
| 119 | E | 93.7 | Very high | 92.1 | Very high | 64 Ų | 64 | 30.2 Ų | 30.2 | 30% | 0.299 | 15% | 0.147 | S | C | . | . | H | α-helix | trans | -72.7 | -24.3 | -178.8 | -72.4 | -69.2 | 157.7 | 0 | 0 | 113.6 | I107 R109 I115 Y116 | I107-E119 HydrophobicContact CD1-CB 3.76Å; I107-E119 HydrophobicContact CD1-CG 4.06Å; I107-E119 HydrophobicContact CG2-CG 4.1Å; R109-E119 IonicContact NH1-OE1 3.27Å; R109-E119 PolarHBondContact NH1-OE1 3.07Å; I115-E119 HydrophobicContact CD1-CG 4.5Å; I115-E119 HydrophobicContact CG1-CG 4.26Å; I115-E119 WeakPolarHBondContact O-CB 3.31Å; I115-E119 VanDerWaalsContact O-CG 3.24Å; I115-E119 WeakPolarHBondContact O-CG 3.43Å; I115-E119 PolarHBondContact O-N 3.39Å; Y116-E119 PolarHBondContact O-N 3.5Å |
| 120 | A | 94.8 | Very high | 92.5 | Very high | 26 Ų | 26 | 25.4 Ų | 25.4 | 22% | 0.215 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -91 | -42.8 | -179.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | Y116 V117 Y118 I409 F413 | Y116-A120 WeakPolarHBondContact O-CB 3.43Å; Y116-A120 PolarHBondContact O-N 3.24Å; V117-A120 PolarHBondContact O-N 2.79Å; Y118-A120 VanDerWaalsContact C-N 3.34Å; Y118-A120 PolarHBondContact O-N 3.37Å; A120-I409 HydrophobicContact CB-CB 4.31Å; A120-I409 HydrophobicContact CB-CD1 3.72Å; A120-I409 HydrophobicContact CB-CG1 3.71Å; A120-I409 HydrophobicContact CB-CG2 3.65Å; A120-F413 HydrophobicContact CB-CE1 3.79Å; A120-F413 HydrophobicContact CB-CZ 3.8Å |
| 121 | F | 95.1 | Very high | 93.2 | Very high | 81 Ų | 81 | 27.6 Ų | 27.6 | 36% | 0.355 | 14% | 0.138 | S | C | . | . | H | α-helix | trans | -120.2 | -0.3 | -169.9 | -55.4 | -62.7 | 0 | 0 | 0 | 113.4 | V117 F125 V405 I409 | V117-F121 HydrophobicContact CG1-CD2 4.12Å; V117-F121 PolarHBondContact O-N 2.89Å; F121-F125 HydrophobicContact CB-CB 3.79Å; F121-F125 HydrophobicContact CB-CD2 3.79Å; F121-F125 HydrophobicContact CB-CG 4.04Å; F121-V405 HydrophobicContact CD2-CG1 4.42Å; F121-V405 HydrophobicContact CE2-CG1 3.73Å; F121-V405 HydrophobicContact CZ-CG1 4.45Å; F121-I409 HydrophobicContact CD2-CD1 4.44Å; F121-I409 HydrophobicContact CD2-CG1 4.48Å; F121-I409 HydrophobicContact CE2-CD1 3.95Å; F121-I409 HydrophobicContact CE2-CG1 3.61Å; F121-I409 HydrophobicContact CZ-CG1 4.05Å |
| 122 | G | 93.9 | Very high | 93.5 | Very high | 21 Ų | 21 | 27.9 Ų | 27.9 | 22% | 0.216 | 14% | 0.139 | C | C | . | . | trans | 88 | -175.7 | 175 | 0 | 0 | 0 | 0 | 0 | 114.6 | Y118 F124 G126 | Y118-G122 CarbonylContact O-C 3.58Å; Y118-G122 WeakPolarHBondContact O-CA 3.33Å; Y118-G122 PolarHBondContact O-N 3.2Å; G122-F124 PolarHBondContact O-N 3.45Å; G122-G126 PolarHBondContact O-N 2.84Å | ||
| 123 | P | 94.2 | Very high | 93.4 | Very high | 61 Ų | 61 | 28 Ų | 28 | 40% | 0.396 | 14% | 0.14 | S | C | . | . | H | α-helix | trans | -66 | -36.2 | -166.8 | 24 | -34 | 0 | 0 | 0 | 113.7 | Y118 G126 F127 Q353 | Y118-P123 HydrophobicContact CD2-CB 4.46Å; Y118-P123 HydrophobicContact CE2-CB 3.84Å; P123-G126 PolarHBondContact O-N 2.74Å; P123-F127 WeakPolarHBondContact O-CB 3.24Å; P123-F127 PolarHBondContact O-N 3.02Å; P123-Q353 PolarHBondContact O-NE2 3.21Å |
| 124 | F | 95 | Very high | 93.1 | Very high | 67 Ų | 67 | 28 Ų | 28 | 29% | 0.294 | 14% | 0.14 | S | C | . | . | H | α-helix | trans | -63.2 | -54.2 | -178 | 176.1 | -111.3 | 0 | 0 | 0 | 112 | G122 G126 F127 L128 I464 Y467 | G122-F124 PolarHBondContact O-N 3.45Å; F124-G126 VanDerWaalsContact C-N 3.34Å; F124-G126 PolarHBondContact O-N 2.87Å; F124-F127 PolarHBondContact O-N 3.28Å; F124-F127 VanDerWaalsContact O-N 3.14Å; F124-L128 HydrophobicContact CD1-CD1 4.39Å; F124-L128 HydrophobicContact CE1-CD1 3.75Å; F124-L128 HydrophobicContact CE1-CG 4.49Å; F124-L128 HydrophobicContact CE2-CD1 4.38Å; F124-L128 HydrophobicContact CE2-CD2 4.49Å; F124-L128 HydrophobicContact CE2-CG 4.4Å; F124-L128 HydrophobicContact CZ-CD1 3.76Å; F124-L128 HydrophobicContact CZ-CG 4.26Å; F124-L128 PolarHBondContact O-N 2.95Å; F124-I464 HydrophobicContact CE2-CG1 4.24Å; F124-I464 HydrophobicContact CE2-CG2 4.48Å; F124-I464 HydrophobicContact CZ-CD1 4.46Å; F124-I464 HydrophobicContact CZ-CG1 4.11Å; F124-Y467 HydrophobicContact CB-CE1 4.25Å; F124-Y467 AromaticContact CD2-CD1 3.59Å; F124-Y467 HydrophobicContact CD2-CD1 3.59Å; F124-Y467 AromaticContact CD2-CE1 3.64Å; F124-Y467 HydrophobicContact CD2-CE1 3.64Å; F124-Y467 HydrophobicContact CD2-CG 4.14Å; F124-Y467 HydrophobicContact CE2-CD1 4.14Å; F124-Y467 HydrophobicContact CG-CE1 4.42Å |
| 125 | F | 94.2 | Very high | 92.8 | Very high | 112 Ų | 112 | 29.1 Ų | 29.1 | 49% | 0.491 | 15% | 0.147 | S | C | . | . | H | α-helix | trans | -67.5 | -35.6 | 178.6 | -69.7 | -71.7 | 0 | 0 | 0 | 112.2 | V117 F121 F127 L128 R129 | V117-F125 HydrophobicContact CG1-CB 3.91Å; V117-F125 WeakPolarHBondContact CG1-O 3.29Å; F121-F125 HydrophobicContact CB-CB 3.79Å; F121-F125 HydrophobicContact CB-CD2 3.79Å; F121-F125 HydrophobicContact CB-CG 4.04Å; F125-F127 VanDerWaalsContact C-N 3.31Å; F125-F127 PolarHBondContact O-N 3.2Å; F125-L128 HydrophobicContact CD1-CD1 4.5Å; F125-L128 PolarHBondContact O-N 3.12Å; F125-R129 PolarHBondContact O-N 3.5Å; F125-R129 VanDerWaalsContact O-N 3.09Å |
| 126 | G | 94.3 | Very high | 92.6 | Very high | 0 Ų | 0 | 29.6 Ų | 29.6 | 0% | 0 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -56.1 | -46.1 | 169.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | Y114 G122 P123 F124 R129 L130 | Y114-G126 WeakPolarHBondContact CD2-O 3.48Å; Y114-G126 WeakPolarHBondContact CE2-O 3.47Å; G122-G126 PolarHBondContact O-N 2.84Å; P123-G126 PolarHBondContact O-N 2.74Å; F124-G126 VanDerWaalsContact C-N 3.34Å; F124-G126 PolarHBondContact O-N 2.87Å; G126-R129 PolarHBondContact O-N 2.89Å; G126-L130 PolarHBondContact O-N 3.27Å |
| 127 | F | 94.5 | Very high | 92.3 | Very high | 5 Ų | 5 | 30.2 Ų | 30.2 | 2% | 0.022 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -67.2 | -41.7 | 179.5 | -173.7 | -87.6 | 0 | 0 | 0 | 112.8 | P123 F124 F125 R129 L130 W131 Q353 G463 V466 Y467 C471 | P123-F127 WeakPolarHBondContact O-CB 3.24Å; P123-F127 PolarHBondContact O-N 3.02Å; F124-F127 PolarHBondContact O-N 3.28Å; F124-F127 VanDerWaalsContact O-N 3.14Å; F125-F127 VanDerWaalsContact C-N 3.31Å; F125-F127 PolarHBondContact O-N 3.2Å; F127-R129 PolarHBondContact O-N 2.89Å; F127-L130 HydrophobicContact CD2-CD2 4.19Å; F127-L130 HydrophobicContact CE2-CD2 4.42Å; F127-L130 WeakPolarHBondContact O-CB 3.1Å; F127-L130 PolarHBondContact O-N 3.3Å; F127-L130 VanDerWaalsContact O-N 3.15Å; F127-W131 HydrophobicContact CD1-CB 4.43Å; F127-W131 HydrophobicContact CE1-CB 4.18Å; F127-W131 HydrophobicContact CE1-CE3 4.38Å; F127-W131 HydrophobicContact CZ-CE3 4.32Å; F127-W131 WeakPolarHBondContact O-CB 3.49Å; F127-W131 PolarHBondContact O-N 3.23Å; F127-Q353 HydrophobicContact CD2-CB 4.06Å; F127-Q353 HydrophobicContact CD2-CG 4.33Å; F127-G463 WeakPolarHBondContact CE1-O 3.47Å; F127-V466 HydrophobicContact CE1-CB 4.32Å; F127-V466 HydrophobicContact CE1-CG1 4.45Å; F127-V466 HydrophobicContact CZ-CB 4.29Å; F127-V466 HydrophobicContact CZ-CG1 3.93Å; F127-Y467 HydrophobicContact CB-CD2 3.46Å; F127-Y467 VanDerWaalsContact CB-CD2 3.46Å; F127-Y467 HydrophobicContact CB-CE2 3.93Å; F127-Y467 HydrophobicContact CB-CG 4.38Å; F127-Y467 AromaticContact CD1-CD2 3.83Å; F127-Y467 HydrophobicContact CD1-CD2 3.83Å; F127-Y467 HydrophobicContact CD1-CG 4.11Å; F127-Y467 AromaticContact CD2-CD2 3.97Å; F127-Y467 HydrophobicContact CD2-CD2 3.97Å; F127-Y467 AromaticContact CG-CD2 3.46Å; F127-Y467 HydrophobicContact CG-CD2 3.46Å; F127-Y467 VanDerWaalsContact CG-CD2 3.46Å; F127-Y467 HydrophobicContact CG-CE2 4.35Å; F127-Y467 HydrophobicContact CG-CG 4.21Å; F127-C471 VanDerWaalsContact CD2-SG 3.53Å; F127-C471 WeakPolarHBondContact CE2-SG 3.17Å |
| 128 | L | 93.6 | Very high | 92 | Very high | 23 Ų | 23 | 29.9 Ų | 29.9 | 12% | 0.12 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -58.1 | -38.9 | 175.7 | -69.4 | -176.6 | 0 | 0 | 0 | 111.3 | F124 F125 W131 S132 I460 I464 | F124-L128 HydrophobicContact CD1-CD1 4.39Å; F124-L128 HydrophobicContact CE1-CD1 3.75Å; F124-L128 HydrophobicContact CE1-CG 4.49Å; F124-L128 HydrophobicContact CE2-CD1 4.38Å; F124-L128 HydrophobicContact CE2-CD2 4.49Å; F124-L128 HydrophobicContact CE2-CG 4.4Å; F124-L128 HydrophobicContact CZ-CD1 3.76Å; F124-L128 HydrophobicContact CZ-CG 4.26Å; F124-L128 PolarHBondContact O-N 2.95Å; F125-L128 HydrophobicContact CD1-CD1 4.5Å; F125-L128 PolarHBondContact O-N 3.12Å; L128-W131 PolarHBondContact O-N 2.99Å; L128-S132 PolarHBondContact O-N 3.35Å; L128-S132 PolarHBondContact O-OG 2.94Å; L128-I460 HydrophobicContact CB-CG2 4.15Å; L128-I460 HydrophobicContact CD2-CG2 4.38Å; L128-I464 HydrophobicContact CD2-CG1 3.8Å |
| 129 | R | 92.5 | Very high | 91.9 | Very high | 11 Ų | 11 | 27.3 Ų | 27.3 | 4% | 0.042 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -72 | -36.2 | 176.6 | -174.9 | 49.5 | -178.9 | 57.6 | -10 | 113.2 | D113 V117 F125 G126 F127 W131 E133 | D113-R129 IonicContact OD1-CZ 2.65Å; D113-R129 IonicContact OD1-NH1 3.56Å; D113-R129 PolarHBondContact OD1-NH1 3.28Å; D113-R129 IonicContact OD1-NH2 3.34Å; D113-R129 PolarHBondContact OD1-NH2 3.36Å; D113-R129 IonicContact OD2-CZ 3.77Å; D113-R129 VanDerWaalsContact OD2-CZ 3.3Å; D113-R129 IonicContact OD2-NH1 3.42Å; D113-R129 PolarHBondContact OD2-NH1 2.95Å; D113-R129 IonicContact OD2-NH2 3.3Å; D113-R129 PolarHBondContact OD2-NH2 2.97Å; V117-R129 HydrophobicContact CB-CB 4.47Å; V117-R129 HydrophobicContact CG1-CB 4.3Å; V117-R129 HydrophobicContact CG2-CG 4.34Å; F125-R129 PolarHBondContact O-N 3.5Å; F125-R129 VanDerWaalsContact O-N 3.09Å; G126-R129 PolarHBondContact O-N 2.89Å; F127-R129 PolarHBondContact O-N 2.89Å; R129-W131 VanDerWaalsContact C-N 3.34Å; R129-E133 IonicContact CZ-OE2 3.05Å; R129-E133 IonicContact NH2-OE1 2.65Å; R129-E133 IonicContact NH2-OE2 3.47Å; R129-E133 PolarHBondContact NH2-OE2 3.22Å; R129-E133 WeakPolarHBondContact O-CB 3.18Å; R129-E133 PolarHBondContact O-N 3.44Å |
| 130 | L | 92.9 | Very high | 91.7 | Very high | 0 Ų | 0 | 24.3 Ų | 24.3 | 0% | 0 | 13% | 0.128 | C | C | . | . | I | π-helix | trans | -61.3 | -44.9 | 171 | 178.4 | 68.5 | 0 | 0 | 0 | 111.1 | Y114 G126 F127 V134 V135 A348 Q353 M354 | Y114-L130 HydrophobicContact CD2-CB 3.71Å; Y114-L130 HydrophobicContact CD2-CD1 4.36Å; Y114-L130 HydrophobicContact CE2-CB 3.87Å; Y114-L130 HydrophobicContact CE2-CD2 4.35Å; Y114-L130 HydrophobicContact CE2-CG 4.5Å; Y114-L130 HydrophobicContact CG-CB 4.44Å; Y114-L130 HydrophobicContact CG-CD1 4.37Å; G126-L130 PolarHBondContact O-N 3.27Å; F127-L130 HydrophobicContact CD2-CD2 4.19Å; F127-L130 HydrophobicContact CE2-CD2 4.42Å; F127-L130 WeakPolarHBondContact O-CB 3.1Å; F127-L130 PolarHBondContact O-N 3.3Å; F127-L130 VanDerWaalsContact O-N 3.15Å; L130-V134 HydrophobicContact CD1-CB 3.83Å; L130-V134 HydrophobicContact CD1-CG1 4.21Å; L130-V134 HydrophobicContact CD1-CG2 3.79Å; L130-V134 WeakPolarHBondContact O-CA 3.36Å; L130-V134 WeakPolarHBondContact O-CB 3.31Å; L130-V134 PolarHBondContact O-N 3.18Å; L130-V135 PolarHBondContact O-N 2.7Å; L130-A348 HydrophobicContact CD1-CB 3.53Å; L130-A348 HydrophobicContact CD2-CB 3.59Å; L130-A348 HydrophobicContact CG-CB 4.22Å; L130-Q353 HydrophobicContact CD2-CB 3.83Å; L130-M354 HydrophobicContact CD2-CE 3.51Å; L130-M354 HydrophobicContact CD2-CG 3.95Å; L130-M354 HydrophobicContact CG-CE 3.89Å |
| 131 | W | 92.5 | Very high | 91.4 | Very high | 46 Ų | 46 | 24.4 Ų | 24.4 | 17% | 0.174 | 13% | 0.128 | C | C | . | . | I | π-helix | trans | -63.4 | -58.3 | -178.5 | -178.4 | -101.3 | 0 | 0 | 0 | 111.6 | F127 L128 R129 E133 V135 V136 T462 G463 V466 | F127-W131 HydrophobicContact CD1-CB 4.43Å; F127-W131 HydrophobicContact CE1-CB 4.18Å; F127-W131 HydrophobicContact CE1-CE3 4.38Å; F127-W131 HydrophobicContact CZ-CE3 4.32Å; F127-W131 WeakPolarHBondContact O-CB 3.49Å; F127-W131 PolarHBondContact O-N 3.23Å; L128-W131 PolarHBondContact O-N 2.99Å; R129-W131 VanDerWaalsContact C-N 3.34Å; W131-E133 PolarHBondContact O-N 3.37Å; W131-V135 HydrophobicContact CE3-CB 4.11Å; W131-V135 HydrophobicContact CE3-CG1 4.06Å; W131-V135 HydrophobicContact CE3-CG2 4.06Å; W131-V135 HydrophobicContact CH2-CG1 4.3Å; W131-V135 HydrophobicContact CZ3-CB 4.41Å; W131-V135 HydrophobicContact CZ3-CG1 3.86Å; W131-V135 HydrophobicContact CZ3-CG2 4.47Å; W131-V135 WeakPolarHBondContact O-CB 3.46Å; W131-V135 PolarHBondContact O-N 3.28Å; W131-V136 PolarHBondContact O-N 2.88Å; W131-V136 VanDerWaalsContact O-N 3.15Å; W131-T462 PolarHBondContact NE1-OG1 3.22Å; W131-G463 VanDerWaalsContact CG-CA 3.48Å; W131-G463 VanDerWaalsContact NE1-N 3.18Å; W131-V466 HydrophobicContact CE3-CB 4.38Å; W131-V466 HydrophobicContact CE3-CG1 4.21Å; W131-V466 HydrophobicContact CH2-CB 4.33Å; W131-V466 HydrophobicContact CH2-CG1 4.3Å; W131-V466 HydrophobicContact CH2-CG2 3.67Å; W131-V466 HydrophobicContact CZ2-CG2 4.04Å; W131-V466 HydrophobicContact CZ3-CB 4.1Å; W131-V466 HydrophobicContact CZ3-CG1 3.75Å; W131-V466 HydrophobicContact CZ3-CG2 3.95Å |
| 132 | S | 89.7 | Confident | 91.3 | Very high | 5 Ų | 5 | 20.6 Ų | 20.6 | 4% | 0.035 | 11% | 0.111 | C | C | . | . | I | π-helix | trans | -64.4 | -42.5 | -174.8 | 62.3 | 0 | 0 | 0 | 0 | 112.7 | L128 V136 A137 | L128-S132 PolarHBondContact O-N 3.35Å; L128-S132 PolarHBondContact O-OG 2.94Å; S132-V136 WeakPolarHBondContact O-CB 3.48Å; S132-A137 WeakPolarHBondContact O-CB 3.5Å; S132-A137 PolarHBondContact O-N 2.5Å |
| 133 | E | 88.1 | Confident | 91.2 | Very high | 4 Ų | 4 | 19.6 Ų | 19.6 | 2% | 0.019 | 10% | 0.101 | C | C | . | . | I | π-helix | trans | -84.2 | -56.7 | -177.4 | -173.5 | 79.2 | -167.4 | 0 | 0 | 112 | R129 W131 A137 R138 | R129-E133 IonicContact CZ-OE2 3.05Å; R129-E133 IonicContact NH2-OE1 2.65Å; R129-E133 IonicContact NH2-OE2 3.47Å; R129-E133 PolarHBondContact NH2-OE2 3.22Å; R129-E133 WeakPolarHBondContact O-CB 3.18Å; R129-E133 PolarHBondContact O-N 3.44Å; W131-E133 PolarHBondContact O-N 3.37Å; E133-A137 CarbonylContact O-C 3.49Å; E133-A137 PolarHBondContact O-N 3.19Å; E133-R138 HydrophobicContact CG-CG 4.07Å; E133-R138 WeakPolarHBondContact O-CB 3.09Å; E133-R138 WeakPolarHBondContact O-CG 3.28Å; E133-R138 PolarHBondContact O-N 3.45Å; E133-R138 IonicContact OE1-CZ 3.48Å; E133-R138 IonicContact OE1-NE 3.85Å; E133-R138 PolarHBondContact OE1-NE 3.08Å; E133-R138 IonicContact OE1-NH2 2.9Å; E133-R138 PolarHBondContact OE1-NH2 2.84Å |
| 134 | V | 85.8 | Confident | 90.9 | Very high | 0 Ų | 0 | 17.5 Ų | 17.5 | 0% | 0 | 9% | 0.086 | C | C | . | . | I | π-helix | trans | -85.2 | -33.6 | -162.9 | -168.3 | 0 | 0 | 0 | 0 | 111.3 | L130 P139 T341 M344 F345 | L130-V134 HydrophobicContact CD1-CB 3.83Å; L130-V134 HydrophobicContact CD1-CG1 4.21Å; L130-V134 HydrophobicContact CD1-CG2 3.79Å; L130-V134 WeakPolarHBondContact O-CA 3.36Å; L130-V134 WeakPolarHBondContact O-CB 3.31Å; L130-V134 PolarHBondContact O-N 3.18Å; V134-P139 WeakPolarHBondContact O-CD 3.33Å; V134-P139 WeakPolarHBondContact O-CG 3.36Å; V134-T341 HydrophobicContact CG1-CG2 3.93Å; V134-M344 HydrophobicContact CG1-CB 3.8Å; V134-M344 HydrophobicContact CG1-CE 4.3Å; V134-M344 HydrophobicContact CG2-CB 3.95Å; V134-M344 HydrophobicContact CG2-CE 3.9Å; V134-M344 HydrophobicContact CG2-CG 4.44Å; V134-M344 HydrophobicContact CG2-SD 3.65Å; V134-F345 HydrophobicContact CB-CE1 4.48Å; V134-F345 HydrophobicContact CG1-CD1 3.97Å; V134-F345 HydrophobicContact CG1-CD2 4.1Å; V134-F345 HydrophobicContact CG1-CE1 3.72Å; V134-F345 HydrophobicContact CG1-CE2 3.9Å; V134-F345 HydrophobicContact CG1-CG 4.14Å; V134-F345 HydrophobicContact CG1-CZ 3.69Å; V134-F345 WeakPolarHBondContact O-CZ 3.35Å |
| 135 | V | 86.8 | Confident | 90.6 | Very high | 24 Ų | 24 | 15.3 Ų | 15.3 | 15% | 0.145 | 8% | 0.077 | C | C | . | . | I | π-helix | trans | -87.4 | -37.8 | 178.4 | -176.6 | 0 | 0 | 0 | 0 | 111.5 | L130 W131 P139 F345 M354 | L130-V135 PolarHBondContact O-N 2.7Å; W131-V135 HydrophobicContact CE3-CB 4.11Å; W131-V135 HydrophobicContact CE3-CG1 4.06Å; W131-V135 HydrophobicContact CE3-CG2 4.06Å; W131-V135 HydrophobicContact CH2-CG1 4.3Å; W131-V135 HydrophobicContact CZ3-CB 4.41Å; W131-V135 HydrophobicContact CZ3-CG1 3.86Å; W131-V135 HydrophobicContact CZ3-CG2 4.47Å; W131-V135 WeakPolarHBondContact O-CB 3.46Å; W131-V135 PolarHBondContact O-N 3.28Å; V135-P139 WeakPolarHBondContact O-CG 3.49Å; V135-F345 HydrophobicContact CG2-CE1 4.04Å; V135-F345 HydrophobicContact CG2-CZ 4.44Å; V135-M354 HydrophobicContact CG2-CE 3.67Å |
| 136 | V | 88.8 | Confident | 90.5 | Very high | 9 Ų | 9 | 10 Ų | 10 | 6% | 0.055 | 5% | 0.054 | C | C | . | . | I | π-helix | trans | -100.8 | -66 | -176.1 | -170.3 | 0 | 0 | 0 | 0 | 112.5 | W131 S132 R138 A140 L391 L395 I459 | W131-V136 PolarHBondContact O-N 2.88Å; W131-V136 VanDerWaalsContact O-N 3.15Å; S132-V136 WeakPolarHBondContact O-CB 3.48Å; V136-R138 PolarHBondContact O-N 3.48Å; V136-A140 VanDerWaalsContact O-CB 3.27Å; V136-A140 WeakPolarHBondContact O-CB 2.96Å; V136-A140 PolarHBondContact O-N 3.04Å; V136-L391 HydrophobicContact CG1-CD1 4.37Å; V136-L391 HydrophobicContact CG1-CD2 4.25Å; V136-L395 HydrophobicContact CB-CD1 4.31Å; V136-L395 HydrophobicContact CG1-CD1 3.54Å; V136-I459 HydrophobicContact CG1-CG2 4.09Å; V136-I459 HydrophobicContact CG2-CG2 4.32Å |
| 137 | A | 87.7 | Confident | 90.4 | Very high | 13 Ų | 13 | 11 Ų | 11 | 11% | 0.107 | 6% | 0.058 | C | C | . | . | I | π-helix | trans | -66.2 | -42.1 | -168.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | S132 E133 S141 L395 | S132-A137 WeakPolarHBondContact O-CB 3.5Å; S132-A137 PolarHBondContact O-N 2.5Å; E133-A137 CarbonylContact O-C 3.49Å; E133-A137 PolarHBondContact O-N 3.19Å; A137-S141 VanDerWaalsContact O-CB 3.24Å; A137-S141 WeakPolarHBondContact O-CB 3.49Å; A137-S141 PolarHBondContact O-N 3.47Å; A137-L395 HydrophobicContact CB-CD1 4.04Å |
| 138 | R | 90.1 | Very high | 90.1 | Very high | 2 Ų | 2 | 11.3 Ų | 11.3 | 1% | 0.008 | 6% | 0.061 | C | C | . | . | H | α-helix | trans | -70.1 | -47.8 | -175.6 | -66.6 | -75.2 | 168.1 | 108.1 | 7.4 | 112.7 | E133 V136 A140 S141 V142 Y254 T337 T341 M344 | E133-R138 HydrophobicContact CG-CG 4.07Å; E133-R138 WeakPolarHBondContact O-CB 3.09Å; E133-R138 WeakPolarHBondContact O-CG 3.28Å; E133-R138 PolarHBondContact O-N 3.45Å; E133-R138 IonicContact OE1-CZ 3.48Å; E133-R138 IonicContact OE1-NE 3.85Å; E133-R138 PolarHBondContact OE1-NE 3.08Å; E133-R138 IonicContact OE1-NH2 2.9Å; E133-R138 PolarHBondContact OE1-NH2 2.84Å; V136-R138 PolarHBondContact O-N 3.48Å; R138-A140 VanDerWaalsContact C-N 3.33Å; R138-A140 PolarHBondContact O-N 3.17Å; R138-S141 WeakPolarHBondContact O-CB 3.17Å; R138-S141 PolarHBondContact O-N 2.91Å; R138-V142 WeakPolarHBondContact O-CG2 3.23Å; R138-V142 PolarHBondContact O-N 3.17Å; R138-Y254 PolarHBondContact NE-OH 3.14Å; R138-T337 HydrophobicContact CB-CG2 4.47Å; R138-T341 HydrophobicContact CB-CG2 3.88Å; R138-T341 WeakPolarHBondContact CB-OG1 3.47Å; R138-M344 HydrophobicContact CG-CE 4.08Å; R138-M344 VanDerWaalsContact NH1-CE 3.29Å |
| 139 | P | 91.8 | Very high | 89.9 | Confident | 0 Ų | 0 | 11.3 Ų | 11.3 | 0% | 0 | 6% | 0.06 | C | C | . | . | H | α-helix | trans | -64.4 | -37.6 | 175.1 | -26.6 | 39.7 | 0 | 0 | 0 | 112.6 | V134 V135 V142 A143 Y382 | V134-P139 WeakPolarHBondContact O-CD 3.33Å; V134-P139 WeakPolarHBondContact O-CG 3.36Å; V135-P139 WeakPolarHBondContact O-CG 3.49Å; P139-V142 PolarHBondContact O-N 3.32Å; P139-A143 WeakPolarHBondContact O-CB 3.27Å; P139-A143 PolarHBondContact O-N 2.91Å; P139-Y382 HydrophobicContact CB-CD2 3.52Å; P139-Y382 HydrophobicContact CB-CE2 3.74Å; P139-Y382 HydrophobicContact CG-CE2 4.47Å |
| 140 | A | 89.9 | Confident | 90 | Very high | 0 Ų | 0 | 10.8 Ų | 10.8 | 0% | 0 | 6% | 0.058 | C | C | . | . | H | α-helix | trans | -61.2 | -43.9 | 171.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | V136 R138 A143 I144 Y382 I388 L391 I392 | V136-A140 VanDerWaalsContact O-CB 3.27Å; V136-A140 WeakPolarHBondContact O-CB 2.96Å; V136-A140 PolarHBondContact O-N 3.04Å; R138-A140 VanDerWaalsContact C-N 3.33Å; R138-A140 PolarHBondContact O-N 3.17Å; A140-A143 WeakPolarHBondContact O-CB 3.22Å; A140-A143 PolarHBondContact O-N 3.45Å; A140-I144 WeakPolarHBondContact O-CG1 3.46Å; A140-I144 PolarHBondContact O-N 3.19Å; A140-Y382 HydrophobicContact CB-CD1 4.07Å; A140-Y382 HydrophobicContact CB-CE1 4.25Å; A140-Y382 HydrophobicContact CB-CG 4.46Å; A140-I388 HydrophobicContact CB-CG2 3.89Å; A140-L391 HydrophobicContact CB-CD2 4.1Å; A140-I392 HydrophobicContact CB-CD1 4.11Å; A140-I392 HydrophobicContact CB-CG1 4Å |
| 141 | S | 88.6 | Confident | 89.8 | Confident | 29 Ų | 29 | 14.7 Ų | 14.7 | 20% | 0.203 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -61.3 | -45 | 176.6 | -179.1 | 0 | 0 | 0 | 0 | 112 | A137 R138 A143 I144 M145 I392 | A137-S141 VanDerWaalsContact O-CB 3.24Å; A137-S141 WeakPolarHBondContact O-CB 3.49Å; A137-S141 PolarHBondContact O-N 3.47Å; R138-S141 WeakPolarHBondContact O-CB 3.17Å; R138-S141 PolarHBondContact O-N 2.91Å; S141-A143 VanDerWaalsContact C-N 3.32Å; S141-A143 PolarHBondContact O-N 3.5Å; S141-I144 PolarHBondContact O-N 3.26Å; S141-M145 WeakPolarHBondContact O-CB 3.46Å; S141-M145 WeakPolarHBondContact O-CE 3.42Å; S141-M145 WeakPolarHBondContact O-CG 3.39Å; S141-M145 PolarHBondContact O-N 3.01Å; S141-M145 VanDerWaalsContact OG-CE 3.31Å; S141-M145 WeakPolarHBondContact OG-CE 3.45Å; S141-I392 VanDerWaalsContact CA-CD1 3.48Å |
| 142 | V | 91.9 | Very high | 89.6 | Confident | 0 Ų | 0 | 14 Ų | 14 | 0% | 0 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -57.3 | -46.1 | 173.4 | 169.5 | 0 | 0 | 0 | 0 | 110.8 | R138 P139 M145 S146 I176 V334 T337 V338 | R138-V142 WeakPolarHBondContact O-CG2 3.23Å; R138-V142 PolarHBondContact O-N 3.17Å; P139-V142 PolarHBondContact O-N 3.32Å; V142-M145 PolarHBondContact O-N 3.03Å; V142-S146 VanDerWaalsContact O-CB 3.3Å; V142-S146 WeakPolarHBondContact O-CB 3.46Å; V142-S146 PolarHBondContact O-N 3.45Å; V142-S146 PolarHBondContact O-OG 3.5Å; V142-S146 VanDerWaalsContact O-OG 3.07Å; V142-I176 HydrophobicContact CG1-CD1 3.87Å; V142-I176 HydrophobicContact CG1-CG1 3.81Å; V142-I176 HydrophobicContact CG1-CG2 4.44Å; V142-V334 HydrophobicContact CG1-CG1 4.1Å; V142-T337 HydrophobicContact CG2-CG2 3.54Å; V142-V338 HydrophobicContact CG1-CG2 4.16Å; V142-V338 HydrophobicContact CG2-CG2 4.08Å |
| 143 | A | 92.6 | Very high | 89.7 | Confident | 0 Ų | 0 | 16.3 Ų | 16.3 | 0% | 0 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -59.9 | -51.1 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | P139 A140 S141 M145 S146 M147 L383 I388 | P139-A143 WeakPolarHBondContact O-CB 3.27Å; P139-A143 PolarHBondContact O-N 2.91Å; A140-A143 WeakPolarHBondContact O-CB 3.22Å; A140-A143 PolarHBondContact O-N 3.45Å; S141-A143 VanDerWaalsContact C-N 3.32Å; S141-A143 PolarHBondContact O-N 3.5Å; A143-M145 PolarHBondContact O-N 3.46Å; A143-S146 PolarHBondContact O-N 3.27Å; A143-S146 PolarHBondContact O-OG 3.04Å; A143-M147 WeakPolarHBondContact O-CB 3.3Å; A143-M147 VanDerWaalsContact O-CG 3.28Å; A143-M147 WeakPolarHBondContact O-CG 3.38Å; A143-M147 PolarHBondContact O-N 3.45Å; A143-L383 HydrophobicContact CB-CD2 3.85Å; A143-L383 HydrophobicContact CB-CG 4.37Å; A143-I388 HydrophobicContact CB-CD1 3.98Å |
| 144 | I | 87.8 | Confident | 89.9 | Confident | 17 Ų | 17 | 16.7 Ų | 16.7 | 9% | 0.087 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -60.2 | -47 | 178 | -65.8 | -166 | 0 | 0 | 0 | 111.9 | A140 S141 S146 M147 T148 I388 Y389 I392 | A140-I144 WeakPolarHBondContact O-CG1 3.46Å; A140-I144 PolarHBondContact O-N 3.19Å; S141-I144 PolarHBondContact O-N 3.26Å; I144-S146 VanDerWaalsContact C-N 3.32Å; I144-S146 PolarHBondContact O-N 2.89Å; I144-M147 PolarHBondContact O-N 3.11Å; I144-T148 WeakPolarHBondContact O-CB 3.19Å; I144-T148 PolarHBondContact O-N 2.91Å; I144-T148 PolarHBondContact O-OG1 2.9Å; I144-I388 HydrophobicContact CD1-CB 4.22Å; I144-I388 HydrophobicContact CD1-CG2 3.91Å; I144-I388 WeakPolarHBondContact CD1-O 3.28Å; I144-I388 HydrophobicContact CG1-CB 3.97Å; I144-I388 HydrophobicContact CG1-CG2 3.54Å; I144-Y389 HydrophobicContact CD1-CD1 3.79Å; I144-Y389 HydrophobicContact CD1-CE1 4.16Å; I144-Y389 HydrophobicContact CD1-CG 3.99Å; I144-Y389 HydrophobicContact CG2-CD1 4.12Å; I144-Y389 HydrophobicContact CG2-CE1 3.49Å; I144-Y389 VanDerWaalsContact CG2-CE1 3.49Å; I144-I392 HydrophobicContact CB-CD1 4.31Å; I144-I392 HydrophobicContact CD1-CB 4.13Å; I144-I392 HydrophobicContact CD1-CD1 3.33Å; I144-I392 HydrophobicContact CD1-CG1 3.69Å; I144-I392 HydrophobicContact CG1-CD1 3.87Å |
| 145 | M | 88.3 | Confident | 89.9 | Confident | 22 Ų | 22 | 18.9 Ų | 18.9 | 11% | 0.108 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -63.4 | -40 | -179.7 | -72.8 | -172.6 | -73.1 | 0 | 0 | 111.6 | S141 V142 A143 T148 F149 V334 T337 | S141-M145 WeakPolarHBondContact O-CB 3.46Å; S141-M145 WeakPolarHBondContact O-CE 3.42Å; S141-M145 WeakPolarHBondContact O-CG 3.39Å; S141-M145 PolarHBondContact O-N 3.01Å; S141-M145 VanDerWaalsContact OG-CE 3.31Å; S141-M145 WeakPolarHBondContact OG-CE 3.45Å; V142-M145 PolarHBondContact O-N 3.03Å; A143-M145 PolarHBondContact O-N 3.46Å; M145-T148 PolarHBondContact O-N 3.08Å; M145-F149 PolarHBondContact O-N 2.99Å; M145-V334 HydrophobicContact CB-CG2 3.59Å; M145-T337 HydrophobicContact CE-CG2 4.22Å; M145-T337 WeakPolarHBondContact CE-OG1 3.28Å |
| 146 | S | 92.9 | Very high | 89.9 | Confident | 0 Ų | 0 | 19.8 Ų | 19.8 | 0% | 0 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -69 | -36.3 | 176.7 | 69.4 | 0 | 0 | 0 | 0 | 113.1 | V142 A143 I144 T148 F149 A150 A172 I176 | V142-S146 VanDerWaalsContact O-CB 3.3Å; V142-S146 WeakPolarHBondContact O-CB 3.46Å; V142-S146 PolarHBondContact O-N 3.45Å; V142-S146 PolarHBondContact O-OG 3.5Å; V142-S146 VanDerWaalsContact O-OG 3.07Å; A143-S146 PolarHBondContact O-N 3.27Å; A143-S146 PolarHBondContact O-OG 3.04Å; I144-S146 VanDerWaalsContact C-N 3.32Å; I144-S146 PolarHBondContact O-N 2.89Å; S146-T148 VanDerWaalsContact C-N 3.35Å; S146-F149 WeakPolarHBondContact O-CB 3.49Å; S146-F149 PolarHBondContact O-N 3.45Å; S146-A150 WeakPolarHBondContact O-CB 3.37Å; S146-A150 PolarHBondContact O-N 2.94Å; S146-A172 WeakPolarHBondContact O-CB 3.45Å; S146-I176 WeakPolarHBondContact OG-CD1 3.06Å |
| 147 | M | 91 | Very high | 89.9 | Confident | 20 Ų | 20 | 25.5 Ų | 25.5 | 10% | 0.099 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -64.4 | -41.2 | 170.9 | -73.6 | -66.5 | -68.8 | 0 | 0 | 111.2 | A143 I144 A150 K151 V168 R169 A172 L383 | A143-M147 WeakPolarHBondContact O-CB 3.3Å; A143-M147 VanDerWaalsContact O-CG 3.28Å; A143-M147 WeakPolarHBondContact O-CG 3.38Å; A143-M147 PolarHBondContact O-N 3.45Å; I144-M147 PolarHBondContact O-N 3.11Å; M147-A150 PolarHBondContact O-N 3.49Å; M147-K151 WeakPolarHBondContact O-CG 3.45Å; M147-K151 PolarHBondContact O-N 3.41Å; M147-V168 HydrophobicContact CE-CB 4.41Å; M147-V168 HydrophobicContact CE-CG1 3.61Å; M147-V168 HydrophobicContact SD-CG1 4.02Å; M147-R169 HydrophobicContact CE-CG 3.78Å; M147-R169 HydrophobicContact SD-CB 4.35Å; M147-R169 HydrophobicContact SD-CG 3.8Å; M147-A172 HydrophobicContact CG-CB 4.17Å; M147-A172 HydrophobicContact SD-CB 3.7Å; M147-L383 HydrophobicContact CG-CD2 3.68Å; M147-L383 HydrophobicContact SD-CD2 3.93Å |
| 148 | T | 87.9 | Confident | 89.9 | Confident | 12 Ų | 12 | 28 Ų | 28 | 7% | 0.074 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -65.3 | -41.8 | 177.1 | -52.4 | 0 | 0 | 0 | 0 | 110.9 | I144 M145 S146 K151 Y152 T330 | I144-T148 WeakPolarHBondContact O-CB 3.19Å; I144-T148 PolarHBondContact O-N 2.91Å; I144-T148 PolarHBondContact O-OG1 2.9Å; M145-T148 PolarHBondContact O-N 3.08Å; S146-T148 VanDerWaalsContact C-N 3.35Å; T148-K151 PolarHBondContact O-N 2.9Å; T148-Y152 HydrophobicContact CG2-CD2 3.57Å; T148-Y152 HydrophobicContact CG2-CE2 3.36Å; T148-Y152 WeakPolarHBondContact O-CD2 3.45Å; T148-Y152 PolarHBondContact O-N 2.95Å; T148-Y152 VanDerWaalsContact O-N 3.08Å; T148-T330 HydrophobicContact CG2-CG2 3.83Å |
| 149 | F | 90.6 | Very high | 89.3 | Confident | 23 Ų | 23 | 30.7 Ų | 30.7 | 10% | 0.101 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -54.3 | -52.1 | 169.3 | 161.8 | -102 | 0 | 0 | 0 | 111.2 | M145 S146 K151 Y152 I153 L171 C175 A327 T330 F331 | M145-F149 PolarHBondContact O-N 2.99Å; S146-F149 WeakPolarHBondContact O-CB 3.49Å; S146-F149 PolarHBondContact O-N 3.45Å; F149-K151 PolarHBondContact O-N 3.44Å; F149-Y152 PolarHBondContact O-N 2.94Å; F149-I153 HydrophobicContact CE1-CG2 4.35Å; F149-I153 HydrophobicContact CE2-CB 4.22Å; F149-I153 HydrophobicContact CE2-CG1 4.37Å; F149-I153 HydrophobicContact CE2-CG2 4.42Å; F149-I153 HydrophobicContact CZ-CB 4.43Å; F149-I153 HydrophobicContact CZ-CG1 4.48Å; F149-I153 HydrophobicContact CZ-CG2 4.19Å; F149-I153 WeakPolarHBondContact O-CB 3.44Å; F149-I153 WeakPolarHBondContact O-CG2 3.48Å; F149-I153 PolarHBondContact O-N 2.91Å; F149-L171 HydrophobicContact CE1-CD1 4.48Å; F149-L171 HydrophobicContact CE1-CG 4.25Å; F149-C175 HydrophobicContact CD1-CB 3.67Å; F149-C175 HydrophobicContact CE1-CB 3.74Å; F149-A327 HydrophobicContact CD2-CB 3.95Å; F149-A327 WeakPolarHBondContact CD2-O 3.45Å; F149-A327 HydrophobicContact CE2-CB 4.35Å; F149-T330 WeakPolarHBondContact CA-OG1 3.36Å; F149-T330 VanDerWaalsContact CB-OG1 3.31Å; F149-T330 WeakPolarHBondContact CB-OG1 3.37Å; F149-T330 PolarHBondContact N-OG1 3.26Å; F149-F331 HydrophobicContact CD2-CB 3.9Å; F149-F331 HydrophobicContact CD2-CD2 4.09Å; F149-F331 HydrophobicContact CD2-CG 4.49Å; F149-F331 HydrophobicContact CE1-CD2 4.34Å; F149-F331 HydrophobicContact CE2-CB 4.16Å; F149-F331 AromaticContact CE2-CD2 3.79Å; F149-F331 HydrophobicContact CE2-CD2 3.79Å; F149-F331 HydrophobicContact CE2-CG 4.37Å; F149-F331 HydrophobicContact CG-CD2 4.47Å; F149-F331 AromaticContact CZ-CD2 3.92Å; F149-F331 HydrophobicContact CZ-CD2 3.92Å; F149-F331 HydrophobicContact CZ-CE2 4.48Å |
| 150 | A | 93.5 | Very high | 88.9 | Confident | 0 Ų | 0 | 38.2 Ų | 38.2 | 0% | 0 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -62.7 | -40.4 | -176.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | S146 M147 I153 A154 V168 L171 A172 | S146-A150 WeakPolarHBondContact O-CB 3.37Å; S146-A150 PolarHBondContact O-N 2.94Å; M147-A150 PolarHBondContact O-N 3.49Å; A150-I153 WeakPolarHBondContact O-CG2 3.28Å; A150-A154 VanDerWaalsContact O-CB 3.23Å; A150-A154 WeakPolarHBondContact O-CB 3.42Å; A150-A154 PolarHBondContact O-N 3.14Å; A150-V168 HydrophobicContact CB-CB 4.44Å; A150-V168 HydrophobicContact CB-CG1 3.69Å; A150-V168 WeakPolarHBondContact CB-O 3.4Å; A150-L171 HydrophobicContact CB-CB 3.87Å; A150-L171 HydrophobicContact CB-CD2 4.09Å; A150-L171 HydrophobicContact CB-CG 3.98Å; A150-A172 HydrophobicContact CB-CB 4.16Å |
| 151 | K | 89.7 | Confident | 88.7 | Confident | 83 Ų | 83 | 41.6 Ų | 41.6 | 36% | 0.361 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -62.2 | -49.5 | 174.1 | -72.5 | -175.6 | 176.5 | -173.3 | 0 | 111.4 | M147 T148 F149 A154 Q155 V168 | M147-K151 WeakPolarHBondContact O-CG 3.45Å; M147-K151 PolarHBondContact O-N 3.41Å; T148-K151 PolarHBondContact O-N 2.9Å; F149-K151 PolarHBondContact O-N 3.44Å; K151-A154 PolarHBondContact O-N 2.76Å; K151-Q155 PolarHBondContact O-N 2.76Å; K151-V168 HydrophobicContact CG-CG1 3.69Å; K151-V168 HydrophobicContact CG-CG2 4.32Å |
| 152 | Y | 88 | Confident | 88.5 | Confident | 32 Ų | 32 | 47.8 Ų | 47.8 | 13% | 0.125 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -75.1 | -31.1 | -174 | -73.2 | -49.6 | 0 | 0 | 0 | 115 | T148 F149 A154 Q155 A305 I308 P323 V326 | T148-Y152 HydrophobicContact CG2-CD2 3.57Å; T148-Y152 HydrophobicContact CG2-CE2 3.36Å; T148-Y152 WeakPolarHBondContact O-CD2 3.45Å; T148-Y152 PolarHBondContact O-N 2.95Å; T148-Y152 VanDerWaalsContact O-N 3.08Å; F149-Y152 PolarHBondContact O-N 2.94Å; Y152-A154 VanDerWaalsContact C-N 3.28Å; Y152-Q155 PolarHBondContact O-N 3.17Å; Y152-A305 WeakPolarHBondContact OH-CB 3.38Å; Y152-I308 HydrophobicContact CD1-CD1 3.85Å; Y152-I308 HydrophobicContact CE1-CD1 3.09Å; Y152-I308 HydrophobicContact CE1-CG1 4.3Å; Y152-P323 WeakPolarHBondContact CB-O 3.39Å; Y152-P323 HydrophobicContact CD1-CB 4.39Å; Y152-V326 HydrophobicContact CD2-CB 4.1Å; Y152-V326 HydrophobicContact CD2-CG1 3.35Å; Y152-V326 HydrophobicContact CE2-CB 4.45Å; Y152-V326 HydrophobicContact CE2-CG1 3.43Å; Y152-V326 VanDerWaalsContact CE2-CG1 3.43Å; Y152-V326 HydrophobicContact CG-CB 4.3Å; Y152-V326 HydrophobicContact CG-CG1 4.03Å |
| 153 | I | 91.6 | Very high | 88.3 | Confident | 53 Ų | 53 | 49.5 Ų | 49.5 | 27% | 0.272 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -72.2 | -27.7 | 173.9 | -159.6 | 70.1 | 0 | 0 | 0 | 111.4 | F149 A150 L171 A327 | F149-I153 HydrophobicContact CE1-CG2 4.35Å; F149-I153 HydrophobicContact CE2-CB 4.22Å; F149-I153 HydrophobicContact CE2-CG1 4.37Å; F149-I153 HydrophobicContact CE2-CG2 4.42Å; F149-I153 HydrophobicContact CZ-CB 4.43Å; F149-I153 HydrophobicContact CZ-CG1 4.48Å; F149-I153 HydrophobicContact CZ-CG2 4.19Å; F149-I153 WeakPolarHBondContact O-CB 3.44Å; F149-I153 WeakPolarHBondContact O-CG2 3.48Å; F149-I153 PolarHBondContact O-N 2.91Å; A150-I153 WeakPolarHBondContact O-CG2 3.28Å; I153-L171 HydrophobicContact CG2-CD2 3.39Å; I153-L171 HydrophobicContact CG2-CG 4.35Å; I153-A327 HydrophobicContact CB-CB 3.92Å; I153-A327 HydrophobicContact CD1-CB 4.03Å |
| 154 | A | 91.8 | Very high | 88.2 | Confident | 11 Ų | 11 | 52.7 Ų | 52.7 | 9% | 0.091 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -85 | -20.4 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | A150 K151 Y152 P156 I157 F158 Q163 | A150-A154 VanDerWaalsContact O-CB 3.23Å; A150-A154 WeakPolarHBondContact O-CB 3.42Å; A150-A154 PolarHBondContact O-N 3.14Å; K151-A154 PolarHBondContact O-N 2.76Å; Y152-A154 VanDerWaalsContact C-N 3.28Å; A154-P156 VanDerWaalsContact C-CD 3.47Å; A154-P156 VanDerWaalsContact C-N 3.34Å; A154-I157 WeakPolarHBondContact O-CA 3.39Å; A154-I157 WeakPolarHBondContact O-CB 3.36Å; A154-I157 PolarHBondContact O-N 2.89Å; A154-F158 HydrophobicContact CB-CD2 4.3Å; A154-F158 PolarHBondContact O-N 2.71Å; A154-Q163 HydrophobicContact CB-CG 4.24Å |
| 155 | Q | 87.2 | Confident | 88.3 | Confident | 46 Ų | 46 | 57.4 Ų | 57.4 | 22% | 0.215 | 30% | 0.304 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -51.3 | -42.1 | -177.8 | -168.8 | 73.5 | 34 | 0 | 0 | 113.9 | K151 Y152 I157 F158 P159 W319 P323 | K151-Q155 PolarHBondContact O-N 2.76Å; Y152-Q155 PolarHBondContact O-N 3.17Å; Q155-I157 VanDerWaalsContact C-N 3.26Å; Q155-I157 PolarHBondContact O-N 3.41Å; Q155-F158 CarbonylContact O-C 3.56Å; Q155-F158 PolarHBondContact O-N 2.87Å; Q155-F158 VanDerWaalsContact O-O 3.13Å; Q155-P159 WeakPolarHBondContact O-CA 3.32Å; Q155-W319 HydrophobicContact CG-CH2 4.25Å; Q155-W319 HydrophobicContact CG-CZ3 4.13Å; Q155-P323 HydrophobicContact CB-CB 4.15Å; Q155-P323 HydrophobicContact CG-CB 4.46Å; Q155-P323 HydrophobicContact CG-CG 4.36Å |
| 156 | P | 86.1 | Confident | 88.5 | Confident | 44 Ų | 44 | 61.3 Ų | 61.3 | 29% | 0.286 | 33% | 0.329 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -69.4 | -22.8 | 177.8 | -20.8 | 35.3 | 0 | 0 | 0 | 114 | A154 W320 I324 | A154-P156 VanDerWaalsContact C-CD 3.47Å; A154-P156 VanDerWaalsContact C-N 3.34Å; P156-W320 HydrophobicContact CB-CB 4.1Å; P156-W320 HydrophobicContact CG-CB 4.12Å; P156-I324 HydrophobicContact CG-CG1 4.32Å |
| 157 | I | 88.8 | Confident | 88.5 | Confident | 128 Ų | 128 | 63.7 Ų | 63.7 | 66% | 0.656 | 35% | 0.348 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.6 | -33.9 | 178.5 | -56.4 | 173 | 0 | 0 | 0 | 110.3 | A154 Q155 P159 | A154-I157 WeakPolarHBondContact O-CA 3.39Å; A154-I157 WeakPolarHBondContact O-CB 3.36Å; A154-I157 PolarHBondContact O-N 2.89Å; Q155-I157 VanDerWaalsContact C-N 3.26Å; Q155-I157 PolarHBondContact O-N 3.41Å; I157-P159 VanDerWaalsContact O-CD 3.29Å; I157-P159 WeakPolarHBondContact O-CD 3.24Å |
| 158 | F | 87.4 | Confident | 88.6 | Confident | 65 Ų | 65 | 63 Ų | 63 | 29% | 0.285 | 35% | 0.345 | S | S | . | . | S | Bend | trans | -118.5 | 70.9 | 177.8 | -60.3 | -87.7 | 0 | 0 | 0 | 109.6 | A154 Q155 Q163 | A154-F158 HydrophobicContact CB-CD2 4.3Å; A154-F158 PolarHBondContact O-N 2.71Å; Q155-F158 CarbonylContact O-C 3.56Å; Q155-F158 PolarHBondContact O-N 2.87Å; Q155-F158 VanDerWaalsContact O-O 3.13Å; F158-Q163 HydrophobicContact CB-CG 3.96Å; F158-Q163 HydrophobicContact CD2-CG 4.1Å; F158-Q163 HydrophobicContact CG-CG 4.2Å |
| 159 | P | 78.6 | Confident | 88.8 | Confident | 59 Ų | 59 | 65.9 Ų | 65.9 | 38% | 0.383 | 36% | 0.355 | S | S | . | . | S | Bend | trans | -68.8 | -39.4 | -173.8 | 26.4 | -34.2 | 0 | 0 | 0 | 113 | Q155 I157 W319 | Q155-P159 WeakPolarHBondContact O-CA 3.32Å; I157-P159 VanDerWaalsContact O-CD 3.29Å; I157-P159 WeakPolarHBondContact O-CD 3.24Å; P159-W319 HydrophobicContact CB-CH2 4.32Å; P159-W319 HydrophobicContact CB-CZ2 4.01Å |
| 160 | D | 81.6 | Confident | 89.1 | Confident | 158 Ų | 158 | 70.1 Ų | 70.1 | 85% | 0.845 | 38% | 0.378 | S | S | * | . | S | Bend | trans | -115.7 | 11.1 | -169.8 | -55.9 | -54.1 | 0 | 0 | 0 | 113.4 | ||
| 161 | C | 85.8 | Confident | 89.2 | Confident | 72 Ų | 72 | 73.1 Ų | 73.1 | 49% | 0.486 | 39% | 0.394 | S | S | . | . | S | Bend | trans | -142.2 | 154.7 | -178.3 | 58.1 | 0 | 0 | 0 | 0 | 112.8 | ||
| 162 | D | 85.2 | Confident | 89.4 | Confident | 158 Ų | 158 | 69.2 Ų | 69.2 | 85% | 0.845 | 38% | 0.377 | S | S | * | . | P | Polyproline II helix | trans | -64.8 | 135 | 177 | -70.8 | -37.4 | 0 | 0 | 0 | 110.9 | ||
| 163 | Q | 87.4 | Confident | 89.9 | Confident | 37 Ų | 37 | 68.6 Ų | 68.6 | 17% | 0.173 | 38% | 0.378 | C | S | . | . | P | Polyproline II helix | trans | -73.3 | 135.4 | 178.5 | -56 | 97.1 | 11.4 | 0 | 0 | 110.5 | A154 F158 E165 V168 | A154-Q163 HydrophobicContact CB-CG 4.24Å; F158-Q163 HydrophobicContact CB-CG 3.96Å; F158-Q163 HydrophobicContact CD2-CG 4.1Å; F158-Q163 HydrophobicContact CG-CG 4.2Å; Q163-E165 PolarHBondContact O-N 3.27Å; Q163-E165 VanDerWaalsContact O-N 3.16Å; Q163-V168 HydrophobicContact CB-CG2 3.7Å |
| 164 | P | 91.6 | Very high | 90.1 | Very high | 67 Ų | 67 | 70.2 Ų | 70.2 | 44% | 0.435 | 39% | 0.39 | S | S | . | . | P | Polyproline II helix | trans | -57 | 122.5 | 176.5 | -23.8 | 32.3 | 0 | 0 | 0 | 111.3 | V166 A167 V168 | P164-V166 VanDerWaalsContact C-N 3.26Å; P164-V166 PolarHBondContact O-N 3.36Å; P164-A167 HydrophobicContact CB-CB 4.11Å; P164-A167 WeakPolarHBondContact O-CB 3.49Å; P164-A167 PolarHBondContact O-N 3.26Å; P164-V168 PolarHBondContact O-N 3.44Å; P164-V168 VanDerWaalsContact O-N 3.11Å |
| 165 | E | 89.5 | Confident | 90.3 | Very high | 116 Ų | 116 | 69.9 Ų | 69.9 | 54% | 0.542 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -57.5 | -39.9 | -172.8 | -175.2 | 176.7 | -162.4 | 0 | 0 | 112.6 | Q163 A167 V168 R169 | Q163-E165 PolarHBondContact O-N 3.27Å; Q163-E165 VanDerWaalsContact O-N 3.16Å; E165-A167 VanDerWaalsContact C-N 3.33Å; E165-A167 PolarHBondContact O-N 2.96Å; E165-V168 PolarHBondContact O-N 3.49Å; E165-R169 HydrophobicContact CG-CG 4.46Å; E165-R169 WeakPolarHBondContact O-CG 3.45Å; E165-R169 PolarHBondContact O-N 3.23Å; E165-R169 IonicContact OE1-CZ 3.46Å; E165-R169 VanDerWaalsContact OE1-CZ 3.23Å; E165-R169 IonicContact OE1-NE 2.68Å; E165-R169 PolarHBondContact OE1-NE 3.49Å; E165-R169 IonicContact OE1-NH2 3.12Å; E165-R169 PolarHBondContact OE1-NH2 3.44Å; E165-R169 IonicContact OE2-NH2 2.72Å |
| 166 | V | 91.8 | Very high | 90.8 | Very high | 104 Ų | 104 | 67.7 Ų | 67.7 | 63% | 0.63 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -62.3 | -40.9 | 177.5 | -179.8 | 0 | 0 | 0 | 0 | 111.3 | P164 R169 L170 | P164-V166 VanDerWaalsContact C-N 3.26Å; P164-V166 PolarHBondContact O-N 3.36Å; V166-R169 PolarHBondContact O-N 3.05Å; V166-L170 HydrophobicContact CG1-CD1 4.06Å; V166-L170 HydrophobicContact CG1-CG 4.38Å; V166-L170 WeakPolarHBondContact O-CB 3.45Å; V166-L170 VanDerWaalsContact O-CG 3.3Å; V166-L170 WeakPolarHBondContact O-CG 3.42Å; V166-L170 PolarHBondContact O-N 2.92Å |
| 167 | A | 92.8 | Very high | 91.3 | Very high | 50 Ų | 50 | 69.9 Ų | 69.9 | 41% | 0.413 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -65.4 | -42.7 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | P164 E165 L170 L171 | P164-A167 HydrophobicContact CB-CB 4.11Å; P164-A167 WeakPolarHBondContact O-CB 3.49Å; P164-A167 PolarHBondContact O-N 3.26Å; E165-A167 VanDerWaalsContact C-N 3.33Å; E165-A167 PolarHBondContact O-N 2.96Å; A167-L170 PolarHBondContact O-N 3.48Å; A167-L171 WeakPolarHBondContact O-CB 3.28Å; A167-L171 PolarHBondContact O-N 3.39Å |
| 168 | V | 92.7 | Very high | 91.6 | Very high | 5 Ų | 5 | 67.9 Ų | 67.9 | 3% | 0.03 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -61.1 | -47 | 175.5 | 177.7 | 0 | 0 | 0 | 0 | 110.8 | M147 A150 K151 Q163 P164 E165 L170 L171 A172 | M147-V168 HydrophobicContact CE-CB 4.41Å; M147-V168 HydrophobicContact CE-CG1 3.61Å; M147-V168 HydrophobicContact SD-CG1 4.02Å; A150-V168 HydrophobicContact CB-CB 4.44Å; A150-V168 HydrophobicContact CB-CG1 3.69Å; A150-V168 WeakPolarHBondContact CB-O 3.4Å; K151-V168 HydrophobicContact CG-CG1 3.69Å; K151-V168 HydrophobicContact CG-CG2 4.32Å; Q163-V168 HydrophobicContact CB-CG2 3.7Å; P164-V168 PolarHBondContact O-N 3.44Å; P164-V168 VanDerWaalsContact O-N 3.11Å; E165-V168 PolarHBondContact O-N 3.49Å; V168-L170 PolarHBondContact O-N 3.11Å; V168-L171 PolarHBondContact O-N 2.92Å; V168-A172 WeakPolarHBondContact O-CB 3.49Å; V168-A172 PolarHBondContact O-N 2.94Å |
| 169 | R | 94.1 | Very high | 92 | Very high | 72 Ų | 72 | 64.8 Ų | 64.8 | 27% | 0.272 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -63.4 | -40.7 | 178.7 | -71.5 | 179.9 | -175 | -172.6 | -0.5 | 112.6 | M147 E165 V166 A172 A173 | M147-R169 HydrophobicContact CE-CG 3.78Å; M147-R169 HydrophobicContact SD-CB 4.35Å; M147-R169 HydrophobicContact SD-CG 3.8Å; E165-R169 HydrophobicContact CG-CG 4.46Å; E165-R169 WeakPolarHBondContact O-CG 3.45Å; E165-R169 PolarHBondContact O-N 3.23Å; E165-R169 IonicContact OE1-CZ 3.46Å; E165-R169 VanDerWaalsContact OE1-CZ 3.23Å; E165-R169 IonicContact OE1-NE 2.68Å; E165-R169 PolarHBondContact OE1-NE 3.49Å; E165-R169 IonicContact OE1-NH2 3.12Å; E165-R169 PolarHBondContact OE1-NH2 3.44Å; E165-R169 IonicContact OE2-NH2 2.72Å; V166-R169 PolarHBondContact O-N 3.05Å; R169-A172 PolarHBondContact O-N 2.79Å; R169-A173 WeakPolarHBondContact O-CB 3.35Å; R169-A173 PolarHBondContact O-N 3.14Å |
| 170 | L | 95.5 | Very high | 92.8 | Very high | 112 Ų | 112 | 62.3 Ų | 62.3 | 59% | 0.586 | 35% | 0.346 | S | S | * | . | H | α-helix | trans | -65.3 | -42.9 | 176.2 | -72.9 | 174.6 | 0 | 0 | 0 | 111.6 | V166 A167 V168 A172 A173 V174 | V166-L170 HydrophobicContact CG1-CD1 4.06Å; V166-L170 HydrophobicContact CG1-CG 4.38Å; V166-L170 WeakPolarHBondContact O-CB 3.45Å; V166-L170 VanDerWaalsContact O-CG 3.3Å; V166-L170 WeakPolarHBondContact O-CG 3.42Å; V166-L170 PolarHBondContact O-N 2.92Å; A167-L170 PolarHBondContact O-N 3.48Å; V168-L170 PolarHBondContact O-N 3.11Å; L170-A172 VanDerWaalsContact C-N 3.34Å; L170-A173 WeakPolarHBondContact O-CB 3.36Å; L170-A173 PolarHBondContact O-N 2.93Å; L170-V174 WeakPolarHBondContact O-CG2 3.4Å; L170-V174 PolarHBondContact O-N 3.12Å |
| 171 | L | 95.4 | Very high | 93.4 | Very high | 64 Ų | 64 | 61.2 Ų | 61.2 | 34% | 0.335 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -66.7 | -37.3 | 177.8 | -173.5 | 57.9 | 0 | 0 | 0 | 112.1 | F149 A150 I153 A167 V168 V174 C175 | F149-L171 HydrophobicContact CE1-CD1 4.48Å; F149-L171 HydrophobicContact CE1-CG 4.25Å; A150-L171 HydrophobicContact CB-CB 3.87Å; A150-L171 HydrophobicContact CB-CD2 4.09Å; A150-L171 HydrophobicContact CB-CG 3.98Å; I153-L171 HydrophobicContact CG2-CD2 3.39Å; I153-L171 HydrophobicContact CG2-CG 4.35Å; A167-L171 WeakPolarHBondContact O-CB 3.28Å; A167-L171 PolarHBondContact O-N 3.39Å; V168-L171 PolarHBondContact O-N 2.92Å; L171-V174 PolarHBondContact O-N 3.4Å; L171-C175 PolarHBondContact O-N 3.43Å |
| 172 | A | 95.5 | Very high | 93.7 | Very high | 0 Ų | 0 | 59 Ų | 59 | 0% | 0 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -61.5 | -44.7 | 171.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | S146 M147 A150 V168 R169 L170 V174 C175 I176 L383 | S146-A172 WeakPolarHBondContact O-CB 3.45Å; M147-A172 HydrophobicContact CG-CB 4.17Å; M147-A172 HydrophobicContact SD-CB 3.7Å; A150-A172 HydrophobicContact CB-CB 4.16Å; V168-A172 WeakPolarHBondContact O-CB 3.49Å; V168-A172 PolarHBondContact O-N 2.94Å; R169-A172 PolarHBondContact O-N 2.79Å; L170-A172 VanDerWaalsContact C-N 3.34Å; A172-V174 PolarHBondContact O-N 2.75Å; A172-C175 WeakPolarHBondContact O-CB 3.32Å; A172-C175 PolarHBondContact O-N 2.89Å; A172-I176 WeakPolarHBondContact O-CG1 3.25Å; A172-I176 PolarHBondContact O-N 3.07Å; A172-L383 HydrophobicContact CB-CD1 4.25Å; A172-L383 HydrophobicContact CB-CD2 4.02Å |
| 173 | A | 96.9 | Very high | 94 | Very high | 19 Ų | 19 | 51.5 Ų | 51.5 | 16% | 0.157 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -62.1 | -43.2 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | R169 L170 C175 I176 I177 L383 | R169-A173 WeakPolarHBondContact O-CB 3.35Å; R169-A173 PolarHBondContact O-N 3.14Å; L170-A173 WeakPolarHBondContact O-CB 3.36Å; L170-A173 PolarHBondContact O-N 2.93Å; A173-C175 VanDerWaalsContact C-N 3.31Å; A173-C175 PolarHBondContact O-N 2.98Å; A173-I176 PolarHBondContact O-N 3.5Å; A173-I177 WeakPolarHBondContact O-CB 3.09Å; A173-I177 VanDerWaalsContact O-CG1 3.24Å; A173-I177 WeakPolarHBondContact O-CG1 3.46Å; A173-I177 PolarHBondContact O-N 3.43Å; A173-L383 HydrophobicContact CB-CD1 3.82Å |
| 174 | V | 97.1 | Very high | 94.1 | Very high | 88 Ų | 88 | 50.4 Ų | 50.4 | 53% | 0.533 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -58.9 | -43.4 | 174.8 | 170.5 | 0 | 0 | 0 | 0 | 111.1 | L170 L171 A172 I177 L178 | L170-V174 WeakPolarHBondContact O-CG2 3.4Å; L170-V174 PolarHBondContact O-N 3.12Å; L171-V174 PolarHBondContact O-N 3.4Å; A172-V174 PolarHBondContact O-N 2.75Å; V174-I177 PolarHBondContact O-N 3.33Å; V174-L178 VanDerWaalsContact O-CB 3.28Å; V174-L178 WeakPolarHBondContact O-CB 3.35Å; V174-L178 PolarHBondContact O-N 3.39Å |
| 175 | C | 96 | Very high | 94 | Very high | 3 Ų | 3 | 51.3 Ų | 51.3 | 2% | 0.02 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -58.2 | -49.9 | 175.7 | 176.7 | 0 | 0 | 0 | 0 | 112 | F149 L171 A172 A173 I177 L178 L179 F331 | F149-C175 HydrophobicContact CD1-CB 3.67Å; F149-C175 HydrophobicContact CE1-CB 3.74Å; L171-C175 PolarHBondContact O-N 3.43Å; A172-C175 WeakPolarHBondContact O-CB 3.32Å; A172-C175 PolarHBondContact O-N 2.89Å; A173-C175 VanDerWaalsContact C-N 3.31Å; A173-C175 PolarHBondContact O-N 2.98Å; C175-I177 PolarHBondContact O-N 3.41Å; C175-L178 PolarHBondContact O-N 3.47Å; C175-L179 WeakPolarHBondContact O-CB 3.37Å; C175-L179 WeakPolarHBondContact O-CG 3.44Å; C175-L179 PolarHBondContact O-N 2.89Å; C175-F331 HydrophobicContact CB-CE2 4.46Å; C175-F331 WeakPolarHBondContact SG-CD2 3.28Å |
| 176 | I | 96.7 | Very high | 93.9 | Very high | 0 Ų | 0 | 47 Ų | 47 | 0% | 0 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -60.8 | -46.6 | 178.3 | -65.2 | 172.5 | 0 | 0 | 0 | 111 | V142 S146 A172 A173 L179 S180 I380 L383 | V142-I176 HydrophobicContact CG1-CD1 3.87Å; V142-I176 HydrophobicContact CG1-CG1 3.81Å; V142-I176 HydrophobicContact CG1-CG2 4.44Å; S146-I176 WeakPolarHBondContact OG-CD1 3.06Å; A172-I176 WeakPolarHBondContact O-CG1 3.25Å; A172-I176 PolarHBondContact O-N 3.07Å; A173-I176 PolarHBondContact O-N 3.5Å; I176-L179 PolarHBondContact O-N 2.85Å; I176-S180 WeakPolarHBondContact O-CB 3.39Å; I176-S180 PolarHBondContact O-N 2.83Å; I176-S180 PolarHBondContact O-OG 3.37Å; I176-I380 HydrophobicContact CG2-CG1 4.21Å; I176-L383 HydrophobicContact CD1-CD1 4Å; I176-L383 HydrophobicContact CD1-CG 4.3Å |
| 177 | I | 97.3 | Very high | 93.5 | Very high | 90 Ų | 90 | 42.8 Ų | 42.8 | 46% | 0.462 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -63 | -46.3 | -178.2 | -68.9 | 166.4 | 0 | 0 | 0 | 110.5 | A173 V174 C175 S180 F181 I380 | A173-I177 WeakPolarHBondContact O-CB 3.09Å; A173-I177 VanDerWaalsContact O-CG1 3.24Å; A173-I177 WeakPolarHBondContact O-CG1 3.46Å; A173-I177 PolarHBondContact O-N 3.43Å; V174-I177 PolarHBondContact O-N 3.33Å; C175-I177 PolarHBondContact O-N 3.41Å; I177-S180 PolarHBondContact O-N 3.27Å; I177-F181 WeakPolarHBondContact O-CB 3.35Å; I177-F181 PolarHBondContact O-N 3.4Å; I177-I380 HydrophobicContact CD1-CD1 4.14Å; I177-I380 HydrophobicContact CG1-CD1 3.78Å |
| 178 | L | 95.6 | Very high | 93.2 | Very high | 86 Ų | 86 | 49.8 Ų | 49.8 | 45% | 0.45 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -61.2 | -48.6 | 180 | 178.9 | 63.3 | 0 | 0 | 0 | 111.4 | V174 C175 F181 I182 F331 | V174-L178 VanDerWaalsContact O-CB 3.28Å; V174-L178 WeakPolarHBondContact O-CB 3.35Å; V174-L178 PolarHBondContact O-N 3.39Å; C175-L178 PolarHBondContact O-N 3.47Å; L178-F181 WeakPolarHBondContact O-CB 3.47Å; L178-F181 PolarHBondContact O-N 3.24Å; L178-I182 HydrophobicContact CD1-CD1 4.36Å; L178-I182 HydrophobicContact CG-CD1 4.21Å; L178-I182 WeakPolarHBondContact O-CG1 3.37Å; L178-I182 PolarHBondContact O-N 3.38Å; L178-F331 HydrophobicContact CD2-CE2 4.44Å; L178-F331 HydrophobicContact CD2-CZ 4.1Å |
| 179 | L | 94.7 | Very high | 92.9 | Very high | 0 Ų | 0 | 53.9 Ų | 53.9 | 0% | 0 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -68.6 | -35.7 | -179.4 | -73.3 | 174.3 | 0 | 0 | 0 | 112.4 | C175 I176 I182 N183 V193 F331 V334 N335 | C175-L179 WeakPolarHBondContact O-CB 3.37Å; C175-L179 WeakPolarHBondContact O-CG 3.44Å; C175-L179 PolarHBondContact O-N 2.89Å; I176-L179 PolarHBondContact O-N 2.85Å; L179-I182 HydrophobicContact CD2-CD1 4.39Å; L179-I182 PolarHBondContact O-N 3.48Å; L179-N183 WeakPolarHBondContact O-CB 3.14Å; L179-N183 PolarHBondContact O-N 3.04Å; L179-N183 PolarHBondContact O-ND2 2.83Å; L179-V193 HydrophobicContact CD2-CG1 4.31Å; L179-F331 HydrophobicContact CD1-CD1 4.19Å; L179-F331 HydrophobicContact CD1-CD2 4.18Å; L179-F331 HydrophobicContact CD1-CE1 4.06Å; L179-F331 HydrophobicContact CD1-CE2 4.01Å; L179-F331 HydrophobicContact CD1-CG 4.26Å; L179-F331 HydrophobicContact CD1-CZ 3.95Å; L179-F331 WeakPolarHBondContact CD1-O 3.28Å; L179-F331 HydrophobicContact CD2-CD1 4.14Å; L179-F331 HydrophobicContact CD2-CE1 3.37Å; L179-F331 HydrophobicContact CD2-CE2 4.39Å; L179-F331 HydrophobicContact CD2-CZ 3.51Å; L179-F331 HydrophobicContact CG-CE1 3.95Å; L179-F331 HydrophobicContact CG-CE2 4.08Å; L179-F331 HydrophobicContact CG-CZ 3.65Å; L179-V334 HydrophobicContact CD1-CB 3.66Å; L179-V334 HydrophobicContact CD1-CG1 3.47Å; L179-V334 VanDerWaalsContact CD1-CG1 3.47Å; L179-N335 HydrophobicContact CD1-CB 4.14Å; L179-N335 HydrophobicContact CD2-CB 3.78Å; L179-N335 HydrophobicContact CG-CB 4.45Å |
| 180 | S | 94.6 | Very high | 92.6 | Very high | 7 Ų | 7 | 50.5 Ų | 50.5 | 5% | 0.049 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -66.3 | -39.6 | 173.2 | -59.7 | 0 | 0 | 0 | 0 | 111.3 | I176 I177 N183 A184 V372 C376 | I176-S180 WeakPolarHBondContact O-CB 3.39Å; I176-S180 PolarHBondContact O-N 2.83Å; I176-S180 PolarHBondContact O-OG 3.37Å; I177-S180 PolarHBondContact O-N 3.27Å; S180-N183 PolarHBondContact O-N 3Å; S180-A184 WeakPolarHBondContact O-CB 3.43Å; S180-A184 PolarHBondContact O-N 3.36Å; S180-V372 WeakPolarHBondContact O-CG1 3.21Å; S180-C376 WeakPolarHBondContact OG-CB 3.2Å |
| 181 | F | 94.4 | Very high | 92.2 | Very high | 136 Ų | 136 | 45.6 Ų | 45.6 | 60% | 0.596 | 23% | 0.226 | S | C | * | . | H | α-helix | trans | -62 | -46.1 | 174.4 | 178.3 | -97.6 | 0 | 0 | 0 | 111.8 | I177 L178 N183 A184 F185 | I177-F181 WeakPolarHBondContact O-CB 3.35Å; I177-F181 PolarHBondContact O-N 3.4Å; L178-F181 WeakPolarHBondContact O-CB 3.47Å; L178-F181 PolarHBondContact O-N 3.24Å; F181-N183 VanDerWaalsContact C-N 3.33Å; F181-N183 PolarHBondContact O-N 2.95Å; F181-A184 PolarHBondContact O-N 3.19Å; F181-F185 WeakPolarHBondContact O-CB 3.31Å; F181-F185 PolarHBondContact O-N 2.96Å |
| 182 | I | 93.1 | Very high | 91.9 | Very high | 26 Ų | 26 | 48.7 Ų | 48.7 | 13% | 0.133 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -59.8 | -45 | 176.1 | -66.7 | 165 | 0 | 0 | 0 | 110.7 | L178 L179 F185 S186 M189 V193 | L178-I182 HydrophobicContact CD1-CD1 4.36Å; L178-I182 HydrophobicContact CG-CD1 4.21Å; L178-I182 WeakPolarHBondContact O-CG1 3.37Å; L178-I182 PolarHBondContact O-N 3.38Å; L179-I182 HydrophobicContact CD2-CD1 4.39Å; L179-I182 PolarHBondContact O-N 3.48Å; I182-F185 PolarHBondContact O-N 3.36Å; I182-S186 PolarHBondContact O-N 3.31Å; I182-M189 HydrophobicContact CG2-CB 4.07Å; I182-V193 HydrophobicContact CG2-CG2 4.39Å |
| 183 | N | 90.7 | Very high | 91.6 | Very high | 0 Ų | 0 | 49.9 Ų | 49.9 | 0% | 0 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -62.1 | -41.4 | 177.1 | -92.7 | -88.3 | 0 | 0 | 0 | 113 | L179 S180 F181 S190 N335 V338 M339 V372 | L179-N183 WeakPolarHBondContact O-CB 3.14Å; L179-N183 PolarHBondContact O-N 3.04Å; L179-N183 PolarHBondContact O-ND2 2.83Å; S180-N183 PolarHBondContact O-N 3Å; F181-N183 VanDerWaalsContact C-N 3.33Å; F181-N183 PolarHBondContact O-N 2.95Å; N183-S190 PolarHBondContact ND2-OG 3.24Å; N183-S190 VanDerWaalsContact ND2-OG 3.16Å; N183-S190 PolarHBondContact OD1-OG 2.82Å; N183-S190 VanDerWaalsContact OD1-OG 3.1Å; N183-N335 PolarHBondContact ND2-OD1 2.92Å; N183-V338 HydrophobicContact CB-CG1 4.34Å; N183-M339 VanDerWaalsContact OD1-CA 3.28Å; N183-M339 WeakPolarHBondContact OD1-CA 3.39Å; N183-M339 VanDerWaalsContact OD1-CB 3.3Å; N183-M339 WeakPolarHBondContact OD1-CB 3.42Å; N183-V372 HydrophobicContact CB-CG1 3.92Å; N183-V372 HydrophobicContact CB-CG2 4.24Å |
| 184 | A | 90.8 | Very high | 91.2 | Very high | 14 Ų | 14 | 49 Ų | 49 | 12% | 0.116 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -67.3 | -37.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | S180 F181 T367 I369 V372 | S180-A184 WeakPolarHBondContact O-CB 3.43Å; S180-A184 PolarHBondContact O-N 3.36Å; F181-A184 PolarHBondContact O-N 3.19Å; A184-T367 WeakPolarHBondContact O-CB 3.39Å; A184-T367 PolarHBondContact O-OG1 3.4Å; A184-I369 HydrophobicContact CB-CG1 4.2Å; A184-I369 HydrophobicContact CB-CG2 4.2Å; A184-V372 HydrophobicContact CB-CB 4.43Å; A184-V372 HydrophobicContact CB-CG1 4.13Å |
| 185 | F | 89.6 | Confident | 90.8 | Very high | 85 Ų | 85 | 45.9 Ų | 45.9 | 37% | 0.373 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -74.6 | -46.4 | -176.4 | -172.8 | -98 | 0 | 0 | 0 | 113.3 | F181 I182 M189 R365 | F181-F185 WeakPolarHBondContact O-CB 3.31Å; F181-F185 PolarHBondContact O-N 2.96Å; I182-F185 PolarHBondContact O-N 3.36Å; F185-M189 HydrophobicContact CD1-SD 3.71Å; F185-M189 HydrophobicContact CE1-SD 3.87Å; F185-R365 VanDerWaalsContact CZ-NH2 3.29Å; F185-R365 WeakPolarHBondContact O-CD 3.26Å |
| 186 | S | 87.3 | Confident | 90.6 | Very high | 26 Ų | 26 | 49.6 Ų | 49.6 | 18% | 0.182 | 24% | 0.236 | C | C | . | . | trans | -160.1 | 125.1 | -179.5 | -175.9 | 0 | 0 | 0 | 0 | 113.4 | I182 R188 M189 S190 | I182-S186 PolarHBondContact O-N 3.31Å; S186-R188 VanDerWaalsContact C-N 3.26Å; S186-R188 PolarHBondContact O-N 2.91Å; S186-R188 PolarHBondContact OG-N 2.93Å; S186-M189 PolarHBondContact O-N 3.36Å; S186-M189 PolarHBondContact OG-N 3.06Å; S186-S190 PolarHBondContact O-N 3.44Å | ||
| 187 | V | 82.8 | Confident | 90.2 | Very high | 16 Ų | 16 | 51.3 Ų | 51.3 | 10% | 0.097 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -56.8 | -40.7 | 169.6 | -177.2 | 0 | 0 | 0 | 0 | 111.8 | M189 S190 T191 E261 T367 | V187-M189 VanDerWaalsContact C-N 3.33Å; V187-M189 PolarHBondContact O-N 3.22Å; V187-S190 PolarHBondContact O-N 2.92Å; V187-T191 HydrophobicContact CG1-CG2 4.38Å; V187-T191 WeakPolarHBondContact O-CG2 3.35Å; V187-T191 PolarHBondContact O-N 3.41Å; V187-T191 PolarHBondContact O-OG1 3Å; V187-E261 WeakPolarHBondContact CG1-OE2 3.43Å; V187-T367 HydrophobicContact CG2-CG2 3.69Å |
| 188 | R | 85.7 | Confident | 89.9 | Confident | 196 Ų | 196 | 47.2 Ų | 47.2 | 74% | 0.74 | 22% | 0.223 | S | C | * | . | H | α-helix | trans | -65.8 | -37.2 | -179.5 | -171.5 | 176.6 | -178.4 | 163.5 | 1.6 | 111.8 | S186 T191 F192 | S186-R188 VanDerWaalsContact C-N 3.26Å; S186-R188 PolarHBondContact O-N 2.91Å; S186-R188 PolarHBondContact OG-N 2.93Å; R188-T191 WeakPolarHBondContact CA-OG1 3.28Å; R188-T191 PolarHBondContact O-OG1 3.28Å; R188-F192 VanDerWaalsContact O-CB 3.23Å; R188-F192 WeakPolarHBondContact O-CB 3.4Å; R188-F192 PolarHBondContact O-N 3.33Å |
| 189 | M | 87.1 | Confident | 89.6 | Confident | 92 Ų | 92 | 49.7 Ų | 49.7 | 45% | 0.453 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -69.9 | -41.9 | 174 | -68.2 | -175.5 | 67.5 | 0 | 0 | 111.3 | I182 F185 S186 V187 T191 F192 V193 | I182-M189 HydrophobicContact CG2-CB 4.07Å; F185-M189 HydrophobicContact CD1-SD 3.71Å; F185-M189 HydrophobicContact CE1-SD 3.87Å; S186-M189 PolarHBondContact O-N 3.36Å; S186-M189 PolarHBondContact OG-N 3.06Å; V187-M189 VanDerWaalsContact C-N 3.33Å; V187-M189 PolarHBondContact O-N 3.22Å; M189-T191 PolarHBondContact O-N 3.44Å; M189-F192 PolarHBondContact O-N 3.49Å; M189-V193 WeakPolarHBondContact O-CB 3.42Å; M189-V193 VanDerWaalsContact O-CG2 3.25Å; M189-V193 WeakPolarHBondContact O-CG2 3.39Å; M189-V193 PolarHBondContact O-N 3.25Å |
| 190 | S | 87.5 | Confident | 89.3 | Confident | 0 Ų | 0 | 50.9 Ų | 50.9 | 0% | 0 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -62.5 | -41.9 | 177.6 | 179.4 | 0 | 0 | 0 | 0 | 112.5 | N183 S186 V187 V193 Q194 N335 | N183-S190 PolarHBondContact ND2-OG 3.24Å; N183-S190 VanDerWaalsContact ND2-OG 3.16Å; N183-S190 PolarHBondContact OD1-OG 2.82Å; N183-S190 VanDerWaalsContact OD1-OG 3.1Å; S186-S190 PolarHBondContact O-N 3.44Å; V187-S190 PolarHBondContact O-N 2.92Å; S190-V193 PolarHBondContact O-N 3.29Å; S190-Q194 WeakPolarHBondContact O-CB 3.44Å; S190-Q194 PolarHBondContact O-N 3.36Å; S190-N335 PolarHBondContact O-ND2 3.13Å; S190-N335 PolarHBondContact OG-ND2 3.23Å; S190-N335 PolarHBondContact OG-OD1 3.14Å |
| 191 | T | 87.2 | Confident | 89 | Confident | 9 Ų | 9 | 50.8 Ų | 50.8 | 6% | 0.055 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -67.6 | -40.3 | 174.4 | 46.5 | 0 | 0 | 0 | 0 | 112 | I47 I55 V187 R188 M189 V193 Q194 D195 M339 | I47-T191 HydrophobicContact CG1-CG2 4.34Å; I55-T191 HydrophobicContact CD1-CG2 4.39Å; V187-T191 HydrophobicContact CG1-CG2 4.38Å; V187-T191 WeakPolarHBondContact O-CG2 3.35Å; V187-T191 PolarHBondContact O-N 3.41Å; V187-T191 PolarHBondContact O-OG1 3Å; R188-T191 WeakPolarHBondContact CA-OG1 3.28Å; R188-T191 PolarHBondContact O-OG1 3.28Å; M189-T191 PolarHBondContact O-N 3.44Å; T191-V193 PolarHBondContact O-N 3.49Å; T191-Q194 VanDerWaalsContact O-CB 3.27Å; T191-Q194 WeakPolarHBondContact O-CB 3.2Å; T191-Q194 PolarHBondContact O-N 3.5Å; T191-D195 PolarHBondContact O-N 3.44Å; T191-M339 HydrophobicContact CG2-CE 4.34Å; T191-M339 HydrophobicContact CG2-SD 3.89Å |
| 192 | F | 90.1 | Very high | 88.9 | Confident | 130 Ų | 130 | 45.6 Ų | 45.6 | 57% | 0.57 | 22% | 0.215 | S | C | * | . | H | α-helix | trans | -61.9 | -43 | 173.6 | 177.7 | -107.3 | 0 | 0 | 0 | 112.9 | R188 M189 Q194 D195 I196 | R188-F192 VanDerWaalsContact O-CB 3.23Å; R188-F192 WeakPolarHBondContact O-CB 3.4Å; R188-F192 PolarHBondContact O-N 3.33Å; M189-F192 PolarHBondContact O-N 3.49Å; F192-Q194 VanDerWaalsContact C-N 3.33Å; F192-D195 PolarHBondContact O-N 3.14Å; F192-I196 HydrophobicContact CD1-CD1 3.85Å; F192-I196 HydrophobicContact CE1-CD1 3.3Å; F192-I196 HydrophobicContact CE1-CG1 4.4Å; F192-I196 HydrophobicContact CE2-CD1 4.08Å; F192-I196 HydrophobicContact CE2-CG1 4.42Å; F192-I196 HydrophobicContact CG-CD1 4.46Å; F192-I196 HydrophobicContact CZ-CD1 3.45Å; F192-I196 VanDerWaalsContact CZ-CD1 3.45Å; F192-I196 HydrophobicContact CZ-CG1 4.24Å; F192-I196 WeakPolarHBondContact O-CG1 3.29Å; F192-I196 PolarHBondContact O-N 2.95Å; F192-I196 VanDerWaalsContact O-N 3.09Å |
| 193 | V | 88.6 | Confident | 88.8 | Confident | 24 Ų | 24 | 46.5 Ų | 46.5 | 15% | 0.145 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -59.3 | -46.7 | 172.8 | 166.2 | 0 | 0 | 0 | 0 | 109.8 | L179 I182 M189 S190 T191 D195 I196 F197 | L179-V193 HydrophobicContact CD2-CG1 4.31Å; I182-V193 HydrophobicContact CG2-CG2 4.39Å; M189-V193 WeakPolarHBondContact O-CB 3.42Å; M189-V193 VanDerWaalsContact O-CG2 3.25Å; M189-V193 WeakPolarHBondContact O-CG2 3.39Å; M189-V193 PolarHBondContact O-N 3.25Å; S190-V193 PolarHBondContact O-N 3.29Å; T191-V193 PolarHBondContact O-N 3.49Å; V193-D195 VanDerWaalsContact C-N 3.31Å; V193-D195 PolarHBondContact O-N 2.86Å; V193-I196 PolarHBondContact O-N 3.17Å; V193-F197 HydrophobicContact CG1-CD2 3.67Å; V193-F197 HydrophobicContact CG1-CE2 3.73Å; V193-F197 WeakPolarHBondContact O-CD2 3.39Å; V193-F197 PolarHBondContact O-N 3.29Å; V193-F197 VanDerWaalsContact O-N 3.11Å |
| 194 | Q | 88.3 | Confident | 88.7 | Confident | 1 Ų | 1 | 46.7 Ų | 46.7 | 1% | 0.005 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -54.8 | -46.9 | 175.3 | -169.5 | 64 | 35.5 | 0 | 0 | 112.1 | I55 S190 T191 F192 F197 T198 G332 N335 G336 | I55-Q194 HydrophobicContact CG1-CG 4.18Å; S190-Q194 WeakPolarHBondContact O-CB 3.44Å; S190-Q194 PolarHBondContact O-N 3.36Å; T191-Q194 VanDerWaalsContact O-CB 3.27Å; T191-Q194 WeakPolarHBondContact O-CB 3.2Å; T191-Q194 PolarHBondContact O-N 3.5Å; F192-Q194 VanDerWaalsContact C-N 3.33Å; Q194-F197 PolarHBondContact O-N 3.02Å; Q194-T198 WeakPolarHBondContact O-CB 3.3Å; Q194-T198 PolarHBondContact O-N 3.48Å; Q194-T198 PolarHBondContact O-OG1 2.98Å; Q194-G332 PolarHBondContact NE2-O 2.9Å; Q194-G332 PolarHBondContact OE1-O 3.23Å; Q194-N335 PolarHBondContact OE1-ND2 2.99Å; Q194-G336 VanDerWaalsContact OE1-N 3.1Å |
| 195 | D | 89 | Confident | 88.8 | Confident | 23 Ų | 23 | 46 Ų | 46 | 12% | 0.123 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -61.6 | -50.3 | -177.1 | -66.4 | -9.5 | 0 | 0 | 0 | 110.7 | S51 T54 T191 F192 V193 F197 T198 Y199 | S51-D195 PolarHBondContact OG-OD2 3.03Å; T54-D195 VanDerWaalsContact CB-OD1 3.28Å; T54-D195 WeakPolarHBondContact CB-OD1 3.44Å; T54-D195 HydrophobicContact CG2-CB 4.41Å; T54-D195 PolarHBondContact OG1-OD1 2.68Å; T191-D195 PolarHBondContact O-N 3.44Å; F192-D195 PolarHBondContact O-N 3.14Å; V193-D195 VanDerWaalsContact C-N 3.31Å; V193-D195 PolarHBondContact O-N 2.86Å; D195-F197 PolarHBondContact O-N 2.73Å; D195-T198 PolarHBondContact O-N 3.5Å; D195-Y199 HydrophobicContact CB-CE2 4.23Å; D195-Y199 WeakPolarHBondContact O-CD2 3.39Å; D195-Y199 PolarHBondContact O-N 3.25Å |
| 196 | I | 90.8 | Very high | 89 | Confident | 81 Ų | 81 | 45.6 Ų | 45.6 | 42% | 0.415 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -55.9 | -52.5 | 177.7 | -69.9 | 168.6 | 0 | 0 | 0 | 111.2 | F192 V193 T198 Y199 A200 | F192-I196 HydrophobicContact CD1-CD1 3.85Å; F192-I196 HydrophobicContact CE1-CD1 3.3Å; F192-I196 HydrophobicContact CE1-CG1 4.4Å; F192-I196 HydrophobicContact CE2-CD1 4.08Å; F192-I196 HydrophobicContact CE2-CG1 4.42Å; F192-I196 HydrophobicContact CG-CD1 4.46Å; F192-I196 HydrophobicContact CZ-CD1 3.45Å; F192-I196 VanDerWaalsContact CZ-CD1 3.45Å; F192-I196 HydrophobicContact CZ-CG1 4.24Å; F192-I196 WeakPolarHBondContact O-CG1 3.29Å; F192-I196 PolarHBondContact O-N 2.95Å; F192-I196 VanDerWaalsContact O-N 3.09Å; V193-I196 PolarHBondContact O-N 3.17Å; I196-T198 VanDerWaalsContact C-N 3.27Å; I196-T198 PolarHBondContact O-N 2.76Å; I196-Y199 PolarHBondContact O-N 2.94Å; I196-A200 PolarHBondContact O-N 3.33Å |
| 197 | F | 88.8 | Confident | 89.2 | Confident | 36 Ų | 36 | 47.8 Ų | 47.8 | 16% | 0.158 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -65.2 | -35.1 | -177.2 | -78.9 | -69.6 | 0 | 0 | 0 | 111.3 | V193 Q194 D195 A200 K201 L328 F331 | V193-F197 HydrophobicContact CG1-CD2 3.67Å; V193-F197 HydrophobicContact CG1-CE2 3.73Å; V193-F197 WeakPolarHBondContact O-CD2 3.39Å; V193-F197 PolarHBondContact O-N 3.29Å; V193-F197 VanDerWaalsContact O-N 3.11Å; Q194-F197 PolarHBondContact O-N 3.02Å; D195-F197 PolarHBondContact O-N 2.73Å; F197-A200 PolarHBondContact O-N 3.01Å; F197-K201 WeakPolarHBondContact O-CG 3.35Å; F197-K201 PolarHBondContact O-N 3.47Å; F197-L328 HydrophobicContact CD1-CB 3.92Å; F197-L328 WeakPolarHBondContact CD1-O 3.48Å; F197-L328 HydrophobicContact CE1-CB 3.9Å; F197-L328 HydrophobicContact CE1-CD2 3.64Å; F197-L328 HydrophobicContact CE1-CG 4.3Å; F197-L328 HydrophobicContact CZ-CD2 4.5Å; F197-F331 HydrophobicContact CD1-CD1 4.41Å; F197-F331 AromaticContact CD2-CD1 3.89Å; F197-F331 HydrophobicContact CD2-CD1 3.89Å; F197-F331 HydrophobicContact CD2-CE1 4.31Å; F197-F331 HydrophobicContact CE1-CB 4.44Å; F197-F331 AromaticContact CE1-CD1 3.88Å; F197-F331 HydrophobicContact CE1-CD1 3.88Å; F197-F331 HydrophobicContact CE1-CG 4.45Å; F197-F331 AromaticContact CE2-CD1 3.34Å; F197-F331 HydrophobicContact CE2-CD1 3.34Å; F197-F331 AromaticContact CE2-CE1 3.49Å; F197-F331 HydrophobicContact CE2-CE1 3.49Å; F197-F331 VanDerWaalsContact CE2-CE1 3.49Å; F197-F331 HydrophobicContact CG-CD1 4.42Å; F197-F331 AromaticContact CZ-CD1 3.34Å; F197-F331 HydrophobicContact CZ-CD1 3.34Å; F197-F331 AromaticContact CZ-CE1 3.67Å; F197-F331 HydrophobicContact CZ-CE1 3.67Å; F197-F331 HydrophobicContact CZ-CG 4.22Å |
| 198 | T | 90.4 | Very high | 89.7 | Confident | 3 Ų | 3 | 47 Ų | 47 | 2% | 0.018 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -64.6 | -43.4 | 175.8 | -55 | 0 | 0 | 0 | 0 | 112 | T54 V57 G58 Q194 D195 I196 A200 K201 V202 | T54-T198 HydrophobicContact CG2-CG2 4.49Å; T54-T198 PolarHBondContact O-OG1 3.13Å; V57-T198 HydrophobicContact CB-CG2 3.92Å; V57-T198 HydrophobicContact CG1-CG2 3.75Å; G58-T198 VanDerWaalsContact CA-OG1 3.29Å; G58-T198 WeakPolarHBondContact CA-OG1 3.38Å; Q194-T198 WeakPolarHBondContact O-CB 3.3Å; Q194-T198 PolarHBondContact O-N 3.48Å; Q194-T198 PolarHBondContact O-OG1 2.98Å; D195-T198 PolarHBondContact O-N 3.5Å; I196-T198 VanDerWaalsContact C-N 3.27Å; I196-T198 PolarHBondContact O-N 2.76Å; T198-A200 VanDerWaalsContact C-N 3.33Å; T198-A200 PolarHBondContact O-N 3.31Å; T198-K201 WeakPolarHBondContact O-CB 3.19Å; T198-K201 PolarHBondContact O-N 2.95Å; T198-V202 WeakPolarHBondContact O-CG2 3.36Å; T198-V202 PolarHBondContact O-N 2.99Å |
| 199 | Y | 90.5 | Very high | 90.2 | Very high | 138 Ų | 138 | 38.4 Ų | 38.4 | 54% | 0.541 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -62.3 | -41.5 | 174.8 | -64.3 | -47.4 | 0 | 0 | 0 | 112.1 | T54 D195 I196 K201 V202 A203 | T54-Y199 HydrophobicContact CG2-CE1 4.02Å; D195-Y199 HydrophobicContact CB-CE2 4.23Å; D195-Y199 WeakPolarHBondContact O-CD2 3.39Å; D195-Y199 PolarHBondContact O-N 3.25Å; I196-Y199 PolarHBondContact O-N 2.94Å; Y199-K201 VanDerWaalsContact C-N 3.34Å; Y199-K201 PolarHBondContact O-N 2.9Å; Y199-V202 PolarHBondContact O-N 3.08Å; Y199-A203 WeakPolarHBondContact O-CB 3.46Å; Y199-A203 PolarHBondContact O-N 2.83Å |
| 200 | A | 88.4 | Confident | 90.6 | Very high | 26 Ų | 26 | 38.6 Ų | 38.6 | 22% | 0.215 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -60.8 | -42.1 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | I196 F197 T198 A203 A204 | I196-A200 PolarHBondContact O-N 3.33Å; F197-A200 PolarHBondContact O-N 3.01Å; T198-A200 VanDerWaalsContact C-N 3.33Å; T198-A200 PolarHBondContact O-N 3.31Å; A200-A203 PolarHBondContact O-N 3.25Å; A200-A204 PolarHBondContact O-N 3.29Å |
| 201 | K | 88.3 | Confident | 90.9 | Very high | 5 Ų | 5 | 39.7 Ų | 39.7 | 2% | 0.022 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -60.4 | -49.1 | 175.3 | -68.2 | 173.3 | -162.6 | -140.4 | 0 | 112.4 | G58 I61 F197 T198 Y199 A203 A204 L205 S329 | G58-K201 PolarHBondContact O-NZ 3.45Å; I61-K201 HydrophobicContact CB-CD 4.31Å; I61-K201 HydrophobicContact CG2-CB 3.97Å; I61-K201 HydrophobicContact CG2-CD 4.13Å; I61-K201 HydrophobicContact CG2-CG 4.46Å; I61-K201 VanDerWaalsContact O-CD 3.31Å; I61-K201 WeakPolarHBondContact O-CD 3.4Å; I61-K201 PolarHBondContact O-NZ 3.37Å; F197-K201 WeakPolarHBondContact O-CG 3.35Å; F197-K201 PolarHBondContact O-N 3.47Å; T198-K201 WeakPolarHBondContact O-CB 3.19Å; T198-K201 PolarHBondContact O-N 2.95Å; Y199-K201 VanDerWaalsContact C-N 3.34Å; Y199-K201 PolarHBondContact O-N 2.9Å; K201-A203 VanDerWaalsContact C-N 3.32Å; K201-A203 PolarHBondContact O-N 3.48Å; K201-A204 WeakPolarHBondContact O-CB 3.17Å; K201-A204 PolarHBondContact O-N 3.27Å; K201-L205 PolarHBondContact O-N 2.9Å; K201-L205 VanDerWaalsContact O-N 3.09Å; K201-S329 WeakPolarHBondContact CD-OG 3.27Å; K201-S329 WeakPolarHBondContact CE-O 3.36Å; K201-S329 WeakPolarHBondContact CG-OG 3.37Å; K201-S329 PolarHBondContact NZ-O 2.96Å |
| 202 | V | 92 | Very high | 91.3 | Very high | 26 Ų | 26 | 39.3 Ų | 39.3 | 16% | 0.158 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -63.8 | -41.8 | -179.3 | 171.8 | 0 | 0 | 0 | 0 | 109.9 | V57 I61 T198 Y199 A204 L205 I206 I283 | V57-V202 HydrophobicContact CG1-CG2 3.8Å; I61-V202 HydrophobicContact CD1-CG2 3.94Å; T198-V202 WeakPolarHBondContact O-CG2 3.36Å; T198-V202 PolarHBondContact O-N 2.99Å; Y199-V202 PolarHBondContact O-N 3.08Å; V202-A204 PolarHBondContact O-N 2.97Å; V202-L205 PolarHBondContact O-N 3.41Å; V202-I206 HydrophobicContact CG1-CD1 3.67Å; V202-I206 HydrophobicContact CG1-CG1 4.27Å; V202-I206 WeakPolarHBondContact O-CB 3.09Å; V202-I206 VanDerWaalsContact O-CG1 3.24Å; V202-I206 WeakPolarHBondContact O-CG1 3.17Å; V202-I206 PolarHBondContact O-N 2.96Å; V202-I283 HydrophobicContact CG1-CD1 4.13Å; V202-I283 HydrophobicContact CG2-CD1 4.46Å |
| 203 | A | 89.9 | Confident | 91.5 | Very high | 46 Ų | 46 | 38.6 Ų | 38.6 | 38% | 0.38 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -59.5 | -43.8 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | Y199 A200 K201 L205 I206 M207 | Y199-A203 WeakPolarHBondContact O-CB 3.46Å; Y199-A203 PolarHBondContact O-N 2.83Å; A200-A203 PolarHBondContact O-N 3.25Å; K201-A203 VanDerWaalsContact C-N 3.32Å; K201-A203 PolarHBondContact O-N 3.48Å; A203-L205 PolarHBondContact O-N 3.18Å; A203-I206 PolarHBondContact O-N 2.91Å; A203-M207 WeakPolarHBondContact O-CG 3.2Å; A203-M207 PolarHBondContact O-N 3.03Å |
| 204 | A | 89.5 | Confident | 91.8 | Very high | 3 Ų | 3 | 40.9 Ų | 40.9 | 3% | 0.025 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -60.3 | -44.8 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | A200 K201 V202 M207 I208 F325 | A200-A204 PolarHBondContact O-N 3.29Å; K201-A204 WeakPolarHBondContact O-CB 3.17Å; K201-A204 PolarHBondContact O-N 3.27Å; V202-A204 PolarHBondContact O-N 2.97Å; A204-M207 WeakPolarHBondContact O-CB 3.45Å; A204-M207 PolarHBondContact O-N 2.76Å; A204-I208 WeakPolarHBondContact O-CG1 3.48Å; A204-I208 PolarHBondContact O-N 3.5Å; A204-I208 VanDerWaalsContact O-N 3.12Å; A204-F325 HydrophobicContact CB-CB 3.66Å; A204-F325 HydrophobicContact CB-CD1 3.69Å; A204-F325 HydrophobicContact CB-CD2 4.05Å; A204-F325 HydrophobicContact CB-CE1 4.33Å; A204-F325 HydrophobicContact CB-CG 3.54Å |
| 205 | L | 93.1 | Very high | 92.1 | Very high | 0 Ų | 0 | 41.5 Ų | 41.5 | 0% | 0 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -68.8 | -37.3 | 177.1 | -68 | 171.8 | 0 | 0 | 0 | 112 | I61 I65 F66 K201 V202 A203 M207 I208 I209 I283 A287 | I61-L205 HydrophobicContact CD1-CD1 4.02Å; I61-L205 HydrophobicContact CG1-CD1 4.46Å; I61-L205 HydrophobicContact CG2-CD1 3.55Å; I65-L205 HydrophobicContact CG1-CD2 4.26Å; I65-L205 HydrophobicContact CG2-CD1 4.43Å; I65-L205 HydrophobicContact CG2-CD2 4.24Å; F66-L205 HydrophobicContact CE1-CD2 3.84Å; F66-L205 HydrophobicContact CZ-CD2 4.21Å; K201-L205 PolarHBondContact O-N 2.9Å; K201-L205 VanDerWaalsContact O-N 3.09Å; V202-L205 PolarHBondContact O-N 3.41Å; A203-L205 PolarHBondContact O-N 3.18Å; L205-M207 VanDerWaalsContact C-N 3.29Å; L205-M207 PolarHBondContact O-N 3.45Å; L205-I208 HydrophobicContact CD2-CD1 4.17Å; L205-I208 PolarHBondContact O-N 3.39Å; L205-I209 WeakPolarHBondContact O-CB 3.25Å; L205-I209 WeakPolarHBondContact O-CD1 3.48Å; L205-I209 WeakPolarHBondContact O-CG1 3.45Å; L205-I209 PolarHBondContact O-N 3.12Å; L205-I283 HydrophobicContact CB-CG2 3.62Å; L205-I283 HydrophobicContact CD1-CG2 3.46Å; L205-I283 VanDerWaalsContact CD1-CG2 3.46Å; L205-I283 HydrophobicContact CG-CG2 4.09Å; L205-A287 HydrophobicContact CD2-CB 4.42Å |
| 206 | I | 93.7 | Very high | 92.3 | Very high | 76 Ų | 76 | 42.9 Ų | 42.9 | 39% | 0.39 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -59.9 | -41.1 | 172.4 | -72.3 | 169.1 | 0 | 0 | 0 | 110.5 | V202 A203 I208 I209 I210 | V202-I206 HydrophobicContact CG1-CD1 3.67Å; V202-I206 HydrophobicContact CG1-CG1 4.27Å; V202-I206 WeakPolarHBondContact O-CB 3.09Å; V202-I206 VanDerWaalsContact O-CG1 3.24Å; V202-I206 WeakPolarHBondContact O-CG1 3.17Å; V202-I206 PolarHBondContact O-N 2.96Å; A203-I206 PolarHBondContact O-N 2.91Å; I206-I208 PolarHBondContact O-N 2.92Å; I206-I209 PolarHBondContact O-N 2.64Å; I206-I210 HydrophobicContact CG2-CD1 3.6Å; I206-I210 HydrophobicContact CG2-CG1 4.19Å; I206-I210 WeakPolarHBondContact O-CB 3.35Å; I206-I210 VanDerWaalsContact O-CG1 3.28Å; I206-I210 WeakPolarHBondContact O-CG1 3.29Å; I206-I210 PolarHBondContact O-N 3.37Å |
| 207 | M | 91.8 | Very high | 92.4 | Very high | 72 Ų | 72 | 42.2 Ų | 42.2 | 36% | 0.355 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -61.7 | -43.4 | 174.9 | -69.9 | -162.6 | -62.4 | 0 | 0 | 112.1 | A203 A204 L205 I209 I210 T211 F325 | A203-M207 WeakPolarHBondContact O-CG 3.2Å; A203-M207 PolarHBondContact O-N 3.03Å; A204-M207 WeakPolarHBondContact O-CB 3.45Å; A204-M207 PolarHBondContact O-N 2.76Å; L205-M207 VanDerWaalsContact C-N 3.29Å; L205-M207 PolarHBondContact O-N 3.45Å; M207-I209 VanDerWaalsContact C-N 3.32Å; M207-I209 PolarHBondContact O-N 3.2Å; M207-I210 PolarHBondContact O-N 2.91Å; M207-T211 WeakPolarHBondContact O-CB 3.34Å; M207-T211 PolarHBondContact O-N 2.99Å; M207-T211 PolarHBondContact O-OG1 3.16Å; M207-F325 HydrophobicContact CE-CD2 3.97Å; M207-F325 HydrophobicContact CE-CE2 3.27Å; M207-F325 HydrophobicContact CE-CZ 3.74Å |
| 208 | I | 93.3 | Very high | 92.5 | Very high | 0 Ų | 0 | 47.8 Ų | 47.8 | 0% | 0 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -59 | -46.9 | 174.6 | -65.2 | 173.3 | 0 | 0 | 0 | 110.4 | A204 L205 I206 T211 G212 A290 Y291 A307 F310 M322 | A204-I208 WeakPolarHBondContact O-CG1 3.48Å; A204-I208 PolarHBondContact O-N 3.5Å; A204-I208 VanDerWaalsContact O-N 3.12Å; L205-I208 HydrophobicContact CD2-CD1 4.17Å; L205-I208 PolarHBondContact O-N 3.39Å; I206-I208 PolarHBondContact O-N 2.92Å; I208-T211 PolarHBondContact O-N 2.66Å; I208-G212 PolarHBondContact O-N 3.03Å; I208-A290 HydrophobicContact CG2-CB 3.92Å; I208-A290 WeakPolarHBondContact O-CB 3.41Å; I208-Y291 HydrophobicContact CD1-CE1 3.96Å; I208-Y291 HydrophobicContact CG2-CD1 4.03Å; I208-Y291 HydrophobicContact CG2-CE1 3.61Å; I208-A307 HydrophobicContact CD1-CB 4.4Å; I208-F310 HydrophobicContact CG1-CE1 4.48Å; I208-F310 HydrophobicContact CG2-CE1 4.18Å; I208-F310 HydrophobicContact CG2-CZ 4.23Å; I208-M322 HydrophobicContact CD1-CE 3.56Å; I208-M322 HydrophobicContact CD1-SD 3.85Å; I208-M322 HydrophobicContact CG1-CE 3.44Å; I208-M322 VanDerWaalsContact CG1-CE 3.44Å; I208-M322 HydrophobicContact CG1-SD 4.39Å |
| 209 | I | 95.8 | Very high | 92.5 | Very high | 15 Ų | 15 | 50 Ų | 50 | 8% | 0.077 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -61.3 | -48.7 | -179.5 | -68.5 | 165 | 0 | 0 | 0 | 110.9 | L205 I206 M207 T211 G212 F213 I283 M286 A287 | L205-I209 WeakPolarHBondContact O-CB 3.25Å; L205-I209 WeakPolarHBondContact O-CD1 3.48Å; L205-I209 WeakPolarHBondContact O-CG1 3.45Å; L205-I209 PolarHBondContact O-N 3.12Å; I206-I209 PolarHBondContact O-N 2.64Å; M207-I209 VanDerWaalsContact C-N 3.32Å; M207-I209 PolarHBondContact O-N 3.2Å; I209-T211 PolarHBondContact O-N 3.16Å; I209-G212 PolarHBondContact O-N 3.34Å; I209-F213 HydrophobicContact CG2-CD2 3.66Å; I209-F213 HydrophobicContact CG2-CE2 3.49Å; I209-F213 VanDerWaalsContact CG2-CE2 3.49Å; I209-F213 VanDerWaalsContact O-CD2 3.22Å; I209-F213 WeakPolarHBondContact O-CD2 3.36Å; I209-F213 PolarHBondContact O-N 3.25Å; I209-I283 HydrophobicContact CD1-CB 4.48Å; I209-I283 HydrophobicContact CD1-CG2 4.17Å; I209-M286 HydrophobicContact CD1-CB 3.82Å; I209-M286 HydrophobicContact CG1-CB 3.83Å; I209-M286 HydrophobicContact CG2-CB 4.02Å; I209-A287 HydrophobicContact CG1-CB 4.36Å |
| 210 | I | 95.9 | Very high | 92.4 | Very high | 96 Ų | 96 | 48.1 Ų | 48.1 | 49% | 0.492 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -59.9 | -47.3 | 177.6 | -69.2 | 169.2 | 0 | 0 | 0 | 110.3 | I206 M207 G212 F213 V214 | I206-I210 HydrophobicContact CG2-CD1 3.6Å; I206-I210 HydrophobicContact CG2-CG1 4.19Å; I206-I210 WeakPolarHBondContact O-CB 3.35Å; I206-I210 VanDerWaalsContact O-CG1 3.28Å; I206-I210 WeakPolarHBondContact O-CG1 3.29Å; I206-I210 PolarHBondContact O-N 3.37Å; M207-I210 PolarHBondContact O-N 2.91Å; I210-G212 VanDerWaalsContact C-N 3.29Å; I210-G212 PolarHBondContact O-N 2.89Å; I210-F213 PolarHBondContact O-N 3.5Å; I210-V214 HydrophobicContact CG2-CG2 4.45Å; I210-V214 WeakPolarHBondContact O-CG2 3.41Å; I210-V214 PolarHBondContact O-N 3.26Å |
| 211 | T | 94 | Very high | 92.3 | Very high | 23 Ų | 23 | 49.4 Ų | 49.4 | 14% | 0.141 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -59 | -42.1 | 177.4 | -62.3 | 0 | 0 | 0 | 0 | 111.2 | M207 I208 I209 V214 Q215 F310 I314 Y315 | M207-T211 WeakPolarHBondContact O-CB 3.34Å; M207-T211 PolarHBondContact O-N 2.99Å; M207-T211 PolarHBondContact O-OG1 3.16Å; I208-T211 PolarHBondContact O-N 2.66Å; I209-T211 PolarHBondContact O-N 3.16Å; T211-V214 PolarHBondContact O-N 2.93Å; T211-Q215 WeakPolarHBondContact O-CG 3.13Å; T211-Q215 PolarHBondContact O-N 3.01Å; T211-F310 HydrophobicContact CG2-CE1 4.01Å; T211-F310 HydrophobicContact CG2-CZ 3.73Å; T211-I314 HydrophobicContact CG2-CG1 3.72Å; T211-I314 HydrophobicContact CG2-CG2 4.2Å; T211-Y315 HydrophobicContact CG2-CE1 4.33Å; T211-Y315 PolarHBondContact OG1-OH 3.02Å |
| 212 | G | 94.5 | Very high | 92 | Very high | 1 Ų | 1 | 55.5 Ų | 55.5 | 1% | 0.01 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -60.3 | -47 | 174.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | I208 I209 I210 V214 Q215 I216 | I208-G212 PolarHBondContact O-N 3.03Å; I209-G212 PolarHBondContact O-N 3.34Å; I210-G212 VanDerWaalsContact C-N 3.29Å; I210-G212 PolarHBondContact O-N 2.89Å; G212-V214 VanDerWaalsContact C-N 3.31Å; G212-V214 PolarHBondContact O-N 3.5Å; G212-Q215 PolarHBondContact O-N 3.28Å; G212-Q215 VanDerWaalsContact O-N 3.14Å; G212-I216 WeakPolarHBondContact O-CG1 3.3Å; G212-I216 PolarHBondContact O-N 3.36Å |
| 213 | F | 95.1 | Very high | 91.3 | Very high | 116 Ų | 116 | 55 Ų | 55 | 51% | 0.509 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -62 | -37.9 | 175.9 | -81.8 | -67.4 | 0 | 0 | 0 | 112.8 | I209 I210 I216 G217 M286 | I209-F213 HydrophobicContact CG2-CD2 3.66Å; I209-F213 HydrophobicContact CG2-CE2 3.49Å; I209-F213 VanDerWaalsContact CG2-CE2 3.49Å; I209-F213 VanDerWaalsContact O-CD2 3.22Å; I209-F213 WeakPolarHBondContact O-CD2 3.36Å; I209-F213 PolarHBondContact O-N 3.25Å; I210-F213 PolarHBondContact O-N 3.5Å; F213-I216 HydrophobicContact CD1-CD1 4.4Å; F213-I216 PolarHBondContact O-N 3.34Å; F213-G217 PolarHBondContact O-N 3.16Å; F213-M286 HydrophobicContact CE2-SD 4.39Å; F213-M286 HydrophobicContact CZ-SD 3.95Å |
| 214 | V | 95.3 | Very high | 90.9 | Very high | 71 Ų | 71 | 55.6 Ų | 55.6 | 43% | 0.43 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -62.9 | -42.2 | 173.5 | 170 | 0 | 0 | 0 | 0 | 111 | I210 T211 G212 G217 F218 | I210-V214 HydrophobicContact CG2-CG2 4.45Å; I210-V214 WeakPolarHBondContact O-CG2 3.41Å; I210-V214 PolarHBondContact O-N 3.26Å; T211-V214 PolarHBondContact O-N 2.93Å; G212-V214 VanDerWaalsContact C-N 3.31Å; G212-V214 PolarHBondContact O-N 3.5Å; V214-G217 PolarHBondContact O-N 3.3Å; V214-F218 HydrophobicContact CG1-CD2 3.94Å; V214-F218 HydrophobicContact CG1-CE2 3.45Å; V214-F218 VanDerWaalsContact CG1-CE2 3.45Å; V214-F218 HydrophobicContact CG1-CZ 4.36Å; V214-F218 WeakPolarHBondContact O-CD2 3.44Å; V214-F218 PolarHBondContact O-N 3.4Å; V214-F218 VanDerWaalsContact O-N 3.09Å |
| 215 | Q | 93.8 | Very high | 90.7 | Very high | 15 Ų | 15 | 60.5 Ų | 60.5 | 7% | 0.07 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -64.6 | -37.6 | 175.4 | -66.8 | -55 | -67.3 | 0 | 0 | 112.8 | T211 G212 G217 F218 G219 K220 V294 | T211-Q215 WeakPolarHBondContact O-CG 3.13Å; T211-Q215 PolarHBondContact O-N 3.01Å; G212-Q215 PolarHBondContact O-N 3.28Å; G212-Q215 VanDerWaalsContact O-N 3.14Å; Q215-G217 VanDerWaalsContact C-N 3.3Å; Q215-G217 PolarHBondContact O-N 3.01Å; Q215-F218 CarbonylContact O-C 3.59Å; Q215-F218 WeakPolarHBondContact O-CA 3.37Å; Q215-F218 WeakPolarHBondContact O-CB 3.33Å; Q215-F218 PolarHBondContact O-N 2.93Å; Q215-F218 VanDerWaalsContact O-N 3.11Å; Q215-G219 PolarHBondContact O-N 3.23Å; Q215-K220 HydrophobicContact CB-CB 4.42Å; Q215-K220 WeakPolarHBondContact O-CB 3.41Å; Q215-K220 PolarHBondContact O-N 2.94Å; Q215-K220 VanDerWaalsContact O-N 3.1Å; Q215-K220 VanDerWaalsContact OE1-CD 3.24Å; Q215-K220 VanDerWaalsContact OE1-CE 3.23Å; Q215-V294 HydrophobicContact CG-CG2 3.79Å |
| 216 | I | 92.8 | Very high | 90.2 | Very high | 51 Ų | 51 | 62.1 Ų | 62.1 | 26% | 0.262 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -62.1 | -40.9 | 172.2 | -66.7 | 167.6 | 0 | 0 | 0 | 110.4 | G212 F213 F218 G219 V221 V289 T293 | G212-I216 WeakPolarHBondContact O-CG1 3.3Å; G212-I216 PolarHBondContact O-N 3.36Å; F213-I216 HydrophobicContact CD1-CD1 4.4Å; F213-I216 PolarHBondContact O-N 3.34Å; I216-F218 PolarHBondContact O-N 2.89Å; I216-G219 WeakPolarHBondContact O-CA 3.4Å; I216-G219 PolarHBondContact O-N 3.45Å; I216-V221 HydrophobicContact CG1-CG1 4.45Å; I216-V221 HydrophobicContact CG2-CG1 3.97Å; I216-V289 HydrophobicContact CD1-CG1 4.15Å; I216-T293 HydrophobicContact CD1-CG2 3.93Å; I216-T293 HydrophobicContact CG1-CG2 3.49Å; I216-T293 VanDerWaalsContact CG1-CG2 3.49Å |
| 217 | G | 92.7 | Very high | 89.8 | Confident | 68 Ų | 68 | 59.5 Ų | 59.5 | 70% | 0.701 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -60.6 | -29.3 | 173.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | F213 V214 Q215 G219 | F213-G217 PolarHBondContact O-N 3.16Å; V214-G217 PolarHBondContact O-N 3.3Å; Q215-G217 VanDerWaalsContact C-N 3.3Å; Q215-G217 PolarHBondContact O-N 3.01Å; G217-G219 PolarHBondContact O-N 3.43Å |
| 218 | F | 92.8 | Very high | 89.7 | Confident | 153 Ų | 153 | 61.4 Ų | 61.4 | 67% | 0.671 | 36% | 0.355 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.9 | 5.6 | 170.8 | -68.6 | -57.2 | 0 | 0 | 0 | 114.1 | V214 Q215 I216 | V214-F218 HydrophobicContact CG1-CD2 3.94Å; V214-F218 HydrophobicContact CG1-CE2 3.45Å; V214-F218 VanDerWaalsContact CG1-CE2 3.45Å; V214-F218 HydrophobicContact CG1-CZ 4.36Å; V214-F218 WeakPolarHBondContact O-CD2 3.44Å; V214-F218 PolarHBondContact O-N 3.4Å; V214-F218 VanDerWaalsContact O-N 3.09Å; Q215-F218 CarbonylContact O-C 3.59Å; Q215-F218 WeakPolarHBondContact O-CA 3.37Å; Q215-F218 WeakPolarHBondContact O-CB 3.33Å; Q215-F218 PolarHBondContact O-N 2.93Å; Q215-F218 VanDerWaalsContact O-N 3.11Å; I216-F218 PolarHBondContact O-N 2.89Å |
| 219 | G | 89.6 | Confident | 89.4 | Confident | 48 Ų | 48 | 66.5 Ų | 66.5 | 50% | 0.495 | 38% | 0.382 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 81.7 | 9.2 | 178.2 | 0 | 0 | 0 | 0 | 0 | 114.8 | Q215 I216 G217 V221 | Q215-G219 PolarHBondContact O-N 3.23Å; I216-G219 WeakPolarHBondContact O-CA 3.4Å; I216-G219 PolarHBondContact O-N 3.45Å; G217-G219 PolarHBondContact O-N 3.43Å; G219-V221 VanDerWaalsContact C-N 3.26Å; G219-V221 PolarHBondContact O-N 3.25Å |
| 220 | K | 87.7 | Confident | 89 | Confident | 99 Ų | 99 | 72.2 Ų | 72.2 | 43% | 0.43 | 41% | 0.412 | S | S | . | . | trans | -78.3 | 75.7 | 177.3 | -63 | -166.8 | -173.5 | 169.9 | 0 | 111.4 | Q215 | Q215-K220 HydrophobicContact CB-CB 4.42Å; Q215-K220 WeakPolarHBondContact O-CB 3.41Å; Q215-K220 PolarHBondContact O-N 2.94Å; Q215-K220 VanDerWaalsContact O-N 3.1Å; Q215-K220 VanDerWaalsContact OE1-CD 3.24Å; Q215-K220 VanDerWaalsContact OE1-CE 3.23Å | ||
| 221 | V | 87 | Confident | 88.7 | Confident | 53 Ų | 53 | 68.9 Ų | 68.9 | 32% | 0.321 | 40% | 0.398 | S | S | . | . | trans | -115.8 | 9.8 | -179.7 | -63.1 | 0 | 0 | 0 | 0 | 112.9 | I216 G219 G223 L224 V225 | I216-V221 HydrophobicContact CG1-CG1 4.45Å; I216-V221 HydrophobicContact CG2-CG1 3.97Å; G219-V221 VanDerWaalsContact C-N 3.26Å; G219-V221 PolarHBondContact O-N 3.25Å; V221-G223 VanDerWaalsContact C-N 3.26Å; V221-G223 PolarHBondContact O-N 2.95Å; V221-L224 HydrophobicContact CG1-CD1 4.49Å; V221-L224 WeakPolarHBondContact O-CA 3.45Å; V221-L224 WeakPolarHBondContact O-CB 3.44Å; V221-L224 PolarHBondContact O-N 2.96Å; V221-V225 PolarHBondContact O-N 2.99Å | ||
| 222 | D | 82.6 | Confident | 88.6 | Confident | 134 Ų | 134 | 71 Ų | 71 | 72% | 0.717 | 41% | 0.408 | S | S | * | . | G | 310 helix | trans | -55.1 | -39.5 | -174.6 | -58.5 | -38.1 | 0 | 0 | 0 | 112.7 | L224 V225 | D222-L224 PolarHBondContact O-N 2.6Å; D222-V225 PolarHBondContact O-N 2.84Å |
| 223 | G | 76.5 | Confident | 88.3 | Confident | 15 Ų | 15 | 76.8 Ų | 76.8 | 16% | 0.155 | 43% | 0.43 | C | S | . | . | G | 310 helix | trans | -69.8 | -15.3 | 175.9 | 0 | 0 | 0 | 0 | 0 | 114.8 | I79 V221 | I79-G223 WeakPolarHBondContact CD1-O 3.36Å; V221-G223 VanDerWaalsContact C-N 3.26Å; V221-G223 PolarHBondContact O-N 2.95Å |
| 224 | L | 82.3 | Confident | 88.1 | Confident | 58 Ų | 58 | 73.5 Ų | 73.5 | 30% | 0.304 | 42% | 0.421 | S | S | . | . | G | 310 helix | trans | -95.5 | -16.4 | 176.4 | -60.4 | 173.6 | 0 | 0 | 0 | 112 | I79 V221 D222 A227 V292 | I79-L224 HydrophobicContact CG2-CD2 4.43Å; V221-L224 HydrophobicContact CG1-CD1 4.49Å; V221-L224 WeakPolarHBondContact O-CA 3.45Å; V221-L224 WeakPolarHBondContact O-CB 3.44Å; V221-L224 PolarHBondContact O-N 2.96Å; D222-L224 PolarHBondContact O-N 2.6Å; L224-A227 WeakPolarHBondContact O-CB 3.3Å; L224-A227 PolarHBondContact O-N 3.49Å; L224-V292 HydrophobicContact CD2-CG2 3.74Å; L224-V292 HydrophobicContact CG-CG2 4.24Å |
| 225 | V | 84.1 | Confident | 87.6 | Confident | 106 Ų | 106 | 73.2 Ų | 73.2 | 64% | 0.642 | 42% | 0.421 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74 | 128.7 | 172.5 | -178.7 | 0 | 0 | 0 | 0 | 108.3 | V221 D222 A227 | V221-V225 PolarHBondContact O-N 2.99Å; D222-V225 PolarHBondContact O-N 2.84Å; V225-A227 VanDerWaalsContact C-N 3.26Å; V225-A227 PolarHBondContact O-N 2.75Å |
| 226 | G | 83.6 | Confident | 87.1 | Confident | 34 Ų | 34 | 73.6 Ų | 73.6 | 35% | 0.351 | 43% | 0.428 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 64.5 | 31.1 | -175.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | F228 D229 | G226-F228 PolarHBondContact O-N 3.35Å; G226-D229 WeakPolarHBondContact CA-OD2 3.25Å; G226-D229 VanDerWaalsContact O-CB 3.28Å; G226-D229 WeakPolarHBondContact O-CB 3.43Å; G226-D229 PolarHBondContact O-N 2.91Å |
| 227 | A | 85.2 | Confident | 86.8 | Confident | 21 Ų | 21 | 71.3 Ų | 71.3 | 17% | 0.174 | 42% | 0.417 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -52.9 | -26.6 | -172.6 | 0 | 0 | 0 | 0 | 0 | 114.1 | S78 I79 G80 L224 V225 | S78-A227 PolarHBondContact OG-O 2.65Å; I79-A227 PolarHBondContact N-O 3.05Å; G80-A227 PolarHBondContact N-O 3.07Å; L224-A227 WeakPolarHBondContact O-CB 3.3Å; L224-A227 PolarHBondContact O-N 3.49Å; V225-A227 VanDerWaalsContact C-N 3.26Å; V225-A227 PolarHBondContact O-N 2.75Å |
| 228 | F | 90.2 | Very high | 86.7 | Confident | 113 Ų | 113 | 70.2 Ų | 70.2 | 50% | 0.496 | 40% | 0.395 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -96.8 | 3.5 | 180 | -66.2 | -78.3 | 0 | 0 | 0 | 114.5 | S78 I84 G226 N230 S231 W233 | S78-F228 WeakPolarHBondContact OG-CA 3.36Å; I84-F228 HydrophobicContact CD1-CE1 3.67Å; I84-F228 HydrophobicContact CD1-CZ 4Å; G226-F228 PolarHBondContact O-N 3.35Å; F228-N230 PolarHBondContact O-N 3.19Å; F228-S231 VanDerWaalsContact C-OG 3.26Å; F228-S231 WeakPolarHBondContact CA-OG 3.29Å; F228-S231 WeakPolarHBondContact O-CB 3.5Å; F228-S231 PolarHBondContact O-N 3.42Å; F228-S231 PolarHBondContact O-OG 2.96Å; F228-W233 HydrophobicContact CD1-CZ2 4.34Å; F228-W233 HydrophobicContact CE1-CZ2 4.43Å |
| 229 | D | 86.6 | Confident | 86.4 | Confident | 107 Ų | 107 | 63 Ų | 63 | 57% | 0.572 | 36% | 0.363 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.9 | 136.2 | -179.9 | -65.6 | -8 | 0 | 0 | 0 | 110.1 | G226 S231 | G226-D229 WeakPolarHBondContact CA-OD2 3.25Å; G226-D229 VanDerWaalsContact O-CB 3.28Å; G226-D229 WeakPolarHBondContact O-CB 3.43Å; G226-D229 PolarHBondContact O-N 2.91Å; D229-S231 PolarHBondContact O-N 2.77Å |
| 230 | N | 86.9 | Confident | 86.3 | Confident | 134 Ų | 134 | 65.2 Ų | 65.2 | 72% | 0.717 | 36% | 0.359 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 59.4 | 20.1 | -176.6 | -51.2 | -54.5 | 0 | 0 | 0 | 116 | F228 D232 | F228-N230 PolarHBondContact O-N 3.19Å; N230-D232 PolarHBondContact O-N 3.41Å |
| 231 | S | 90.1 | Very high | 86.4 | Confident | 26 Ų | 26 | 60.5 Ų | 60.5 | 18% | 0.182 | 34% | 0.339 | C | S | . | . | trans | -58.1 | 122.6 | 177.5 | -60.4 | 0 | 0 | 0 | 0 | 112.2 | V76 S78 F228 D229 W233 | V76-S231 WeakPolarHBondContact O-CA 3.49Å; S78-S231 WeakPolarHBondContact CB-OG 3.5Å; S78-S231 PolarHBondContact OG-OG 3.06Å; F228-S231 VanDerWaalsContact C-OG 3.26Å; F228-S231 WeakPolarHBondContact CA-OG 3.29Å; F228-S231 WeakPolarHBondContact O-CB 3.5Å; F228-S231 PolarHBondContact O-N 3.42Å; F228-S231 PolarHBondContact O-OG 2.96Å; D229-S231 PolarHBondContact O-N 2.77Å; S231-W233 VanDerWaalsContact CB-NE1 3.25Å | ||
| 232 | D | 90.4 | Very high | 86.6 | Confident | 67 Ų | 67 | 58.9 Ų | 58.9 | 36% | 0.358 | 33% | 0.327 | S | S | . | . | trans | -90.4 | 107.6 | 169.9 | -171.8 | -5.1 | 0 | 0 | 0 | 110.4 | V76 N230 S234 A237 | V76-D232 PolarHBondContact O-N 3.46Å; N230-D232 PolarHBondContact O-N 3.41Å; D232-S234 WeakPolarHBondContact OD1-CA 3.46Å; D232-S234 WeakPolarHBondContact OD1-CB 3.33Å; D232-S234 PolarHBondContact OD1-N 3.08Å; D232-S234 PolarHBondContact OD1-OG 3.19Å; D232-S234 PolarHBondContact OD2-OG 3.16Å; D232-A237 HydrophobicContact CB-CB 4.14Å; D232-A237 WeakPolarHBondContact OD2-CB 3.35Å | ||
| 233 | W | 90.1 | Very high | 86.8 | Confident | 124 Ų | 124 | 54.3 Ų | 54.3 | 47% | 0.47 | 30% | 0.3 | S | S | . | . | trans | -97.7 | 15.3 | 175.9 | -64.4 | 100.7 | 0 | 0 | 0 | 112.9 | A81 I84 F228 S231 I238 | A81-W233 HydrophobicContact CB-CH2 4.06Å; A81-W233 HydrophobicContact CB-CZ2 3.93Å; I84-W233 HydrophobicContact CD1-CH2 3.93Å; I84-W233 HydrophobicContact CG2-CH2 4.48Å; F228-W233 HydrophobicContact CD1-CZ2 4.34Å; F228-W233 HydrophobicContact CE1-CZ2 4.43Å; S231-W233 VanDerWaalsContact CB-NE1 3.25Å; W233-I238 HydrophobicContact CB-CD1 4.5Å; W233-I238 HydrophobicContact CE3-CD1 4.02Å; W233-I238 HydrophobicContact CE3-CG1 4.44Å; W233-I238 VanDerWaalsContact O-CD1 3.29Å; W233-I238 WeakPolarHBondContact O-CD1 3.48Å | ||
| 234 | S | 88.9 | Confident | 87.3 | Confident | 46 Ų | 46 | 55.6 Ų | 55.6 | 32% | 0.322 | 31% | 0.305 | S | S | . | . | trans | -61.7 | 141.6 | 176.6 | 69.3 | 0 | 0 | 0 | 0 | 110.5 | D232 G236 A237 I238 | D232-S234 WeakPolarHBondContact OD1-CA 3.46Å; D232-S234 WeakPolarHBondContact OD1-CB 3.33Å; D232-S234 PolarHBondContact OD1-N 3.08Å; D232-S234 PolarHBondContact OD1-OG 3.19Å; D232-S234 PolarHBondContact OD2-OG 3.16Å; S234-G236 PolarHBondContact O-N 2.99Å; S234-G236 VanDerWaalsContact O-N 3.11Å; S234-A237 PolarHBondContact O-N 3.4Å; S234-A237 VanDerWaalsContact O-N 3.1Å; S234-A237 WeakPolarHBondContact OG-CB 3.3Å; S234-A237 PolarHBondContact OG-N 3.01Å; S234-I238 WeakPolarHBondContact O-CG1 3.49Å; S234-I238 PolarHBondContact O-N 3.39Å | ||
| 235 | P | 85.2 | Confident | 87.8 | Confident | 66 Ų | 66 | 52.8 Ų | 52.8 | 43% | 0.429 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -54.5 | -34.3 | -179.7 | -29.3 | 35.8 | 0 | 0 | 0 | 113.8 | T239 F440 F444 | P235-T239 VanDerWaalsContact O-CB 3.32Å; P235-T239 WeakPolarHBondContact O-CB 3.35Å; P235-T239 PolarHBondContact O-N 3.49Å; P235-T239 PolarHBondContact O-OG1 3.48Å; P235-F440 HydrophobicContact CB-CZ 4.19Å; P235-F444 HydrophobicContact CB-CD1 4.23Å; P235-F444 HydrophobicContact CB-CE1 3.7Å; P235-F444 HydrophobicContact CB-CE2 4.49Å; P235-F444 HydrophobicContact CB-CZ 3.85Å |
| 236 | G | 83.5 | Confident | 88.1 | Confident | 22 Ų | 22 | 47.8 Ų | 47.8 | 23% | 0.227 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -69.9 | -44.1 | 177 | 0 | 0 | 0 | 0 | 0 | 113.3 | S234 T239 K240 | S234-G236 PolarHBondContact O-N 2.99Å; S234-G236 VanDerWaalsContact O-N 3.11Å; G236-T239 PolarHBondContact O-N 3.46Å; G236-K240 WeakPolarHBondContact O-CG 3.35Å; G236-K240 PolarHBondContact O-N 3.03Å |
| 237 | A | 86.9 | Confident | 88.2 | Confident | 3 Ų | 3 | 50.7 Ų | 50.7 | 3% | 0.025 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -61.6 | -49.8 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | N75 D232 S234 T239 K240 A241 | N75-A237 VanDerWaalsContact O-CB 3.29Å; N75-A237 WeakPolarHBondContact O-CB 3.13Å; D232-A237 HydrophobicContact CB-CB 4.14Å; D232-A237 WeakPolarHBondContact OD2-CB 3.35Å; S234-A237 PolarHBondContact O-N 3.4Å; S234-A237 VanDerWaalsContact O-N 3.1Å; S234-A237 WeakPolarHBondContact OG-CB 3.3Å; S234-A237 PolarHBondContact OG-N 3.01Å; A237-T239 VanDerWaalsContact C-N 3.3Å; A237-T239 PolarHBondContact O-N 3.28Å; A237-K240 PolarHBondContact O-N 3.28Å; A237-A241 WeakPolarHBondContact O-CB 3.4Å; A237-A241 PolarHBondContact O-N 3.43Å |
| 238 | I | 89.6 | Confident | 88.4 | Confident | 45 Ų | 45 | 49.8 Ų | 49.8 | 23% | 0.231 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -56.4 | -47.1 | 177.3 | -65.3 | 171 | 0 | 0 | 0 | 109.9 | I85 W233 S234 K240 A241 F242 | I85-I238 HydrophobicContact CD1-CG2 4.14Å; W233-I238 HydrophobicContact CB-CD1 4.5Å; W233-I238 HydrophobicContact CE3-CD1 4.02Å; W233-I238 HydrophobicContact CE3-CG1 4.44Å; W233-I238 VanDerWaalsContact O-CD1 3.29Å; W233-I238 WeakPolarHBondContact O-CD1 3.48Å; S234-I238 WeakPolarHBondContact O-CG1 3.49Å; S234-I238 PolarHBondContact O-N 3.39Å; I238-K240 PolarHBondContact O-N 3.11Å; I238-A241 PolarHBondContact O-N 2.93Å; I238-F242 VanDerWaalsContact O-CB 3.28Å; I238-F242 WeakPolarHBondContact O-CB 3.44Å; I238-F242 PolarHBondContact O-N 2.99Å |
| 239 | T | 87.4 | Confident | 88.5 | Confident | 1 Ų | 1 | 44.4 Ų | 44.4 | 1% | 0.006 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -60.4 | -48.4 | -179.4 | -62.9 | 0 | 0 | 0 | 0 | 112 | P235 G236 A237 F242 Y243 F440 L441 F444 | P235-T239 VanDerWaalsContact O-CB 3.32Å; P235-T239 WeakPolarHBondContact O-CB 3.35Å; P235-T239 PolarHBondContact O-N 3.49Å; P235-T239 PolarHBondContact O-OG1 3.48Å; G236-T239 PolarHBondContact O-N 3.46Å; A237-T239 VanDerWaalsContact C-N 3.3Å; A237-T239 PolarHBondContact O-N 3.28Å; T239-F242 PolarHBondContact O-N 3.38Å; T239-Y243 HydrophobicContact CG2-CD2 3.77Å; T239-Y243 HydrophobicContact CG2-CE2 3.48Å; T239-Y243 VanDerWaalsContact CG2-CE2 3.48Å; T239-Y243 WeakPolarHBondContact O-CD2 3.45Å; T239-Y243 PolarHBondContact O-N 2.9Å; T239-F440 WeakPolarHBondContact OG1-CE1 3.28Å; T239-L441 HydrophobicContact CG2-CD2 3.95Å; T239-F444 HydrophobicContact CG2-CB 3.78Å; T239-F444 WeakPolarHBondContact OG1-CB 3.32Å |
| 240 | K | 87.2 | Confident | 88.5 | Confident | 96 Ų | 96 | 40.2 Ų | 40.2 | 42% | 0.417 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -61.9 | -45.5 | 178.6 | -72.9 | -176.5 | -74.4 | 154.8 | 0 | 111.8 | N75 G236 A237 I238 F242 Y243 V244 | N75-K240 HydrophobicContact CB-CB 4.3Å; N75-K240 WeakPolarHBondContact OD1-CB 3.48Å; N75-K240 WeakPolarHBondContact OD1-CD 3.45Å; N75-K240 VanDerWaalsContact OD1-CE 3.26Å; N75-K240 WeakPolarHBondContact OD1-CE 3.44Å; N75-K240 PolarHBondContact OD1-NZ 2.92Å; N75-K240 VanDerWaalsContact OD1-NZ 3.08Å; G236-K240 WeakPolarHBondContact O-CG 3.35Å; G236-K240 PolarHBondContact O-N 3.03Å; A237-K240 PolarHBondContact O-N 3.28Å; I238-K240 PolarHBondContact O-N 3.11Å; K240-F242 VanDerWaalsContact C-N 3.31Å; K240-F242 PolarHBondContact O-N 2.88Å; K240-Y243 PolarHBondContact O-N 3.22Å; K240-V244 WeakPolarHBondContact O-CG2 3.39Å; K240-V244 PolarHBondContact O-N 2.65Å |
| 241 | A | 90.9 | Very high | 88.6 | Confident | 0 Ų | 0 | 33.9 Ų | 33.9 | 0% | 0 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -60.5 | -41.3 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112 | I72 N75 V76 I85 A237 I238 V244 G245 | I72-A241 HydrophobicContact CG2-CB 4.31Å; N75-A241 HydrophobicContact CB-CB 3.89Å; V76-A241 HydrophobicContact CG1-CB 3.69Å; I85-A241 HydrophobicContact CG1-CB 4.32Å; I85-A241 HydrophobicContact CG2-CB 4.27Å; A237-A241 WeakPolarHBondContact O-CB 3.4Å; A237-A241 PolarHBondContact O-N 3.43Å; I238-A241 PolarHBondContact O-N 2.93Å; A241-V244 PolarHBondContact O-N 3.48Å; A241-G245 PolarHBondContact O-N 3.46Å |
| 242 | F | 90.4 | Very high | 88.7 | Confident | 19 Ų | 19 | 32.7 Ų | 32.7 | 8% | 0.083 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -64 | -41.1 | 177.6 | -144.7 | -99.4 | 0 | 0 | 0 | 111.5 | I85 A88 F92 I238 T239 K240 V244 G245 L246 L441 | I85-F242 HydrophobicContact CD1-CD2 4.28Å; I85-F242 HydrophobicContact CG2-CD2 4.41Å; A88-F242 HydrophobicContact CB-CE2 3.75Å; A88-F242 HydrophobicContact CB-CZ 4.43Å; F92-F242 HydrophobicContact CB-CE1 4.21Å; F92-F242 HydrophobicContact CB-CZ 3.91Å; F92-F242 AromaticContact CD1-CE1 3.93Å; F92-F242 HydrophobicContact CD1-CE1 3.93Å; F92-F242 HydrophobicContact CD1-CZ 4.49Å; F92-F242 HydrophobicContact CE1-CE1 4.4Å; F92-F242 AromaticContact CG-CE1 3.98Å; F92-F242 HydrophobicContact CG-CE1 3.98Å; F92-F242 HydrophobicContact CG-CZ 4.15Å; I238-F242 VanDerWaalsContact O-CB 3.28Å; I238-F242 WeakPolarHBondContact O-CB 3.44Å; I238-F242 PolarHBondContact O-N 2.99Å; T239-F242 PolarHBondContact O-N 3.38Å; K240-F242 VanDerWaalsContact C-N 3.31Å; K240-F242 PolarHBondContact O-N 2.88Å; F242-V244 PolarHBondContact O-N 2.89Å; F242-G245 PolarHBondContact O-N 3Å; F242-L246 HydrophobicContact CD1-CD1 3.43Å; F242-L246 VanDerWaalsContact CD1-CD1 3.43Å; F242-L246 HydrophobicContact CD1-CD2 4.11Å; F242-L246 HydrophobicContact CD1-CG 3.54Å; F242-L246 HydrophobicContact CE1-CD1 3.66Å; F242-L246 HydrophobicContact CE1-CD2 3.74Å; F242-L246 HydrophobicContact CE1-CG 3.71Å; F242-L246 HydrophobicContact CG-CG 4.45Å; F242-L246 HydrophobicContact CZ-CD2 4.46Å; F242-L246 VanDerWaalsContact O-CB 3.23Å; F242-L246 WeakPolarHBondContact O-CB 3.44Å; F242-L246 WeakPolarHBondContact O-CG 3.18Å; F242-L246 PolarHBondContact O-N 3.05Å; F242-L441 HydrophobicContact CB-CD2 3.88Å; F242-L441 HydrophobicContact CD1-CD1 3.58Å; F242-L441 HydrophobicContact CD1-CD2 3.88Å; F242-L441 HydrophobicContact CD1-CG 4.35Å; F242-L441 HydrophobicContact CE1-CD1 3.99Å; F242-L441 HydrophobicContact CG-CD2 4.13Å |
| 243 | Y | 87.2 | Confident | 88.7 | Confident | 38 Ų | 38 | 29.5 Ų | 29.5 | 15% | 0.149 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -60.7 | -43.1 | 174.8 | -84 | -67.8 | 0 | 0 | 0 | 112.7 | T239 K240 F247 W400 L441 V442 A445 | T239-Y243 HydrophobicContact CG2-CD2 3.77Å; T239-Y243 HydrophobicContact CG2-CE2 3.48Å; T239-Y243 VanDerWaalsContact CG2-CE2 3.48Å; T239-Y243 WeakPolarHBondContact O-CD2 3.45Å; T239-Y243 PolarHBondContact O-N 2.9Å; K240-Y243 PolarHBondContact O-N 3.22Å; Y243-F247 WeakPolarHBondContact O-CB 3.34Å; Y243-F247 PolarHBondContact O-N 2.72Å; Y243-W400 AromaticContact CD1-CD1 3.47Å; Y243-W400 VanDerWaalsContact CD1-CD1 3.47Å; Y243-W400 HydrophobicContact CD1-CG 4.29Å; Y243-W400 HydrophobicContact CE1-CB 4.06Å; Y243-W400 AromaticContact CE1-CD1 3.5Å; Y243-W400 AromaticContact CE1-CG 3.99Å; Y243-W400 HydrophobicContact CE1-CG 3.99Å; Y243-L441 HydrophobicContact CE2-CB 4.15Å; Y243-L441 WeakPolarHBondContact CE2-O 3.31Å; Y243-L441 PolarHBondContact OH-O 3.41Å; Y243-V442 PolarHBondContact OH-N 3.15Å; Y243-A445 HydrophobicContact CE2-CB 3.75Å |
| 244 | V | 87.4 | Confident | 88.7 | Confident | 41 Ų | 41 | 24.3 Ų | 24.3 | 25% | 0.248 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -66.2 | -39.2 | 177.1 | 177.6 | 0 | 0 | 0 | 0 | 111.6 | S68 I72 K240 A241 F242 | S68-V244 PolarHBondContact OG-O 2.9Å; I72-V244 HydrophobicContact CG1-CB 4.21Å; I72-V244 HydrophobicContact CG1-CG1 4.04Å; K240-V244 WeakPolarHBondContact O-CG2 3.39Å; K240-V244 PolarHBondContact O-N 2.65Å; A241-V244 PolarHBondContact O-N 3.48Å; F242-V244 PolarHBondContact O-N 2.89Å |
| 245 | G | 91.5 | Very high | 88.8 | Confident | 0 Ų | 0 | 22.1 Ų | 22.1 | 0% | 0 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -68.4 | -47.3 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | A241 F242 F247 A248 Y249 | A241-G245 PolarHBondContact O-N 3.46Å; F242-G245 PolarHBondContact O-N 3Å; G245-F247 VanDerWaalsContact C-N 3.26Å; G245-F247 PolarHBondContact O-N 3.27Å; G245-A248 WeakPolarHBondContact O-CB 3.13Å; G245-A248 PolarHBondContact O-N 2.9Å; G245-Y249 WeakPolarHBondContact O-CD2 3.26Å; G245-Y249 PolarHBondContact O-N 3.09Å |
| 246 | L | 90.3 | Very high | 89.1 | Confident | 0 Ų | 0 | 19 Ų | 19 | 0% | 0 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -61.4 | -34.5 | 177.3 | -73.6 | -174.9 | 0 | 0 | 0 | 112.3 | C89 F92 F242 A248 Y249 S250 W400 L441 | C89-L246 HydrophobicContact CB-CD2 3.94Å; F92-L246 HydrophobicContact CD1-CD1 4.12Å; F92-L246 HydrophobicContact CD1-CD2 3.48Å; F92-L246 VanDerWaalsContact CD1-CD2 3.48Å; F92-L246 HydrophobicContact CD1-CG 4.44Å; F92-L246 HydrophobicContact CE1-CD1 3.86Å; F92-L246 HydrophobicContact CE1-CD2 4.03Å; F92-L246 HydrophobicContact CG-CD2 4.46Å; F242-L246 HydrophobicContact CD1-CD1 3.43Å; F242-L246 VanDerWaalsContact CD1-CD1 3.43Å; F242-L246 HydrophobicContact CD1-CD2 4.11Å; F242-L246 HydrophobicContact CD1-CG 3.54Å; F242-L246 HydrophobicContact CE1-CD1 3.66Å; F242-L246 HydrophobicContact CE1-CD2 3.74Å; F242-L246 HydrophobicContact CE1-CG 3.71Å; F242-L246 HydrophobicContact CG-CG 4.45Å; F242-L246 HydrophobicContact CZ-CD2 4.46Å; F242-L246 VanDerWaalsContact O-CB 3.23Å; F242-L246 WeakPolarHBondContact O-CB 3.44Å; F242-L246 WeakPolarHBondContact O-CG 3.18Å; F242-L246 PolarHBondContact O-N 3.05Å; L246-A248 VanDerWaalsContact C-N 3.28Å; L246-A248 PolarHBondContact O-N 3.48Å; L246-Y249 CarbonylContact O-C 3.5Å; L246-Y249 PolarHBondContact O-N 3.39Å; L246-Y249 VanDerWaalsContact O-N 3.11Å; L246-S250 PolarHBondContact O-N 3.31Å; L246-W400 HydrophobicContact CB-CD2 4.41Å; L246-W400 HydrophobicContact CB-CH2 3.79Å; L246-W400 HydrophobicContact CB-CZ2 3.39Å; L246-W400 HydrophobicContact CB-CZ3 4.44Å; L246-W400 HydrophobicContact CD1-CD2 3.97Å; L246-W400 HydrophobicContact CD1-CE3 4.04Å; L246-W400 HydrophobicContact CD1-CH2 4.37Å; L246-W400 HydrophobicContact CD1-CZ2 4.34Å; L246-W400 HydrophobicContact CD1-CZ3 4.21Å; L246-W400 HydrophobicContact CD2-CH2 4.38Å; L246-W400 HydrophobicContact CG-CH2 4.42Å; L246-W400 HydrophobicContact CG-CZ2 4.39Å; L246-W400 VanDerWaalsContact O-CZ2 3.28Å; L246-W400 WeakPolarHBondContact O-CZ2 3.47Å; L246-L441 HydrophobicContact CD1-CD1 3.87Å |
| 247 | F | 86.4 | Confident | 89.4 | Confident | 96 Ų | 96 | 17.9 Ų | 17.9 | 42% | 0.421 | 9% | 0.086 | S | C | . | . | H | α-helix | trans | -54.8 | -44.3 | 170.2 | 169.3 | -101.5 | 0 | 0 | 0 | 111.8 | Y243 G245 Y249 S250 | Y243-F247 WeakPolarHBondContact O-CB 3.34Å; Y243-F247 PolarHBondContact O-N 2.72Å; G245-F247 VanDerWaalsContact C-N 3.26Å; G245-F247 PolarHBondContact O-N 3.27Å; F247-Y249 VanDerWaalsContact C-N 3.3Å; F247-Y249 PolarHBondContact O-N 3Å; F247-S250 VanDerWaalsContact O-CB 3.31Å; F247-S250 WeakPolarHBondContact O-CB 3.42Å; F247-S250 PolarHBondContact O-N 3.45Å |
| 248 | A | 89.5 | Confident | 89.4 | Confident | 2 Ų | 2 | 17.8 Ų | 17.8 | 2% | 0.017 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -68.5 | -26.5 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | W86 G245 L246 Y284 | W86-A248 HydrophobicContact CH2-CB 3.62Å; W86-A248 HydrophobicContact CZ3-CB 3.66Å; G245-A248 WeakPolarHBondContact O-CB 3.13Å; G245-A248 PolarHBondContact O-N 2.9Å; L246-A248 VanDerWaalsContact C-N 3.28Å; L246-A248 PolarHBondContact O-N 3.48Å; A248-Y284 HydrophobicContact CB-CE2 4.14Å; A248-Y284 VanDerWaalsContact O-CE2 3.28Å; A248-Y284 WeakPolarHBondContact O-CE2 3.38Å; A248-Y284 PolarHBondContact O-OH 2.95Å |
| 249 | Y | 91.9 | Very high | 89.4 | Confident | 0 Ų | 0 | 15.6 Ų | 15.6 | 0% | 0 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -89.5 | -2.6 | 175.2 | -77.4 | -81.3 | 0 | 0 | 0 | 113.9 | M60 W86 C89 G90 S93 G245 L246 F247 W252 V280 T281 Y284 | M60-Y249 HydrophobicContact CE-CD1 3.65Å; M60-Y249 HydrophobicContact CE-CG 4.44Å; M60-Y249 WeakPolarHBondContact CE-O 3.36Å; W86-Y249 HydrophobicContact CE3-CD2 4.41Å; W86-Y249 AromaticContact CE3-CE2 3.58Å; W86-Y249 HydrophobicContact CE3-CE2 3.58Å; W86-Y249 HydrophobicContact CZ3-CD2 4.43Å; W86-Y249 AromaticContact CZ3-CE2 3.99Å; W86-Y249 HydrophobicContact CZ3-CE2 3.99Å; W86-Y249 VanDerWaalsContact O-CE2 3.22Å; W86-Y249 WeakPolarHBondContact O-CE2 3.29Å; W86-Y249 VanDerWaalsContact O-CZ 3.3Å; W86-Y249 PolarHBondContact O-OH 2.86Å; C89-Y249 HydrophobicContact CB-CD2 3.47Å; C89-Y249 VanDerWaalsContact CB-CD2 3.47Å; C89-Y249 HydrophobicContact CB-CE2 3.54Å; C89-Y249 HydrophobicContact CB-CG 4.48Å; G90-Y249 VanDerWaalsContact CA-CE1 3.49Å; S93-Y249 WeakPolarHBondContact OG-CB 3.37Å; G245-Y249 WeakPolarHBondContact O-CD2 3.26Å; G245-Y249 PolarHBondContact O-N 3.09Å; L246-Y249 CarbonylContact O-C 3.5Å; L246-Y249 PolarHBondContact O-N 3.39Å; L246-Y249 VanDerWaalsContact O-N 3.11Å; F247-Y249 VanDerWaalsContact C-N 3.3Å; F247-Y249 PolarHBondContact O-N 3Å; Y249-W252 VanDerWaalsContact O-CD1 3.23Å; Y249-V280 HydrophobicContact CD1-CG1 4.06Å; Y249-V280 HydrophobicContact CE1-CG1 3.93Å; Y249-T281 WeakPolarHBondContact CE1-OG1 3.32Å; Y249-T281 WeakPolarHBondContact OH-CA 3.31Å; Y249-Y284 HydrophobicContact CD1-CD2 4.12Å; Y249-Y284 HydrophobicContact CD1-CE2 4.16Å; Y249-Y284 HydrophobicContact CD2-CD2 4.31Å; Y249-Y284 HydrophobicContact CD2-CE2 4.5Å; Y249-Y284 AromaticContact CE1-CD2 3.66Å; Y249-Y284 HydrophobicContact CE1-CD2 3.66Å; Y249-Y284 HydrophobicContact CE1-CE2 4.15Å; Y249-Y284 AromaticContact CE2-CD2 3.91Å; Y249-Y284 HydrophobicContact CE2-CD2 3.91Å; Y249-Y284 HydrophobicContact CG-CD2 4.43Å; Y249-Y284 HydrophobicContact CG-CE2 4.34Å; Y249-Y284 AromaticContact CZ-CD2 3.57Å |
| 250 | S | 87.5 | Confident | 89.5 | Confident | 18 Ų | 18 | 17.7 Ų | 17.7 | 13% | 0.126 | 8% | 0.083 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -61.8 | 150.8 | 178.8 | -168.8 | 0 | 0 | 0 | 0 | 111.5 | M60 L246 F247 | M60-S250 VanDerWaalsContact CA-O 3.32Å; M60-S250 WeakPolarHBondContact CA-O 3.4Å; L246-S250 PolarHBondContact O-N 3.31Å; F247-S250 VanDerWaalsContact O-CB 3.31Å; F247-S250 WeakPolarHBondContact O-CB 3.42Å; F247-S250 PolarHBondContact O-N 3.45Å |
| 251 | G | 88.6 | Confident | 89.5 | Confident | 1 Ų | 1 | 13.2 Ų | 13.2 | 1% | 0.01 | 6% | 0.064 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 115.4 | -16.6 | 178.9 | 0 | 0 | 0 | 0 | 0 | 114.7 | S59 N253 Y254 | S59-G251 PolarHBondContact OG-O 3.35Å; G251-N253 PolarHBondContact O-N 2.83Å; G251-Y254 WeakPolarHBondContact O-CB 3.24Å; G251-Y254 WeakPolarHBondContact O-CD1 3.36Å; G251-Y254 PolarHBondContact O-N 2.95Å |
| 252 | W | 91.7 | Very high | 89.6 | Confident | 1 Ų | 1 | 13.2 Ų | 13.2 | 0% | 0.004 | 6% | 0.064 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -58.7 | -24.9 | 179 | 54.5 | -104.1 | 0 | 0 | 0 | 114.4 | I56 M60 A97 Y100 Y249 Y254 I403 | I56-W252 HydrophobicContact CG2-CB 4.42Å; M60-W252 HydrophobicContact CE-CB 4.49Å; M60-W252 HydrophobicContact CG-CB 4.47Å; M60-W252 HydrophobicContact SD-CB 3.96Å; A97-W252 VanDerWaalsContact CA-CZ3 3.46Å; A97-W252 HydrophobicContact CB-CB 4.19Å; A97-W252 HydrophobicContact CB-CD2 3.79Å; A97-W252 HydrophobicContact CB-CE3 3.44Å; A97-W252 VanDerWaalsContact CB-CE3 3.44Å; A97-W252 HydrophobicContact CB-CG 4.11Å; A97-W252 HydrophobicContact CB-CZ3 4.09Å; Y100-W252 AromaticContact CD1-CZ3 3.9Å; Y100-W252 HydrophobicContact CD1-CZ3 3.9Å; Y100-W252 AromaticContact CD2-CH2 3.74Å; Y100-W252 HydrophobicContact CD2-CH2 3.74Å; Y100-W252 AromaticContact CD2-CZ3 3.57Å; Y100-W252 HydrophobicContact CD2-CZ3 3.57Å; Y100-W252 HydrophobicContact CE1-CZ3 4.24Å; Y100-W252 AromaticContact CE2-CH2 3.7Å; Y100-W252 HydrophobicContact CE2-CH2 3.7Å; Y100-W252 AromaticContact CE2-CZ3 3.94Å; Y100-W252 HydrophobicContact CE2-CZ3 3.94Å; Y100-W252 HydrophobicContact CG-CH2 4.18Å; Y100-W252 AromaticContact CG-CZ3 3.54Å; Y100-W252 HydrophobicContact CG-CZ3 3.54Å; Y249-W252 VanDerWaalsContact O-CD1 3.23Å; W252-Y254 VanDerWaalsContact C-N 3.3Å; W252-Y254 PolarHBondContact O-N 3.46Å; W252-I403 HydrophobicContact CH2-CG2 3.82Å; W252-I403 HydrophobicContact CZ2-CG2 3.9Å |
| 253 | N | 90.6 | Very high | 89.5 | Confident | 1 Ų | 1 | 16.3 Ų | 16.3 | 1% | 0.005 | 8% | 0.081 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -82.1 | -1.2 | 177.3 | 61.8 | -40.9 | 0 | 0 | 0 | 113.9 | Y100 D113 G251 L255 N256 | Y100-N253 HydrophobicContact CD1-CB 3.84Å; Y100-N253 HydrophobicContact CE1-CB 3.71Å; D113-N253 PolarHBondContact OD2-ND2 3.39Å; G251-N253 PolarHBondContact O-N 2.83Å; N253-L255 PolarHBondContact O-N 2.78Å; N253-N256 WeakPolarHBondContact O-CB 3.34Å; N253-N256 PolarHBondContact O-N 2.68Å |
| 254 | Y | 89.5 | Confident | 89.8 | Confident | 14 Ų | 14 | 17.7 Ų | 17.7 | 6% | 0.055 | 9% | 0.091 | C | C | . | . | S | Bend | trans | -70 | -35.6 | -174.5 | -85.6 | 36 | 0 | 0 | 0 | 112 | R138 G251 W252 N256 C257 T337 T340 | R138-Y254 PolarHBondContact NE-OH 3.14Å; G251-Y254 WeakPolarHBondContact O-CB 3.24Å; G251-Y254 WeakPolarHBondContact O-CD1 3.36Å; G251-Y254 PolarHBondContact O-N 2.95Å; W252-Y254 VanDerWaalsContact C-N 3.3Å; W252-Y254 PolarHBondContact O-N 3.46Å; Y254-N256 PolarHBondContact O-N 2.75Å; Y254-C257 VanDerWaalsContact O-CB 3.28Å; Y254-C257 WeakPolarHBondContact O-CB 3.19Å; Y254-C257 PolarHBondContact O-N 3.44Å; Y254-T337 HydrophobicContact CE2-CG2 4.28Å; Y254-T337 WeakPolarHBondContact CE2-OG1 3.34Å; Y254-T340 HydrophobicContact CD2-CG2 3.92Å; Y254-T340 HydrophobicContact CG-CG2 4.1Å; Y254-T340 WeakPolarHBondContact O-CG2 3.39Å |
| 255 | L | 91.1 | Very high | 90 | Very high | 0 Ų | 0 | 16.4 Ų | 16.4 | 0% | 0 | 8% | 0.083 | C | C | . | . | G | 310 helix | trans | -62.2 | -31.2 | 177.4 | -173.3 | 61.6 | 0 | 0 | 0 | 112.2 | I55 I56 N253 C257 M258 M262 L269 A272 | I55-L255 HydrophobicContact CD1-CD1 4.45Å; I55-L255 HydrophobicContact CG2-CD1 4.44Å; I56-L255 HydrophobicContact CD1-CB 4.13Å; I56-L255 HydrophobicContact CD1-CD2 3.68Å; I56-L255 HydrophobicContact CG1-CB 3.87Å; I56-L255 HydrophobicContact CG1-CD2 4.06Å; N253-L255 PolarHBondContact O-N 2.78Å; L255-C257 PolarHBondContact O-N 3.46Å; L255-M258 PolarHBondContact O-N 3.24Å; L255-M262 HydrophobicContact CD1-CE 4.38Å; L255-M262 HydrophobicContact CD1-CG 4.42Å; L255-M262 HydrophobicContact CD1-SD 4.03Å; L255-M262 HydrophobicContact CD2-CE 3.99Å; L255-M262 HydrophobicContact CD2-SD 4.31Å; L255-M262 HydrophobicContact CG-CE 4.3Å; L255-M262 HydrophobicContact CG-SD 3.98Å; L255-L269 HydrophobicContact CB-CD1 4.38Å; L255-L269 HydrophobicContact CD2-CD1 3.56Å; L255-L269 HydrophobicContact CG-CD1 3.89Å; L255-A272 HydrophobicContact CD2-CB 4Å |
| 256 | N | 92.9 | Very high | 90 | Very high | 0 Ų | 0 | 24.6 Ų | 24.6 | 0% | 0 | 11% | 0.114 | C | C | . | . | G | 310 helix | trans | -62 | -24.4 | 174.4 | -71.7 | 77.5 | 0 | 0 | 0 | 113.4 | Y100 Y116 N253 Y254 M258 | Y100-N256 HydrophobicContact CD1-CB 4.43Å; Y100-N256 PolarHBondContact O-ND2 3.45Å; Y116-N256 HydrophobicContact CE2-CB 4.46Å; Y116-N256 WeakPolarHBondContact OH-CB 3.19Å; Y116-N256 PolarHBondContact OH-ND2 3.24Å; N253-N256 WeakPolarHBondContact O-CB 3.34Å; N253-N256 PolarHBondContact O-N 2.68Å; Y254-N256 PolarHBondContact O-N 2.75Å; N256-M258 PolarHBondContact O-N 2.89Å |
| 257 | C | 89.4 | Confident | 90.2 | Very high | 0 Ų | 0 | 32.1 Ų | 32.1 | 0% | 0 | 14% | 0.143 | C | C | . | . | G | 310 helix | trans | -78.5 | -0.2 | 175.2 | -53.3 | 0 | 0 | 0 | 0 | 112.7 | S110 Y254 L255 T340 R343 M344 | S110-C257 WeakPolarHBondContact CB-O 3.47Å; S110-C257 CarbonylContact O-C 3.54Å; S110-C257 WeakPolarHBondContact O-CA 3.38Å; Y254-C257 VanDerWaalsContact O-CB 3.28Å; Y254-C257 WeakPolarHBondContact O-CB 3.19Å; Y254-C257 PolarHBondContact O-N 3.44Å; L255-C257 PolarHBondContact O-N 3.46Å; C257-T340 HydrophobicContact CB-CG2 4.25Å; C257-R343 WeakPolarHBondContact O-CB 3.46Å; C257-M344 HydrophobicContact CB-CG 4.25Å |
| 258 | M | 87.2 | Confident | 90.6 | Very high | 0 Ų | 0 | 28.1 Ų | 28.1 | 0% | 0 | 13% | 0.126 | C | C | . | . | G | 310 helix | trans | -133.7 | 20.8 | -175.7 | -61.3 | -170.4 | 75.9 | 0 | 0 | 112.2 | I47 I55 L255 N256 E260 E261 M339 T340 | I47-M258 HydrophobicContact CD1-CB 4.13Å; I47-M258 HydrophobicContact CD1-CE 3.56Å; I47-M258 HydrophobicContact CD1-SD 4.26Å; I55-M258 HydrophobicContact CD1-SD 4.48Å; L255-M258 PolarHBondContact O-N 3.24Å; N256-M258 PolarHBondContact O-N 2.89Å; M258-E260 VanDerWaalsContact C-N 3.26Å; M258-E260 PolarHBondContact O-N 2.8Å; M258-E261 WeakPolarHBondContact CE-OE2 3.32Å; M258-E261 PolarHBondContact O-N 3.03Å; M258-M339 HydrophobicContact CE-CE 3.96Å; M258-M339 HydrophobicContact CE-CG 3.47Å; M258-M339 VanDerWaalsContact CE-CG 3.47Å; M258-M339 HydrophobicContact CE-SD 3.49Å; M258-M339 WeakPolarHBondContact CE-SD 3.46Å; M258-M339 HydrophobicContact SD-CE 3.57Å; M258-M339 VanDerWaalsContact SD-CE 3.57Å; M258-M339 HydrophobicContact SD-CG 3.73Å; M258-M339 HydrophobicContact SD-SD 3.91Å; M258-T340 HydrophobicContact CG-CG2 4.19Å; M258-T340 HydrophobicContact SD-CG2 4.07Å |
| 259 | I | 90 | Very high | 90.8 | Very high | 0 Ų | 0 | 28 Ų | 28 | 0% | 0 | 13% | 0.125 | C | C | . | . | G | 310 helix | trans | -64.2 | -29.4 | -170.2 | -158.5 | 156.6 | 0 | 0 | 0 | 113.4 | G104 H108 E261 M262 P265 L269 | G104-I259 VanDerWaalsContact CA-CD1 3.47Å; G104-I259 WeakPolarHBondContact O-CD1 3.39Å; H108-I259 PolarHBondContact CE1-O 3.15Å; H108-I259 VanDerWaalsContact CE1-O 3.28Å; I259-E261 VanDerWaalsContact C-N 3.3Å; I259-M262 HydrophobicContact CG1-SD 4.11Å; I259-M262 WeakPolarHBondContact O-CB 3.32Å; I259-M262 PolarHBondContact O-N 3.46Å; I259-P265 HydrophobicContact CD1-CB 4.3Å; I259-P265 HydrophobicContact CG1-CB 3.76Å; I259-L269 HydrophobicContact CD1-CD2 3.63Å |
| 260 | E | 88.2 | Confident | 90.9 | Very high | 45 Ų | 45 | 28.9 Ų | 28.9 | 21% | 0.21 | 13% | 0.13 | C | C | . | . | G | 310 helix | trans | -73.6 | -23.4 | 178.1 | -63.5 | 166.4 | 137 | 0 | 0 | 112.3 | K45 S110 M258 M262 | K45-E260 WeakPolarHBondContact CG-O 3.05Å; S110-E260 WeakPolarHBondContact CB-OE2 3.32Å; S110-E260 PolarHBondContact N-OE2 3.29Å; S110-E260 VanDerWaalsContact N-OE2 3.07Å; S110-E260 VanDerWaalsContact OG-CB 3.24Å; S110-E260 WeakPolarHBondContact OG-CB 3.24Å; S110-E260 VanDerWaalsContact OG-CG 3.3Å; S110-E260 WeakPolarHBondContact OG-CG 3.44Å; S110-E260 PolarHBondContact OG-N 3.43Å; S110-E260 PolarHBondContact OG-OE2 3.2Å; M258-E260 VanDerWaalsContact C-N 3.26Å; M258-E260 PolarHBondContact O-N 2.8Å; E260-M262 VanDerWaalsContact C-N 3.32Å |
| 261 | E | 88.2 | Confident | 91.3 | Very high | 1 Ų | 1 | 31.1 Ų | 31.1 | 1% | 0.005 | 14% | 0.141 | C | C | . | . | G | 310 helix | trans | -85 | -6.1 | 176.2 | -66.7 | -179.1 | -152.6 | 0 | 0 | 112.4 | L43 K45 T46 I47 V187 M258 I259 R343 | L43-E261 HydrophobicContact CB-CG 3.89Å; L43-E261 HydrophobicContact CD1-CG 4.26Å; K45-E261 CarbonylContact C-O 3.26Å; K45-E261 WeakPolarHBondContact CA-O 3.38Å; T46-E261 PolarHBondContact N-O 2.99Å; I47-E261 HydrophobicContact CD1-CB 3.76Å; I47-E261 HydrophobicContact CG1-CB 4.19Å; I47-E261 PolarHBondContact N-O 2.91Å; V187-E261 WeakPolarHBondContact CG1-OE2 3.43Å; M258-E261 WeakPolarHBondContact CE-OE2 3.32Å; M258-E261 PolarHBondContact O-N 3.03Å; I259-E261 VanDerWaalsContact C-N 3.3Å; E261-R343 IonicContact OE1-CZ 3.6Å; E261-R343 IonicContact OE1-NE 3.14Å; E261-R343 PolarHBondContact OE1-NE 3.22Å; E261-R343 IonicContact OE1-NH2 3.45Å; E261-R343 PolarHBondContact OE1-NH2 3.5Å; E261-R343 VanDerWaalsContact OE1-NH2 3.14Å; E261-R343 IonicContact OE2-NH2 3.44Å; E261-R343 PolarHBondContact OE2-NH2 2.93Å |
| 262 | M | 91.4 | Very high | 91.7 | Very high | 0 Ų | 0 | 31 Ų | 31 | 0% | 0 | 14% | 0.14 | C | C | . | . | B | Isolated β-bridge | trans | -78.4 | 138 | 177 | -62.7 | 179.8 | 73 | 0 | 0 | 112.2 | K45 I47 L255 I259 E260 P265 D268 L269 | K45-M262 WeakPolarHBondContact CD-O 3.43Å; I47-M262 HydrophobicContact CB-CG 4.49Å; I47-M262 WeakPolarHBondContact O-CA 3.34Å; L255-M262 HydrophobicContact CD1-CE 4.38Å; L255-M262 HydrophobicContact CD1-CG 4.42Å; L255-M262 HydrophobicContact CD1-SD 4.03Å; L255-M262 HydrophobicContact CD2-CE 3.99Å; L255-M262 HydrophobicContact CD2-SD 4.31Å; L255-M262 HydrophobicContact CG-CE 4.3Å; L255-M262 HydrophobicContact CG-SD 3.98Å; I259-M262 HydrophobicContact CG1-SD 4.11Å; I259-M262 WeakPolarHBondContact O-CB 3.32Å; I259-M262 PolarHBondContact O-N 3.46Å; E260-M262 VanDerWaalsContact C-N 3.32Å; M262-P265 HydrophobicContact CB-CB 4.25Å; M262-P265 HydrophobicContact SD-CB 4.21Å; M262-D268 HydrophobicContact CE-CB 3.98Å; M262-L269 HydrophobicContact CE-CB 4Å; M262-L269 HydrophobicContact SD-CD1 4.46Å |
| 263 | N | 90.3 | Very high | 91.8 | Very high | 84 Ų | 84 | 31 Ų | 31 | 45% | 0.449 | 14% | 0.14 | S | C | . | . | S | Bend | trans | -66.1 | -51.9 | 177.7 | -67.5 | -26.4 | 0 | 0 | 0 | 111.6 | K45 I47 | K45-N263 PolarHBondContact O-OD1 3.5Å; I47-N263 PolarHBondContact O-N 3.26Å; I47-N263 PolarHBondContact O-ND2 3Å |
| 264 | N | 92 | Very high | 92.1 | Very high | 68 Ų | 68 | 34 Ų | 34 | 36% | 0.364 | 16% | 0.155 | S | C | . | . | trans | -135.2 | 78.1 | 179.3 | -170.8 | -2.5 | 0 | 0 | 0 | 112 | R266 R267 D268 | N264-R266 PolarHBondContact O-N 3.43Å; N264-R266 VanDerWaalsContact O-N 3.15Å; N264-R267 PolarHBondContact O-N 3.09Å; N264-D268 VanDerWaalsContact O-CB 3.27Å; N264-D268 WeakPolarHBondContact O-CB 3.48Å; N264-D268 VanDerWaalsContact O-CG 3.32Å; N264-D268 PolarHBondContact O-N 3.46Å | ||
| 265 | P | 92.1 | Very high | 92.4 | Very high | 13 Ų | 13 | 36.8 Ų | 36.8 | 8% | 0.084 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -61.7 | -26.6 | -177 | 27 | -37.4 | 0 | 0 | 0 | 113.2 | I259 M262 R267 L269 | I259-P265 HydrophobicContact CD1-CB 4.3Å; I259-P265 HydrophobicContact CG1-CB 3.76Å; M262-P265 HydrophobicContact CB-CB 4.25Å; M262-P265 HydrophobicContact SD-CB 4.21Å; P265-R267 VanDerWaalsContact C-N 3.32Å; P265-R267 PolarHBondContact O-N 2.76Å; P265-L269 WeakPolarHBondContact O-CB 3.47Å; P265-L269 PolarHBondContact O-N 2.78Å |
| 266 | R | 92.2 | Very high | 92.6 | Very high | 173 Ų | 173 | 36.8 Ų | 36.8 | 65% | 0.653 | 17% | 0.17 | S | C | * | . | H | α-helix | trans | -65.4 | -36.4 | -179.6 | -62.3 | -175.8 | 176.1 | -178.7 | 1.6 | 112.4 | N264 P270 P423 | N264-R266 PolarHBondContact O-N 3.43Å; N264-R266 VanDerWaalsContact O-N 3.15Å; R266-P270 WeakPolarHBondContact O-CG 3.34Å; R266-P423 HydrophobicContact CB-CB 4.36Å; R266-P423 HydrophobicContact CG-CB 3.69Å; R266-P423 HydrophobicContact CG-CG 4.39Å |
| 267 | R | 93.4 | Very high | 92.8 | Very high | 157 Ų | 157 | 36.9 Ų | 36.9 | 59% | 0.592 | 17% | 0.171 | S | C | * | . | H | α-helix | trans | -96.9 | -47.4 | 179.7 | -178.5 | -169.3 | 176.1 | -164 | -0.2 | 111.4 | N264 P265 P270 L271 | N264-R267 PolarHBondContact O-N 3.09Å; P265-R267 VanDerWaalsContact C-N 3.32Å; P265-R267 PolarHBondContact O-N 2.76Å; R267-P270 WeakPolarHBondContact O-CD 3.38Å; R267-P270 WeakPolarHBondContact O-CG 3.19Å; R267-L271 HydrophobicContact CG-CD1 3.83Å; R267-L271 VanDerWaalsContact O-CG 3.31Å; R267-L271 WeakPolarHBondContact O-CG 3.36Å; R267-L271 PolarHBondContact O-N 2.78Å |
| 268 | D | 94.8 | Very high | 93.1 | Very high | 13 Ų | 13 | 41.3 Ų | 41.3 | 7% | 0.07 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -77.9 | -33.4 | -165.3 | -61.3 | -11 | 0 | 0 | 0 | 111.7 | L49 M262 N264 A272 | L49-D268 HydrophobicContact CB-CB 4.28Å; L49-D268 HydrophobicContact CD1-CB 4.13Å; M262-D268 HydrophobicContact CE-CB 3.98Å; N264-D268 VanDerWaalsContact O-CB 3.27Å; N264-D268 WeakPolarHBondContact O-CB 3.48Å; N264-D268 VanDerWaalsContact O-CG 3.32Å; N264-D268 PolarHBondContact O-N 3.46Å; D268-A272 WeakPolarHBondContact O-CB 3.43Å; D268-A272 PolarHBondContact O-N 2.72Å |
| 269 | L | 93.8 | Very high | 93.6 | Very high | 0 Ų | 0 | 44.3 Ų | 44.3 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -62.6 | -55.1 | 178.8 | -175 | 59 | 0 | 0 | 0 | 113.1 | A101 T105 L255 I259 M262 P265 L271 A272 I273 | A101-L269 HydrophobicContact CB-CD2 4.27Å; A101-L269 HydrophobicContact CB-CG 4.17Å; T105-L269 HydrophobicContact CG2-CD2 4.13Å; L255-L269 HydrophobicContact CB-CD1 4.38Å; L255-L269 HydrophobicContact CD2-CD1 3.56Å; L255-L269 HydrophobicContact CG-CD1 3.89Å; I259-L269 HydrophobicContact CD1-CD2 3.63Å; M262-L269 HydrophobicContact CE-CB 4Å; M262-L269 HydrophobicContact SD-CD1 4.46Å; P265-L269 WeakPolarHBondContact O-CB 3.47Å; P265-L269 PolarHBondContact O-N 2.78Å; L269-L271 VanDerWaalsContact C-N 3.32Å; L269-L271 PolarHBondContact O-N 3.19Å; L269-A272 PolarHBondContact O-N 2.91Å; L269-I273 HydrophobicContact CD1-CD1 3.81Å; L269-I273 HydrophobicContact CD1-CG1 4.41Å; L269-I273 HydrophobicContact CG-CD1 3.93Å; L269-I273 WeakPolarHBondContact O-CD1 2.98Å; L269-I273 WeakPolarHBondContact O-CG1 3.31Å; L269-I273 PolarHBondContact O-N 3.33Å |
| 270 | P | 94.8 | Very high | 93.9 | Very high | 17 Ų | 17 | 44.3 Ų | 44.3 | 11% | 0.11 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -64.5 | -36.5 | 179.9 | 25.1 | -34.6 | 0 | 0 | 0 | 112.4 | Y98 R266 R267 I273 I274 V424 | Y98-P270 HydrophobicContact CE2-CB 4.04Å; R266-P270 WeakPolarHBondContact O-CG 3.34Å; R267-P270 WeakPolarHBondContact O-CD 3.38Å; R267-P270 WeakPolarHBondContact O-CG 3.19Å; P270-I273 PolarHBondContact O-N 3.46Å; P270-I274 WeakPolarHBondContact O-CG1 3.34Å; P270-I274 PolarHBondContact O-N 2.83Å; P270-I274 VanDerWaalsContact O-N 3.07Å; P270-V424 HydrophobicContact CB-CG1 4.45Å; P270-V424 HydrophobicContact CG-CG2 3.99Å |
| 271 | L | 95.8 | Very high | 94.3 | Very high | 65 Ų | 65 | 43 Ų | 43 | 34% | 0.34 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -66.2 | -46 | 176.5 | -70.9 | 176.8 | 0 | 0 | 0 | 111.7 | L49 R267 L269 I273 I274 I275 | L49-L271 HydrophobicContact CD1-CB 3.91Å; L49-L271 HydrophobicContact CD2-CD1 4.33Å; R267-L271 HydrophobicContact CG-CD1 3.83Å; R267-L271 VanDerWaalsContact O-CG 3.31Å; R267-L271 WeakPolarHBondContact O-CG 3.36Å; R267-L271 PolarHBondContact O-N 2.78Å; L269-L271 VanDerWaalsContact C-N 3.32Å; L269-L271 PolarHBondContact O-N 3.19Å; L271-I273 VanDerWaalsContact C-N 3.3Å; L271-I273 PolarHBondContact O-N 2.96Å; L271-I274 PolarHBondContact O-N 3.15Å; L271-I275 WeakPolarHBondContact O-CB 3.39Å; L271-I275 WeakPolarHBondContact O-CD1 3.44Å; L271-I275 VanDerWaalsContact O-CG1 3.25Å; L271-I275 WeakPolarHBondContact O-CG1 3.5Å; L271-I275 PolarHBondContact O-N 3.29Å |
| 272 | A | 96 | Very high | 94.8 | Very high | 0 Ų | 0 | 48.7 Ų | 48.7 | 0% | 0 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -60.7 | -42.2 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | L49 I53 I56 L255 D268 L269 S276 | L49-A272 HydrophobicContact CD1-CB 4.3Å; I53-A272 HydrophobicContact CG1-CB 4.02Å; I56-A272 HydrophobicContact CD1-CB 3.93Å; L255-A272 HydrophobicContact CD2-CB 4Å; D268-A272 WeakPolarHBondContact O-CB 3.43Å; D268-A272 PolarHBondContact O-N 2.72Å; L269-A272 PolarHBondContact O-N 2.91Å; A272-S276 WeakPolarHBondContact O-CB 3.37Å; A272-S276 PolarHBondContact O-N 2.82Å; A272-S276 PolarHBondContact O-OG 3.2Å |
| 273 | I | 95 | Very high | 95 | Very high | 1 Ų | 1 | 48.9 Ų | 48.9 | 1% | 0.005 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -61 | -52.7 | 177.1 | -74.7 | 162.4 | 0 | 0 | 0 | 111.6 | I56 A97 A101 L269 P270 L271 C277 | I56-I273 HydrophobicContact CD1-CG1 3.88Å; A97-I273 HydrophobicContact CB-CB 4.42Å; A97-I273 HydrophobicContact CB-CD1 4.46Å; A97-I273 HydrophobicContact CB-CG1 4.26Å; A97-I273 HydrophobicContact CB-CG2 3.36Å; A97-I273 WeakPolarHBondContact O-CD1 3.24Å; A101-I273 HydrophobicContact CB-CD1 3.63Å; L269-I273 HydrophobicContact CD1-CD1 3.81Å; L269-I273 HydrophobicContact CD1-CG1 4.41Å; L269-I273 HydrophobicContact CG-CD1 3.93Å; L269-I273 WeakPolarHBondContact O-CD1 2.98Å; L269-I273 WeakPolarHBondContact O-CG1 3.31Å; L269-I273 PolarHBondContact O-N 3.33Å; P270-I273 PolarHBondContact O-N 3.46Å; L271-I273 VanDerWaalsContact C-N 3.3Å; L271-I273 PolarHBondContact O-N 2.96Å; I273-C277 VanDerWaalsContact O-CB 3.26Å; I273-C277 WeakPolarHBondContact O-CB 3.37Å; I273-C277 PolarHBondContact O-N 3.02Å; I273-C277 PolarHBondContact O-SG 2.83Å |
| 274 | I | 95.5 | Very high | 95.3 | Very high | 62 Ų | 62 | 44.9 Ų | 44.9 | 32% | 0.318 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -63.8 | -49.4 | -176.3 | -68.6 | 167.7 | 0 | 0 | 0 | 110.7 | Y98 P270 L271 S276 L278 | Y98-I274 HydrophobicContact CD2-CD1 4.29Å; Y98-I274 HydrophobicContact CD2-CG1 4.31Å; Y98-I274 HydrophobicContact CE2-CD1 3.87Å; Y98-I274 HydrophobicContact CE2-CG1 4.37Å; P270-I274 WeakPolarHBondContact O-CG1 3.34Å; P270-I274 PolarHBondContact O-N 2.83Å; P270-I274 VanDerWaalsContact O-N 3.07Å; L271-I274 PolarHBondContact O-N 3.15Å; I274-S276 PolarHBondContact O-N 3.32Å; I274-L278 HydrophobicContact CG2-CD1 3.78Å; I274-L278 HydrophobicContact CG2-CG 4.44Å; I274-L278 WeakPolarHBondContact O-CB 3.49Å; I274-L278 VanDerWaalsContact O-CG 3.3Å; I274-L278 WeakPolarHBondContact O-CG 3.44Å; I274-L278 PolarHBondContact O-N 3.3Å |
| 275 | I | 96.8 | Very high | 95.5 | Very high | 74 Ų | 74 | 42.5 Ų | 42.5 | 38% | 0.379 | 20% | 0.197 | S | C | . | . | H | α-helix | trans | -61.1 | -48.7 | -178.3 | -67 | 167.3 | 0 | 0 | 0 | 109.9 | I53 L271 L279 | I53-I275 HydrophobicContact CD1-CB 4.45Å; I53-I275 HydrophobicContact CD1-CD1 3.94Å; I53-I275 HydrophobicContact CD1-CG2 4.15Å; I53-I275 HydrophobicContact CG1-CG2 4.44Å; I53-I275 HydrophobicContact CG2-CG2 4.3Å; L271-I275 WeakPolarHBondContact O-CB 3.39Å; L271-I275 WeakPolarHBondContact O-CD1 3.44Å; L271-I275 VanDerWaalsContact O-CG1 3.25Å; L271-I275 WeakPolarHBondContact O-CG1 3.5Å; L271-I275 PolarHBondContact O-N 3.29Å; I275-L279 WeakPolarHBondContact O-CB 3.31Å; I275-L279 PolarHBondContact O-N 2.85Å |
| 276 | S | 95.9 | Very high | 95.7 | Very high | 0 Ų | 0 | 43.9 Ų | 43.9 | 0% | 0 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -68.5 | -43.7 | -176.7 | -60.6 | 0 | 0 | 0 | 0 | 112.5 | I53 V57 A272 I274 L279 V280 | I53-S276 PolarHBondContact O-OG 3.07Å; V57-S276 WeakPolarHBondContact CG2-OG 3.21Å; A272-S276 WeakPolarHBondContact O-CB 3.37Å; A272-S276 PolarHBondContact O-N 2.82Å; A272-S276 PolarHBondContact O-OG 3.2Å; I274-S276 PolarHBondContact O-N 3.32Å; S276-L279 PolarHBondContact O-N 3.16Å; S276-V280 WeakPolarHBondContact O-CB 3.24Å; S276-V280 WeakPolarHBondContact O-CG2 3.34Å; S276-V280 PolarHBondContact O-N 3Å |
| 277 | C | 95.9 | Very high | 95.9 | Very high | 2 Ų | 2 | 35.6 Ų | 35.6 | 1% | 0.014 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -62.7 | -47.5 | 177.8 | -71 | 0 | 0 | 0 | 0 | 111.3 | M94 I273 L279 V280 T281 | M94-C277 HydrophobicContact CB-CB 3.87Å; M94-C277 HydrophobicContact CG-CB 4.01Å; I273-C277 VanDerWaalsContact O-CB 3.26Å; I273-C277 WeakPolarHBondContact O-CB 3.37Å; I273-C277 PolarHBondContact O-N 3.02Å; I273-C277 PolarHBondContact O-SG 2.83Å; C277-L279 PolarHBondContact O-N 2.95Å; C277-V280 PolarHBondContact O-N 3.49Å; C277-T281 WeakPolarHBondContact O-CB 3.19Å; C277-T281 PolarHBondContact O-N 3.28Å; C277-T281 PolarHBondContact O-OG1 3.27Å |
| 278 | L | 96.8 | Very high | 96 | Very high | 93 Ų | 93 | 28.6 Ų | 28.6 | 49% | 0.487 | 15% | 0.146 | S | C | . | . | H | α-helix | trans | -63.4 | -42.9 | 178.4 | -70 | 176.4 | 0 | 0 | 0 | 112.2 | M94 I274 T281 F282 | M94-L278 HydrophobicContact SD-CD2 4.03Å; M94-L278 HydrophobicContact SD-CG 4.2Å; I274-L278 HydrophobicContact CG2-CD1 3.78Å; I274-L278 HydrophobicContact CG2-CG 4.44Å; I274-L278 WeakPolarHBondContact O-CB 3.49Å; I274-L278 VanDerWaalsContact O-CG 3.3Å; I274-L278 WeakPolarHBondContact O-CG 3.44Å; I274-L278 PolarHBondContact O-N 3.3Å; L278-T281 PolarHBondContact O-N 3.21Å; L278-F282 WeakPolarHBondContact O-CB 3.31Å; L278-F282 PolarHBondContact O-N 3.45Å |
| 279 | L | 96.2 | Very high | 96 | Very high | 63 Ų | 63 | 29.1 Ų | 29.1 | 33% | 0.33 | 15% | 0.15 | S | C | . | . | H | α-helix | trans | -61.9 | -48.6 | 177.6 | 179 | 64.2 | 0 | 0 | 0 | 111.3 | V57 I275 S276 C277 F282 I283 | V57-L279 HydrophobicContact CG2-CD2 4.09Å; I275-L279 WeakPolarHBondContact O-CB 3.31Å; I275-L279 PolarHBondContact O-N 2.85Å; S276-L279 PolarHBondContact O-N 3.16Å; C277-L279 PolarHBondContact O-N 2.95Å; L279-F282 PolarHBondContact O-N 2.88Å; L279-I283 HydrophobicContact CD1-CD1 3.78Å; L279-I283 HydrophobicContact CD1-CG1 4.18Å; L279-I283 HydrophobicContact CD2-CD1 4.47Å; L279-I283 HydrophobicContact CG-CD1 3.77Å; L279-I283 HydrophobicContact CG-CG1 4.47Å; L279-I283 WeakPolarHBondContact O-CB 3.17Å; L279-I283 VanDerWaalsContact O-CG1 3.24Å; L279-I283 WeakPolarHBondContact O-CG1 3.34Å; L279-I283 PolarHBondContact O-N 3.44Å |
| 280 | V | 96.6 | Very high | 96 | Very high | 0 Ų | 0 | 29.2 Ų | 29.2 | 0% | 0 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -65 | -41.8 | 179.9 | 174.3 | 0 | 0 | 0 | 0 | 110.6 | V57 M60 I61 Y249 S276 C277 F282 I283 Y284 | V57-V280 HydrophobicContact CG1-CG2 4.27Å; V57-V280 HydrophobicContact CG2-CG2 4.32Å; M60-V280 HydrophobicContact CB-CG1 4.28Å; M60-V280 HydrophobicContact CB-CG2 4.23Å; M60-V280 HydrophobicContact CE-CB 4.11Å; M60-V280 HydrophobicContact CE-CG1 3.9Å; M60-V280 HydrophobicContact CE-CG2 4.41Å; M60-V280 HydrophobicContact SD-CB 4.48Å; M60-V280 HydrophobicContact SD-CG2 4.15Å; I61-V280 HydrophobicContact CD1-CG2 4.24Å; I61-V280 HydrophobicContact CG1-CG1 4.46Å; I61-V280 HydrophobicContact CG1-CG2 4.03Å; Y249-V280 HydrophobicContact CD1-CG1 4.06Å; Y249-V280 HydrophobicContact CE1-CG1 3.93Å; S276-V280 WeakPolarHBondContact O-CB 3.24Å; S276-V280 WeakPolarHBondContact O-CG2 3.34Å; S276-V280 PolarHBondContact O-N 3Å; C277-V280 PolarHBondContact O-N 3.49Å; V280-F282 PolarHBondContact O-N 3Å; V280-I283 PolarHBondContact O-N 3.46Å; V280-Y284 HydrophobicContact CG1-CD1 4Å; V280-Y284 HydrophobicContact CG1-CD2 3.71Å; V280-Y284 HydrophobicContact CG1-CE1 3.78Å; V280-Y284 HydrophobicContact CG1-CE2 3.47Å; V280-Y284 VanDerWaalsContact CG1-CE2 3.47Å; V280-Y284 HydrophobicContact CG1-CG 3.99Å; V280-Y284 VanDerWaalsContact O-CB 3.27Å; V280-Y284 WeakPolarHBondContact O-CB 3.36Å; V280-Y284 VanDerWaalsContact O-CG 3.25Å; V280-Y284 PolarHBondContact O-N 3.4Å |
| 281 | T | 97.3 | Very high | 96 | Very high | 16 Ų | 16 | 28.5 Ų | 28.5 | 10% | 0.098 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -59.2 | -48.4 | 175 | -60.7 | 0 | 0 | 0 | 0 | 111.8 | G90 Y249 C277 L278 Y284 T285 | G90-T281 WeakPolarHBondContact CA-OG1 3.27Å; Y249-T281 WeakPolarHBondContact CE1-OG1 3.32Å; Y249-T281 WeakPolarHBondContact OH-CA 3.31Å; C277-T281 WeakPolarHBondContact O-CB 3.19Å; C277-T281 PolarHBondContact O-N 3.28Å; C277-T281 PolarHBondContact O-OG1 3.27Å; L278-T281 PolarHBondContact O-N 3.21Å; T281-Y284 PolarHBondContact O-N 2.88Å; T281-T285 WeakPolarHBondContact O-CB 3.43Å; T281-T285 PolarHBondContact O-N 3.07Å; T281-T285 PolarHBondContact O-OG1 2.91Å |
| 282 | F | 97.3 | Very high | 95.8 | Very high | 122 Ų | 122 | 26.2 Ų | 26.2 | 54% | 0.535 | 13% | 0.134 | S | C | . | . | H | α-helix | trans | -59.1 | -50.5 | 176.5 | 177.1 | -99 | 0 | 0 | 0 | 111.7 | L278 L279 V280 Y284 T285 M286 | L278-F282 WeakPolarHBondContact O-CB 3.31Å; L278-F282 PolarHBondContact O-N 3.45Å; L279-F282 PolarHBondContact O-N 2.88Å; V280-F282 PolarHBondContact O-N 3Å; F282-Y284 VanDerWaalsContact C-N 3.35Å; F282-Y284 PolarHBondContact O-N 3.31Å; F282-T285 PolarHBondContact O-N 3.18Å; F282-M286 HydrophobicContact CD1-CG 4.34Å; F282-M286 HydrophobicContact CD2-CG 4.03Å; F282-M286 HydrophobicContact CE1-CG 4.01Å; F282-M286 HydrophobicContact CE2-CG 3.68Å; F282-M286 HydrophobicContact CE2-SD 4.18Å; F282-M286 HydrophobicContact CG-CG 4.35Å; F282-M286 HydrophobicContact CZ-CG 3.67Å; F282-M286 HydrophobicContact CZ-SD 4.41Å; F282-M286 WeakPolarHBondContact O-CB 3.3Å; F282-M286 WeakPolarHBondContact O-CG 3.45Å; F282-M286 PolarHBondContact O-N 3.33Å |
| 283 | I | 96.4 | Very high | 95.7 | Very high | 4 Ų | 4 | 26.7 Ų | 26.7 | 2% | 0.021 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -60 | -45.5 | -179.6 | -70.9 | 173.1 | 0 | 0 | 0 | 110.9 | I61 V202 L205 I209 L279 V280 M286 A287 | I61-I283 HydrophobicContact CD1-CD1 4.37Å; V202-I283 HydrophobicContact CG1-CD1 4.13Å; V202-I283 HydrophobicContact CG2-CD1 4.46Å; L205-I283 HydrophobicContact CB-CG2 3.62Å; L205-I283 HydrophobicContact CD1-CG2 3.46Å; L205-I283 VanDerWaalsContact CD1-CG2 3.46Å; L205-I283 HydrophobicContact CG-CG2 4.09Å; I209-I283 HydrophobicContact CD1-CB 4.48Å; I209-I283 HydrophobicContact CD1-CG2 4.17Å; L279-I283 HydrophobicContact CD1-CD1 3.78Å; L279-I283 HydrophobicContact CD1-CG1 4.18Å; L279-I283 HydrophobicContact CD2-CD1 4.47Å; L279-I283 HydrophobicContact CG-CD1 3.77Å; L279-I283 HydrophobicContact CG-CG1 4.47Å; L279-I283 WeakPolarHBondContact O-CB 3.17Å; L279-I283 VanDerWaalsContact O-CG1 3.24Å; L279-I283 WeakPolarHBondContact O-CG1 3.34Å; L279-I283 PolarHBondContact O-N 3.44Å; V280-I283 PolarHBondContact O-N 3.46Å; I283-M286 PolarHBondContact O-N 3.2Å; I283-A287 WeakPolarHBondContact O-CB 3.42Å; I283-A287 PolarHBondContact O-N 3.21Å |
| 284 | Y | 96.6 | Very high | 95.6 | Very high | 0 Ų | 0 | 28 Ų | 28 | 0% | 0 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -66.3 | -46.6 | -178.1 | -75.8 | 3 | 0 | 0 | 0 | 112 | M60 I61 I65 W86 A248 Y249 V280 T281 F282 A287 N288 | M60-Y284 VanDerWaalsContact C-OH 3.32Å; M60-Y284 PolarHBondContact O-OH 3.2Å; I61-Y284 WeakPolarHBondContact CA-OH 3.34Å; I61-Y284 HydrophobicContact CG1-CE1 3.96Å; I65-Y284 HydrophobicContact CB-CD1 3.9Å; I65-Y284 HydrophobicContact CB-CE1 3.51Å; I65-Y284 HydrophobicContact CD1-CD1 3.55Å; I65-Y284 HydrophobicContact CD1-CD2 4.34Å; I65-Y284 HydrophobicContact CD1-CE1 4.1Å; I65-Y284 HydrophobicContact CD1-CG 3.66Å; I65-Y284 HydrophobicContact CG1-CD1 3.55Å; I65-Y284 HydrophobicContact CG1-CE1 3.71Å; I65-Y284 HydrophobicContact CG1-CG 4.19Å; I65-Y284 HydrophobicContact CG2-CE1 4.01Å; W86-Y284 AromaticContact CE3-CD2 3.8Å; W86-Y284 HydrophobicContact CE3-CD2 3.8Å; W86-Y284 HydrophobicContact CE3-CG 4.22Å; W86-Y284 HydrophobicContact CH2-CD2 4.4Å; W86-Y284 AromaticContact CZ3-CD2 3.37Å; W86-Y284 HydrophobicContact CZ3-CD2 3.37Å; W86-Y284 AromaticContact CZ3-CE2 3.96Å; W86-Y284 HydrophobicContact CZ3-CE2 3.96Å; W86-Y284 AromaticContact CZ3-CG 3.96Å; W86-Y284 HydrophobicContact CZ3-CG 3.96Å; A248-Y284 HydrophobicContact CB-CE2 4.14Å; A248-Y284 VanDerWaalsContact O-CE2 3.28Å; A248-Y284 WeakPolarHBondContact O-CE2 3.38Å; A248-Y284 PolarHBondContact O-OH 2.95Å; Y249-Y284 HydrophobicContact CD1-CD2 4.12Å; Y249-Y284 HydrophobicContact CD1-CE2 4.16Å; Y249-Y284 HydrophobicContact CD2-CD2 4.31Å; Y249-Y284 HydrophobicContact CD2-CE2 4.5Å; Y249-Y284 AromaticContact CE1-CD2 3.66Å; Y249-Y284 HydrophobicContact CE1-CD2 3.66Å; Y249-Y284 HydrophobicContact CE1-CE2 4.15Å; Y249-Y284 AromaticContact CE2-CD2 3.91Å; Y249-Y284 HydrophobicContact CE2-CD2 3.91Å; Y249-Y284 HydrophobicContact CG-CD2 4.43Å; Y249-Y284 HydrophobicContact CG-CE2 4.34Å; Y249-Y284 AromaticContact CZ-CD2 3.57Å; V280-Y284 HydrophobicContact CG1-CD1 4Å; V280-Y284 HydrophobicContact CG1-CD2 3.71Å; V280-Y284 HydrophobicContact CG1-CE1 3.78Å; V280-Y284 HydrophobicContact CG1-CE2 3.47Å; V280-Y284 VanDerWaalsContact CG1-CE2 3.47Å; V280-Y284 HydrophobicContact CG1-CG 3.99Å; V280-Y284 VanDerWaalsContact O-CB 3.27Å; V280-Y284 WeakPolarHBondContact O-CB 3.36Å; V280-Y284 VanDerWaalsContact O-CG 3.25Å; V280-Y284 PolarHBondContact O-N 3.4Å; T281-Y284 PolarHBondContact O-N 2.88Å; F282-Y284 VanDerWaalsContact C-N 3.35Å; F282-Y284 PolarHBondContact O-N 3.31Å; Y284-A287 PolarHBondContact O-N 3.42Å; Y284-N288 PolarHBondContact O-N 2.83Å; Y284-N288 PolarHBondContact O-ND2 3.43Å |
| 285 | T | 96.5 | Very high | 95.4 | Very high | 17 Ų | 17 | 25.1 Ų | 25.1 | 10% | 0.104 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -62 | -46 | 177.1 | -57.2 | 0 | 0 | 0 | 0 | 110.7 | L83 V87 T281 F282 N288 V289 | L83-T285 HydrophobicContact CD2-CG2 4.28Å; V87-T285 HydrophobicContact CG2-CG2 3.96Å; V87-T285 WeakPolarHBondContact CG2-OG1 3.34Å; T281-T285 WeakPolarHBondContact O-CB 3.43Å; T281-T285 PolarHBondContact O-N 3.07Å; T281-T285 PolarHBondContact O-OG1 2.91Å; F282-T285 PolarHBondContact O-N 3.18Å; T285-N288 PolarHBondContact O-N 2.91Å; T285-V289 WeakPolarHBondContact O-CG2 3.44Å; T285-V289 PolarHBondContact O-N 3.39Å |
| 286 | M | 96.6 | Very high | 95.1 | Very high | 42 Ų | 42 | 24.3 Ų | 24.3 | 21% | 0.207 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -67.8 | -36 | 179.4 | -66.5 | -59.9 | 98.4 | 0 | 0 | 112.9 | I209 F213 F282 I283 N288 V289 A290 | I209-M286 HydrophobicContact CD1-CB 3.82Å; I209-M286 HydrophobicContact CG1-CB 3.83Å; I209-M286 HydrophobicContact CG2-CB 4.02Å; F213-M286 HydrophobicContact CE2-SD 4.39Å; F213-M286 HydrophobicContact CZ-SD 3.95Å; F282-M286 HydrophobicContact CD1-CG 4.34Å; F282-M286 HydrophobicContact CD2-CG 4.03Å; F282-M286 HydrophobicContact CE1-CG 4.01Å; F282-M286 HydrophobicContact CE2-CG 3.68Å; F282-M286 HydrophobicContact CE2-SD 4.18Å; F282-M286 HydrophobicContact CG-CG 4.35Å; F282-M286 HydrophobicContact CZ-CG 3.67Å; F282-M286 HydrophobicContact CZ-SD 4.41Å; F282-M286 WeakPolarHBondContact O-CB 3.3Å; F282-M286 WeakPolarHBondContact O-CG 3.45Å; F282-M286 PolarHBondContact O-N 3.33Å; I283-M286 PolarHBondContact O-N 3.2Å; M286-N288 VanDerWaalsContact C-N 3.33Å; M286-N288 PolarHBondContact O-N 3.23Å; M286-V289 HydrophobicContact CE-CG2 4.32Å; M286-V289 PolarHBondContact O-N 2.89Å; M286-A290 WeakPolarHBondContact O-CB 3.49Å; M286-A290 PolarHBondContact O-N 3.47Å |
| 287 | A | 95.5 | Very high | 94.7 | Very high | 0 Ų | 0 | 26.8 Ų | 26.8 | 0% | 0 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -64.4 | -39 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | I65 L205 I209 I283 Y284 A290 Y291 | I65-A287 HydrophobicContact CD1-CB 4.47Å; L205-A287 HydrophobicContact CD2-CB 4.42Å; I209-A287 HydrophobicContact CG1-CB 4.36Å; I283-A287 WeakPolarHBondContact O-CB 3.42Å; I283-A287 PolarHBondContact O-N 3.21Å; Y284-A287 PolarHBondContact O-N 3.42Å; A287-A290 WeakPolarHBondContact O-CB 3.34Å; A287-A290 PolarHBondContact O-N 3.33Å; A287-Y291 HydrophobicContact CB-CE2 4.38Å; A287-Y291 VanDerWaalsContact O-CD2 3.26Å; A287-Y291 WeakPolarHBondContact O-CD2 3.46Å; A287-Y291 VanDerWaalsContact O-CG 3.24Å; A287-Y291 PolarHBondContact O-N 3.16Å |
| 288 | N | 94.9 | Very high | 94.3 | Very high | 9 Ų | 9 | 34.2 Ų | 34.2 | 5% | 0.048 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -67.7 | -39.3 | 174.7 | -80.1 | -88.7 | 0 | 0 | 0 | 112.4 | I65 P69 L83 W86 Y284 T285 M286 A290 Y291 V292 | I65-N288 WeakPolarHBondContact CD1-ND2 3.41Å; P69-N288 WeakPolarHBondContact CB-OD1 3.27Å; P69-N288 WeakPolarHBondContact CG-OD1 3.31Å; L83-N288 HydrophobicContact CD2-CB 3.79Å; W86-N288 PolarHBondContact NE1-ND2 3.43Å; W86-N288 PolarHBondContact NE1-OD1 2.92Å; W86-N288 VanDerWaalsContact NE1-OD1 3.09Å; Y284-N288 PolarHBondContact O-N 2.83Å; Y284-N288 PolarHBondContact O-ND2 3.43Å; T285-N288 PolarHBondContact O-N 2.91Å; M286-N288 VanDerWaalsContact C-N 3.33Å; M286-N288 PolarHBondContact O-N 3.23Å; N288-A290 VanDerWaalsContact C-N 3.28Å; N288-A290 PolarHBondContact O-N 3.43Å; N288-Y291 PolarHBondContact O-N 2.95Å; N288-V292 PolarHBondContact O-N 3.27Å |
| 289 | V | 95.1 | Very high | 94 | Very high | 24 Ų | 24 | 31.5 Ų | 31.5 | 15% | 0.145 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -59.9 | -40.6 | 170.2 | 173.8 | 0 | 0 | 0 | 0 | 110.7 | L83 I216 T285 M286 V292 T293 | L83-V289 HydrophobicContact CD1-CG2 3.93Å; L83-V289 HydrophobicContact CD2-CG2 3.82Å; I216-V289 HydrophobicContact CD1-CG1 4.15Å; T285-V289 WeakPolarHBondContact O-CG2 3.44Å; T285-V289 PolarHBondContact O-N 3.39Å; M286-V289 HydrophobicContact CE-CG2 4.32Å; M286-V289 PolarHBondContact O-N 2.89Å; V289-V292 WeakPolarHBondContact O-CG2 3.48Å; V289-T293 WeakPolarHBondContact O-CG2 3.39Å |
| 290 | A | 95.1 | Very high | 93.7 | Very high | 3 Ų | 3 | 28.9 Ų | 28.9 | 3% | 0.025 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -65.7 | -43 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | I208 M286 A287 N288 V292 T293 F310 | I208-A290 HydrophobicContact CG2-CB 3.92Å; I208-A290 WeakPolarHBondContact O-CB 3.41Å; M286-A290 WeakPolarHBondContact O-CB 3.49Å; M286-A290 PolarHBondContact O-N 3.47Å; A287-A290 WeakPolarHBondContact O-CB 3.34Å; A287-A290 PolarHBondContact O-N 3.33Å; N288-A290 VanDerWaalsContact C-N 3.28Å; N288-A290 PolarHBondContact O-N 3.43Å; A290-V292 VanDerWaalsContact C-N 3.31Å; A290-V292 PolarHBondContact O-N 2.87Å; A290-T293 WeakPolarHBondContact O-CB 3.47Å; A290-T293 PolarHBondContact O-N 3.31Å; A290-T293 VanDerWaalsContact O-N 3.13Å; A290-T293 PolarHBondContact O-OG1 3.29Å; A290-F310 WeakPolarHBondContact O-CE2 3.38Å |
| 291 | Y | 93.8 | Very high | 93.3 | Very high | 2 Ų | 2 | 31.3 Ų | 31.3 | 1% | 0.008 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -57.2 | -42.8 | -179.2 | -67.8 | -37.6 | 0 | 0 | 0 | 112.8 | P69 I208 A287 N288 T293 V294 V295 V306 A307 F310 | P69-Y291 HydrophobicContact CG-CD2 4.3Å; P69-Y291 HydrophobicContact CG-CE2 4.19Å; I208-Y291 HydrophobicContact CD1-CE1 3.96Å; I208-Y291 HydrophobicContact CG2-CD1 4.03Å; I208-Y291 HydrophobicContact CG2-CE1 3.61Å; A287-Y291 HydrophobicContact CB-CE2 4.38Å; A287-Y291 VanDerWaalsContact O-CD2 3.26Å; A287-Y291 WeakPolarHBondContact O-CD2 3.46Å; A287-Y291 VanDerWaalsContact O-CG 3.24Å; A287-Y291 PolarHBondContact O-N 3.16Å; N288-Y291 PolarHBondContact O-N 2.95Å; Y291-T293 PolarHBondContact O-N 2.89Å; Y291-V294 PolarHBondContact O-N 3.31Å; Y291-V295 PolarHBondContact O-N 3.43Å; Y291-V306 HydrophobicContact CD1-CG1 3.9Å; Y291-V306 HydrophobicContact CD2-CB 4.39Å; Y291-V306 HydrophobicContact CD2-CG1 3.83Å; Y291-V306 HydrophobicContact CE1-CG1 4.5Å; Y291-V306 HydrophobicContact CE2-CG1 4.45Å; Y291-V306 HydrophobicContact CG-CG1 3.56Å; Y291-A307 HydrophobicContact CE1-CB 4.09Å; Y291-F310 HydrophobicContact CD1-CB 4.05Å; Y291-F310 AromaticContact CD1-CD2 3.84Å; Y291-F310 HydrophobicContact CD1-CD2 3.84Å; Y291-F310 HydrophobicContact CD1-CE2 4.5Å; Y291-F310 AromaticContact CD1-CG 4Å; Y291-F310 HydrophobicContact CD1-CG 4Å; Y291-F310 HydrophobicContact CE1-CB 4.35Å; Y291-F310 HydrophobicContact CE1-CG 4.38Å |
| 292 | V | 92.9 | Very high | 92.9 | Very high | 16 Ų | 16 | 35.9 Ų | 35.9 | 10% | 0.097 | 19% | 0.194 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -70.3 | -11 | -177.6 | -60 | 0 | 0 | 0 | 0 | 114.2 | I79 L224 N288 V289 A290 V294 I300 | I79-V292 HydrophobicContact CD1-CB 4.02Å; I79-V292 HydrophobicContact CD1-CG1 3.65Å; I79-V292 HydrophobicContact CG1-CG1 3.95Å; I79-V292 HydrophobicContact CG2-CG1 3.91Å; I79-V292 HydrophobicContact CG2-CG2 4.38Å; L224-V292 HydrophobicContact CD2-CG2 3.74Å; L224-V292 HydrophobicContact CG-CG2 4.24Å; N288-V292 PolarHBondContact O-N 3.27Å; V289-V292 WeakPolarHBondContact O-CG2 3.48Å; A290-V292 VanDerWaalsContact C-N 3.31Å; A290-V292 PolarHBondContact O-N 2.87Å; V292-V294 VanDerWaalsContact C-N 3.33Å; V292-I300 HydrophobicContact CG1-CD1 3.99Å |
| 293 | T | 93 | Very high | 92.3 | Very high | 10 Ų | 10 | 30.7 Ų | 30.7 | 6% | 0.061 | 17% | 0.172 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -80.8 | -15.4 | 175.6 | 68.4 | 0 | 0 | 0 | 0 | 113 | I216 V289 A290 Y291 | I216-T293 HydrophobicContact CD1-CG2 3.93Å; I216-T293 HydrophobicContact CG1-CG2 3.49Å; I216-T293 VanDerWaalsContact CG1-CG2 3.49Å; V289-T293 WeakPolarHBondContact O-CG2 3.39Å; A290-T293 WeakPolarHBondContact O-CB 3.47Å; A290-T293 PolarHBondContact O-N 3.31Å; A290-T293 VanDerWaalsContact O-N 3.13Å; A290-T293 PolarHBondContact O-OG1 3.29Å; Y291-T293 PolarHBondContact O-N 2.89Å |
| 294 | V | 91.9 | Very high | 91.3 | Very high | 30 Ų | 30 | 35.7 Ų | 35.7 | 18% | 0.182 | 21% | 0.205 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -125.1 | -41 | -175.9 | 176.4 | 0 | 0 | 0 | 0 | 111.6 | Q215 Y291 V292 F310 R313 I314 | Q215-V294 HydrophobicContact CG-CG2 3.79Å; Y291-V294 PolarHBondContact O-N 3.31Å; V292-V294 VanDerWaalsContact C-N 3.33Å; V294-F310 HydrophobicContact CB-CD2 3.58Å; V294-F310 HydrophobicContact CB-CE2 3.61Å; V294-F310 HydrophobicContact CG1-CD2 4.04Å; V294-F310 HydrophobicContact CG1-CE2 4.34Å; V294-F310 HydrophobicContact CG2-CD2 3.88Å; V294-F310 HydrophobicContact CG2-CE2 3.36Å; V294-F310 HydrophobicContact CG2-CZ 3.99Å; V294-R313 HydrophobicContact CG1-CB 3.51Å; V294-R313 HydrophobicContact CG1-CG 4.33Å; V294-I314 HydrophobicContact CG1-CB 4.39Å |
| 295 | V | 92.1 | Very high | 90.7 | Very high | 1 Ų | 1 | 35.8 Ų | 35.8 | 1% | 0.006 | 21% | 0.205 | C | C | . | . | S | Bend | trans | -101.3 | 123.3 | -176.5 | -170.5 | 0 | 0 | 0 | 0 | 108.8 | Y291 E299 I300 V306 T309 F310 | Y291-V295 PolarHBondContact O-N 3.43Å; V295-E299 HydrophobicContact CG1-CB 3.78Å; V295-E299 HydrophobicContact CG1-CG 3.82Å; V295-I300 HydrophobicContact CB-CG1 4.16Å; V295-I300 HydrophobicContact CG1-CG1 3.7Å; V295-V306 HydrophobicContact CG2-CG1 4.33Å; V295-T309 HydrophobicContact CG1-CG2 4.02Å; V295-T309 HydrophobicContact CG2-CG2 4.23Å; V295-F310 HydrophobicContact CG2-CB 3.91Å; V295-F310 HydrophobicContact CG2-CD2 4.31Å |
| 296 | S | 90.4 | Very high | 90.4 | Very high | 56 Ų | 56 | 35 Ų | 35 | 39% | 0.392 | 20% | 0.2 | S | C | . | . | trans | -66.9 | 154.4 | 179.2 | 70.1 | 0 | 0 | 0 | 0 | 111.9 | H298 E299 I300 | S296-H298 VanDerWaalsContact C-N 3.26Å; S296-H298 PolarHBondContact O-N 2.79Å; S296-E299 PolarHBondContact O-N 3.41Å; S296-E299 WeakPolarHBondContact OG-CB 3.44Å; S296-E299 PolarHBondContact OG-N 3.02Å; S296-I300 PolarHBondContact O-N 3.37Å | ||
| 297 | P | 87.1 | Confident | 89.9 | Confident | 52 Ų | 52 | 33 Ų | 33 | 34% | 0.338 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -53.3 | -40.9 | 177.5 | -24.4 | 30.3 | 0 | 0 | 0 | 113.7 | M73 I79 E299 I300 L301 | M73-P297 HydrophobicContact CE-CB 4.28Å; I79-P297 HydrophobicContact CD1-CG 3.87Å; P297-E299 PolarHBondContact O-N 3.01Å; P297-I300 PolarHBondContact O-N 3.14Å; P297-L301 WeakPolarHBondContact O-CG 3.47Å; P297-L301 PolarHBondContact O-N 3.27Å |
| 298 | H | 87.9 | Confident | 89.5 | Confident | 159 Ų | 159 | 34.4 Ų | 34.4 | 74% | 0.736 | 20% | 0.198 | S | C | * | . | H | α-helix | trans | -63.6 | -40.8 | 176.7 | -88.6 | -58.3 | 0 | 0 | 0 | 112.5 | S296 L301 T302 | S296-H298 VanDerWaalsContact C-N 3.26Å; S296-H298 PolarHBondContact O-N 2.79Å; H298-L301 PolarHBondContact O-N 3.33Å; H298-T302 PolarHBondContact O-N 3.4Å; H298-T302 PolarHBondContact O-OG1 3.3Å |
| 299 | E | 89.9 | Confident | 89.2 | Confident | 35 Ų | 35 | 34.9 Ų | 34.9 | 16% | 0.164 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -71.3 | -32.9 | -179.2 | -170.6 | 176.8 | -158.8 | 0 | 0 | 111.7 | V295 S296 P297 L301 T302 T303 T309 R313 | V295-E299 HydrophobicContact CG1-CB 3.78Å; V295-E299 HydrophobicContact CG1-CG 3.82Å; S296-E299 PolarHBondContact O-N 3.41Å; S296-E299 WeakPolarHBondContact OG-CB 3.44Å; S296-E299 PolarHBondContact OG-N 3.02Å; P297-E299 PolarHBondContact O-N 3.01Å; E299-L301 VanDerWaalsContact C-N 3.28Å; E299-L301 PolarHBondContact O-N 3.21Å; E299-T302 PolarHBondContact O-N 2.94Å; E299-T302 PolarHBondContact O-OG1 3.31Å; E299-T302 VanDerWaalsContact O-OG1 3.1Å; E299-T303 WeakPolarHBondContact O-CB 3.28Å; E299-T303 VanDerWaalsContact O-CG2 3.31Å; E299-T303 WeakPolarHBondContact O-CG2 2.96Å; E299-T303 PolarHBondContact O-N 3.27Å; E299-T309 HydrophobicContact CG-CG2 3.73Å; E299-T309 WeakPolarHBondContact OE1-CG2 3.23Å; E299-R313 VanDerWaalsContact CD-NH2 3.35Å; E299-R313 IonicContact OE1-CZ 2.75Å; E299-R313 IonicContact OE1-NE 3.88Å; E299-R313 PolarHBondContact OE1-NE 3.17Å; E299-R313 IonicContact OE1-NH2 3.23Å; E299-R313 PolarHBondContact OE1-NH2 3.34Å; E299-R313 IonicContact OE2-CZ 3.32Å; E299-R313 IonicContact OE2-NE 3.04Å; E299-R313 IonicContact OE2-NH2 2.74Å; E299-R313 PolarHBondContact OE2-NH2 3.48Å |
| 300 | I | 89.9 | Confident | 89 | Confident | 8 Ų | 8 | 33.8 Ų | 33.8 | 4% | 0.041 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -58.2 | -41.3 | 171.2 | -68.4 | 173.5 | 0 | 0 | 0 | 110.9 | T70 M73 V292 V295 S296 P297 T302 V306 | T70-I300 WeakPolarHBondContact CB-O 3.45Å; T70-I300 WeakPolarHBondContact CG2-O 3.45Å; T70-I300 PolarHBondContact OG1-O 2.99Å; M73-I300 HydrophobicContact CB-CG2 4.12Å; M73-I300 HydrophobicContact CG-CG2 4.35Å; V292-I300 HydrophobicContact CG1-CD1 3.99Å; V295-I300 HydrophobicContact CB-CG1 4.16Å; V295-I300 HydrophobicContact CG1-CG1 3.7Å; S296-I300 PolarHBondContact O-N 3.37Å; P297-I300 PolarHBondContact O-N 3.14Å; I300-T302 VanDerWaalsContact C-N 3.3Å; I300-T302 PolarHBondContact O-N 3.39Å; I300-V306 HydrophobicContact CG1-CG1 4.27Å; I300-V306 HydrophobicContact CG1-CG2 4.44Å; I300-V306 HydrophobicContact CG2-CG2 4.08Å |
| 301 | L | 88.8 | Confident | 88.8 | Confident | 51 Ų | 51 | 33.6 Ų | 33.6 | 27% | 0.267 | 19% | 0.193 | S | C | . | . | H | α-helix | trans | -71.4 | -22 | -179.9 | -67 | 172.7 | 0 | 0 | 0 | 113.5 | M73 E74 P297 H298 E299 | M73-L301 HydrophobicContact CB-CD2 3.98Å; M73-L301 HydrophobicContact CG-CD2 3.8Å; M73-L301 HydrophobicContact CG-CG 4.26Å; E74-L301 HydrophobicContact CB-CD2 4.16Å; E74-L301 HydrophobicContact CG-CD2 3.53Å; P297-L301 WeakPolarHBondContact O-CG 3.47Å; P297-L301 PolarHBondContact O-N 3.27Å; H298-L301 PolarHBondContact O-N 3.33Å; E299-L301 VanDerWaalsContact C-N 3.28Å; E299-L301 PolarHBondContact O-N 3.21Å |
| 302 | T | 88.3 | Confident | 88.6 | Confident | 113 Ų | 113 | 37.2 Ų | 37.2 | 69% | 0.693 | 22% | 0.215 | S | C | * | . | H | α-helix | trans | -101.3 | -18.6 | -178 | 56.3 | 0 | 0 | 0 | 0 | 113.9 | H298 E299 I300 | H298-T302 PolarHBondContact O-N 3.4Å; H298-T302 PolarHBondContact O-OG1 3.3Å; E299-T302 PolarHBondContact O-N 2.94Å; E299-T302 PolarHBondContact O-OG1 3.31Å; E299-T302 VanDerWaalsContact O-OG1 3.1Å; I300-T302 VanDerWaalsContact C-N 3.3Å; I300-T302 PolarHBondContact O-N 3.39Å |
| 303 | T | 84.8 | Confident | 88.4 | Confident | 13 Ų | 13 | 44.1 Ų | 44.1 | 8% | 0.08 | 24% | 0.239 | C | C | . | . | trans | -85.5 | 135.4 | -176.1 | -173.7 | 0 | 0 | 0 | 0 | 111.6 | T70 E299 A305 V306 T309 | T70-T303 PolarHBondContact OG1-O 2.93Å; E299-T303 WeakPolarHBondContact O-CB 3.28Å; E299-T303 VanDerWaalsContact O-CG2 3.31Å; E299-T303 WeakPolarHBondContact O-CG2 2.96Å; E299-T303 PolarHBondContact O-N 3.27Å; T303-A305 PolarHBondContact O-N 3.32Å; T303-A305 PolarHBondContact OG1-N 3.11Å; T303-A305 PolarHBondContact OG1-O 3.44Å; T303-V306 HydrophobicContact CG2-CB 4.29Å; T303-V306 HydrophobicContact CG2-CG2 3.67Å; T303-T309 WeakPolarHBondContact CB-OG1 3.34Å; T303-T309 PolarHBondContact OG1-OG1 2.98Å | ||
| 304 | P | 77.3 | Confident | 88.3 | Confident | 109 Ų | 109 | 46 Ų | 46 | 71% | 0.708 | 25% | 0.249 | S | C | * | . | S | Bend | trans | -69.3 | -23.3 | 172.1 | 28.4 | -35 | 0 | 0 | 0 | 112.7 | ||
| 305 | A | 83.6 | Confident | 88.2 | Confident | 1 Ų | 1 | 47.4 Ų | 47.4 | 1% | 0.008 | 25% | 0.251 | C | S | . | . | trans | -150.3 | 107.6 | -178.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | F66 Y152 T303 A307 I308 T309 | F66-A305 WeakPolarHBondContact O-CA 3.46Å; Y152-A305 WeakPolarHBondContact OH-CB 3.38Å; T303-A305 PolarHBondContact O-N 3.32Å; T303-A305 PolarHBondContact OG1-N 3.11Å; T303-A305 PolarHBondContact OG1-O 3.44Å; A305-A307 VanDerWaalsContact C-N 3.28Å; A305-A307 PolarHBondContact O-N 3.35Å; A305-I308 HydrophobicContact CB-CD1 3.77Å; A305-I308 HydrophobicContact CB-CG1 4.14Å; A305-I308 PolarHBondContact O-N 3.3Å; A305-I308 VanDerWaalsContact O-N 3.17Å; A305-T309 PolarHBondContact O-N 2.97Å | ||
| 306 | V | 88.8 | Confident | 88 | Confident | 0 Ų | 0 | 49.3 Ų | 49.3 | 0% | 0 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -62 | -35.1 | -172.9 | -178.4 | 0 | 0 | 0 | 0 | 112.4 | F66 P69 Y291 V295 I300 T303 I308 T309 F310 | F66-V306 PolarHBondContact O-N 2.91Å; P69-V306 HydrophobicContact CB-CG2 3.92Å; P69-V306 HydrophobicContact CG-CG2 4.45Å; Y291-V306 HydrophobicContact CD1-CG1 3.9Å; Y291-V306 HydrophobicContact CD2-CB 4.39Å; Y291-V306 HydrophobicContact CD2-CG1 3.83Å; Y291-V306 HydrophobicContact CE1-CG1 4.5Å; Y291-V306 HydrophobicContact CE2-CG1 4.45Å; Y291-V306 HydrophobicContact CG-CG1 3.56Å; V295-V306 HydrophobicContact CG2-CG1 4.33Å; I300-V306 HydrophobicContact CG1-CG1 4.27Å; I300-V306 HydrophobicContact CG1-CG2 4.44Å; I300-V306 HydrophobicContact CG2-CG2 4.08Å; T303-V306 HydrophobicContact CG2-CB 4.29Å; T303-V306 HydrophobicContact CG2-CG2 3.67Å; V306-I308 VanDerWaalsContact C-N 3.31Å; V306-I308 PolarHBondContact O-N 3.02Å; V306-T309 PolarHBondContact O-N 3.16Å; V306-F310 VanDerWaalsContact O-CB 3.28Å; V306-F310 WeakPolarHBondContact O-CB 3.2Å; V306-F310 PolarHBondContact O-N 2.98Å |
| 307 | A | 87.7 | Confident | 87.8 | Confident | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -64.5 | -33.2 | 179.9 | 0 | 0 | 0 | 0 | 0 | 113.9 | F66 I208 Y291 A305 S311 M322 | F66-A307 HydrophobicContact CB-CB 4.44Å; F66-A307 HydrophobicContact CD1-CB 3.41Å; F66-A307 VanDerWaalsContact CD1-CB 3.41Å; F66-A307 HydrophobicContact CE1-CB 3.98Å; F66-A307 HydrophobicContact CG-CB 4.24Å; I208-A307 HydrophobicContact CD1-CB 4.4Å; Y291-A307 HydrophobicContact CE1-CB 4.09Å; A305-A307 VanDerWaalsContact C-N 3.28Å; A305-A307 PolarHBondContact O-N 3.35Å; A307-S311 WeakPolarHBondContact O-CB 3.49Å; A307-S311 PolarHBondContact O-N 3.08Å; A307-S311 PolarHBondContact O-OG 3.17Å; A307-M322 HydrophobicContact CB-CG 3.97Å; A307-M322 HydrophobicContact CB-SD 4.28Å; A307-M322 WeakPolarHBondContact O-CG 3.48Å |
| 308 | I | 85.6 | Confident | 87.9 | Confident | 30 Ų | 30 | 56.2 Ų | 56.2 | 15% | 0.154 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -72.2 | -48.2 | 179.6 | -59.4 | 171.4 | 0 | 0 | 0 | 108.9 | Y152 A305 V306 F310 S311 V312 | Y152-I308 HydrophobicContact CD1-CD1 3.85Å; Y152-I308 HydrophobicContact CE1-CD1 3.09Å; Y152-I308 HydrophobicContact CE1-CG1 4.3Å; A305-I308 HydrophobicContact CB-CD1 3.77Å; A305-I308 HydrophobicContact CB-CG1 4.14Å; A305-I308 PolarHBondContact O-N 3.3Å; A305-I308 VanDerWaalsContact O-N 3.17Å; V306-I308 VanDerWaalsContact C-N 3.31Å; V306-I308 PolarHBondContact O-N 3.02Å; I308-F310 VanDerWaalsContact C-N 3.29Å; I308-F310 PolarHBondContact O-N 3.25Å; I308-S311 PolarHBondContact O-N 3.18Å; I308-S311 PolarHBondContact O-OG 3.14Å; I308-V312 HydrophobicContact CG2-CG2 4.41Å; I308-V312 WeakPolarHBondContact O-CG2 3.38Å; I308-V312 PolarHBondContact O-N 3.35Å |
| 309 | T | 89.4 | Confident | 87.9 | Confident | 20 Ų | 20 | 51.6 Ų | 51.6 | 12% | 0.123 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -56.1 | -46.3 | 174.3 | -56.3 | 0 | 0 | 0 | 0 | 111.3 | V295 E299 T303 A305 V306 S311 V312 R313 | V295-T309 HydrophobicContact CG1-CG2 4.02Å; V295-T309 HydrophobicContact CG2-CG2 4.23Å; E299-T309 HydrophobicContact CG-CG2 3.73Å; E299-T309 WeakPolarHBondContact OE1-CG2 3.23Å; T303-T309 WeakPolarHBondContact CB-OG1 3.34Å; T303-T309 PolarHBondContact OG1-OG1 2.98Å; A305-T309 PolarHBondContact O-N 2.97Å; V306-T309 PolarHBondContact O-N 3.16Å; T309-S311 VanDerWaalsContact C-N 3.31Å; T309-S311 PolarHBondContact O-N 3.49Å; T309-V312 PolarHBondContact O-N 2.94Å; T309-R313 WeakPolarHBondContact O-CG 3.47Å; T309-R313 PolarHBondContact O-N 3.24Å |
| 310 | F | 91.6 | Very high | 87.8 | Confident | 0 Ų | 0 | 55.4 Ų | 55.4 | 0% | 0 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -53.7 | -48.2 | 173.3 | -179.3 | -86.9 | 0 | 0 | 0 | 111.6 | I208 T211 A290 Y291 V294 V295 V306 I308 R313 I314 | I208-F310 HydrophobicContact CG1-CE1 4.48Å; I208-F310 HydrophobicContact CG2-CE1 4.18Å; I208-F310 HydrophobicContact CG2-CZ 4.23Å; T211-F310 HydrophobicContact CG2-CE1 4.01Å; T211-F310 HydrophobicContact CG2-CZ 3.73Å; A290-F310 WeakPolarHBondContact O-CE2 3.38Å; Y291-F310 HydrophobicContact CD1-CB 4.05Å; Y291-F310 AromaticContact CD1-CD2 3.84Å; Y291-F310 HydrophobicContact CD1-CD2 3.84Å; Y291-F310 HydrophobicContact CD1-CE2 4.5Å; Y291-F310 AromaticContact CD1-CG 4Å; Y291-F310 HydrophobicContact CD1-CG 4Å; Y291-F310 HydrophobicContact CE1-CB 4.35Å; Y291-F310 HydrophobicContact CE1-CG 4.38Å; V294-F310 HydrophobicContact CB-CD2 3.58Å; V294-F310 HydrophobicContact CB-CE2 3.61Å; V294-F310 HydrophobicContact CG1-CD2 4.04Å; V294-F310 HydrophobicContact CG1-CE2 4.34Å; V294-F310 HydrophobicContact CG2-CD2 3.88Å; V294-F310 HydrophobicContact CG2-CE2 3.36Å; V294-F310 HydrophobicContact CG2-CZ 3.99Å; V295-F310 HydrophobicContact CG2-CB 3.91Å; V295-F310 HydrophobicContact CG2-CD2 4.31Å; V306-F310 VanDerWaalsContact O-CB 3.28Å; V306-F310 WeakPolarHBondContact O-CB 3.2Å; V306-F310 PolarHBondContact O-N 2.98Å; I308-F310 VanDerWaalsContact C-N 3.29Å; I308-F310 PolarHBondContact O-N 3.25Å; F310-R313 PolarHBondContact O-N 3Å; F310-I314 HydrophobicContact CD1-CG2 4.03Å; F310-I314 HydrophobicContact CE1-CG2 3.81Å; F310-I314 HydrophobicContact CZ-CG2 4.43Å; F310-I314 VanDerWaalsContact O-CG2 3.23Å; F310-I314 WeakPolarHBondContact O-CG2 3.41Å; F310-I314 PolarHBondContact O-N 3.37Å; F310-I314 VanDerWaalsContact O-N 3.15Å |
| 311 | S | 89.6 | Confident | 87.7 | Confident | 0 Ų | 0 | 57.1 Ų | 57.1 | 0% | 0 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -65.9 | -39.6 | -178.6 | 73.5 | 0 | 0 | 0 | 0 | 113.8 | A307 I308 T309 R313 I314 Y315 W319 M322 | A307-S311 WeakPolarHBondContact O-CB 3.49Å; A307-S311 PolarHBondContact O-N 3.08Å; A307-S311 PolarHBondContact O-OG 3.17Å; I308-S311 PolarHBondContact O-N 3.18Å; I308-S311 PolarHBondContact O-OG 3.14Å; T309-S311 VanDerWaalsContact C-N 3.31Å; T309-S311 PolarHBondContact O-N 3.49Å; S311-R313 VanDerWaalsContact C-N 3.3Å; S311-R313 PolarHBondContact O-N 3.44Å; S311-I314 PolarHBondContact O-N 3.24Å; S311-Y315 WeakPolarHBondContact O-CB 3.48Å; S311-Y315 PolarHBondContact O-N 2.6Å; S311-W319 PolarHBondContact OG-O 3.42Å; S311-M322 WeakPolarHBondContact OG-CB 3.3Å |
| 312 | V | 89.7 | Confident | 87.6 | Confident | 78 Ų | 78 | 54.8 Ų | 54.8 | 47% | 0.473 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -64.4 | -39 | 177.3 | 170.9 | 0 | 0 | 0 | 0 | 110.3 | I308 T309 W319 | I308-V312 HydrophobicContact CG2-CG2 4.41Å; I308-V312 WeakPolarHBondContact O-CG2 3.38Å; I308-V312 PolarHBondContact O-N 3.35Å; T309-V312 PolarHBondContact O-N 2.94Å; V312-W319 HydrophobicContact CG2-CB 4.08Å; V312-W319 HydrophobicContact CG2-CD2 4.38Å; V312-W319 HydrophobicContact CG2-CE3 4.18Å; V312-W319 HydrophobicContact CG2-CG 4.37Å |
| 313 | R | 90.1 | Very high | 87.6 | Confident | 160 Ų | 160 | 49.4 Ų | 49.4 | 60% | 0.604 | 26% | 0.256 | S | S | * | . | H | α-helix | trans | -70.9 | -33.4 | -179.8 | -67.5 | -70.8 | -173.1 | 170.5 | 0.3 | 113.7 | V294 E299 T309 F310 S311 | V294-R313 HydrophobicContact CG1-CB 3.51Å; V294-R313 HydrophobicContact CG1-CG 4.33Å; E299-R313 VanDerWaalsContact CD-NH2 3.35Å; E299-R313 IonicContact OE1-CZ 2.75Å; E299-R313 IonicContact OE1-NE 3.88Å; E299-R313 PolarHBondContact OE1-NE 3.17Å; E299-R313 IonicContact OE1-NH2 3.23Å; E299-R313 PolarHBondContact OE1-NH2 3.34Å; E299-R313 IonicContact OE2-CZ 3.32Å; E299-R313 IonicContact OE2-NE 3.04Å; E299-R313 IonicContact OE2-NH2 2.74Å; E299-R313 PolarHBondContact OE2-NH2 3.48Å; T309-R313 WeakPolarHBondContact O-CG 3.47Å; T309-R313 PolarHBondContact O-N 3.24Å; F310-R313 PolarHBondContact O-N 3Å; S311-R313 VanDerWaalsContact C-N 3.3Å; S311-R313 PolarHBondContact O-N 3.44Å |
| 314 | I | 91 | Very high | 87.8 | Confident | 51 Ų | 51 | 51.2 Ų | 51.2 | 26% | 0.262 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -111.5 | -36.9 | -169.2 | -160.6 | 60.2 | 0 | 0 | 0 | 115 | T211 V294 F310 S311 | T211-I314 HydrophobicContact CG2-CG1 3.72Å; T211-I314 HydrophobicContact CG2-CG2 4.2Å; V294-I314 HydrophobicContact CG1-CB 4.39Å; F310-I314 HydrophobicContact CD1-CG2 4.03Å; F310-I314 HydrophobicContact CE1-CG2 3.81Å; F310-I314 HydrophobicContact CZ-CG2 4.43Å; F310-I314 VanDerWaalsContact O-CG2 3.23Å; F310-I314 WeakPolarHBondContact O-CG2 3.41Å; F310-I314 PolarHBondContact O-N 3.37Å; F310-I314 VanDerWaalsContact O-N 3.15Å; S311-I314 PolarHBondContact O-N 3.24Å |
| 315 | Y | 89.4 | Confident | 88.2 | Confident | 58 Ų | 58 | 48.2 Ų | 48.2 | 23% | 0.227 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -92 | -6.9 | -173.9 | -62.3 | -41.3 | 0 | 0 | 0 | 113.3 | T211 S311 V317 M318 M322 | T211-Y315 HydrophobicContact CG2-CE1 4.33Å; T211-Y315 PolarHBondContact OG1-OH 3.02Å; S311-Y315 WeakPolarHBondContact O-CB 3.48Å; S311-Y315 PolarHBondContact O-N 2.6Å; Y315-V317 PolarHBondContact O-N 2.93Å; Y315-V317 VanDerWaalsContact O-N 3.12Å; Y315-M318 WeakPolarHBondContact O-CB 3.43Å; Y315-M318 PolarHBondContact O-N 3.46Å; Y315-M322 HydrophobicContact CE2-CE 4.05Å |
| 316 | G | 86.8 | Confident | 88.2 | Confident | 42 Ų | 42 | 48.3 Ų | 48.3 | 43% | 0.433 | 24% | 0.241 | S | C | . | . | G | 310 helix | trans | 54.1 | -118 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | M318 W319 | G316-M318 PolarHBondContact O-N 2.93Å; G316-M318 VanDerWaalsContact O-N 3.12Å; G316-W319 WeakPolarHBondContact O-CB 3.37Å; G316-W319 VanDerWaalsContact O-CD1 3.23Å; G316-W319 PolarHBondContact O-N 2.89Å |
| 317 | V | 87.2 | Confident | 88.2 | Confident | 133 Ų | 133 | 48.3 Ų | 48.3 | 81% | 0.806 | 24% | 0.241 | S | C | * | . | G | 310 helix | trans | -59.5 | -24.5 | 179.1 | -175.5 | 0 | 0 | 0 | 0 | 112.8 | Y315 W319 W320 | Y315-V317 PolarHBondContact O-N 2.93Å; Y315-V317 VanDerWaalsContact O-N 3.12Å; V317-W319 VanDerWaalsContact C-N 3.34Å; V317-W320 PolarHBondContact O-NE1 2.98Å |
| 318 | M | 88.5 | Confident | 88.3 | Confident | 120 Ų | 120 | 50.9 Ų | 50.9 | 59% | 0.591 | 25% | 0.254 | S | S | * | . | G | 310 helix | trans | -90.8 | 14.4 | 178.7 | -64.4 | -176.2 | -177.8 | 0 | 0 | 113.5 | Y315 G316 W320 I321 | Y315-M318 WeakPolarHBondContact O-CB 3.43Å; Y315-M318 PolarHBondContact O-N 3.46Å; G316-M318 PolarHBondContact O-N 2.93Å; G316-M318 VanDerWaalsContact O-N 3.12Å; M318-W320 PolarHBondContact O-N 3.34Å; M318-I321 HydrophobicContact CB-CD1 3.78Å; M318-I321 HydrophobicContact CB-CG1 4.34Å; M318-I321 HydrophobicContact CG-CD1 4.28Å; M318-I321 VanDerWaalsContact O-CB 3.3Å; M318-I321 WeakPolarHBondContact O-CB 3.36Å; M318-I321 VanDerWaalsContact O-CG1 3.31Å; M318-I321 WeakPolarHBondContact O-CG1 3.47Å; M318-I321 PolarHBondContact O-N 2.88Å; M318-I321 HydrophobicContact SD-CD1 4.33Å |
| 319 | W | 87.2 | Confident | 88.3 | Confident | 61 Ų | 61 | 49.5 Ų | 49.5 | 23% | 0.231 | 25% | 0.247 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -56.1 | -35 | -179.4 | 72.7 | -91.9 | 0 | 0 | 0 | 113.4 | Q155 P159 S311 V312 G316 V317 I321 M322 P323 | Q155-W319 HydrophobicContact CG-CH2 4.25Å; Q155-W319 HydrophobicContact CG-CZ3 4.13Å; P159-W319 HydrophobicContact CB-CH2 4.32Å; P159-W319 HydrophobicContact CB-CZ2 4.01Å; S311-W319 PolarHBondContact OG-O 3.42Å; V312-W319 HydrophobicContact CG2-CB 4.08Å; V312-W319 HydrophobicContact CG2-CD2 4.38Å; V312-W319 HydrophobicContact CG2-CE3 4.18Å; V312-W319 HydrophobicContact CG2-CG 4.37Å; G316-W319 WeakPolarHBondContact O-CB 3.37Å; G316-W319 VanDerWaalsContact O-CD1 3.23Å; G316-W319 PolarHBondContact O-N 2.89Å; V317-W319 VanDerWaalsContact C-N 3.34Å; W319-I321 PolarHBondContact O-N 3.39Å; W319-M322 PolarHBondContact O-N 3.33Å; W319-P323 HydrophobicContact CE3-CG 4.16Å; W319-P323 HydrophobicContact CZ3-CG 3.88Å; W319-P323 VanDerWaalsContact O-CD 3.22Å; W319-P323 WeakPolarHBondContact O-CD 3.39Å |
| 320 | W | 88.8 | Confident | 88.2 | Confident | 116 Ų | 116 | 48.6 Ų | 48.6 | 44% | 0.439 | 24% | 0.242 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -61.8 | -17.4 | -178 | 58.7 | -95 | 0 | 0 | 0 | 113.8 | P156 V317 M318 M322 P323 I324 | P156-W320 HydrophobicContact CB-CB 4.1Å; P156-W320 HydrophobicContact CG-CB 4.12Å; V317-W320 PolarHBondContact O-NE1 2.98Å; M318-W320 PolarHBondContact O-N 3.34Å; W320-M322 VanDerWaalsContact C-N 3.26Å; W320-M322 PolarHBondContact O-N 2.83Å; W320-P323 WeakPolarHBondContact O-CD 3.2Å; W320-I324 HydrophobicContact CE3-CD1 3.48Å; W320-I324 VanDerWaalsContact CE3-CD1 3.48Å; W320-I324 HydrophobicContact CE3-CG1 4.37Å; W320-I324 HydrophobicContact CZ3-CD1 3.66Å; W320-I324 WeakPolarHBondContact O-CG1 3.49Å; W320-I324 PolarHBondContact O-N 2.85Å |
| 321 | I | 88.1 | Confident | 88 | Confident | 44 Ų | 44 | 49.6 Ų | 49.6 | 23% | 0.226 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -58.5 | -40.2 | 175.8 | -68.8 | -177.3 | 0 | 0 | 0 | 110.9 | M318 W319 I324 F325 | M318-I321 HydrophobicContact CB-CD1 3.78Å; M318-I321 HydrophobicContact CB-CG1 4.34Å; M318-I321 HydrophobicContact CG-CD1 4.28Å; M318-I321 VanDerWaalsContact O-CB 3.3Å; M318-I321 WeakPolarHBondContact O-CB 3.36Å; M318-I321 VanDerWaalsContact O-CG1 3.31Å; M318-I321 WeakPolarHBondContact O-CG1 3.47Å; M318-I321 PolarHBondContact O-N 2.88Å; M318-I321 HydrophobicContact SD-CD1 4.33Å; W319-I321 PolarHBondContact O-N 3.39Å; I321-I324 PolarHBondContact O-N 3.21Å; I321-F325 HydrophobicContact CG2-CD2 3.48Å; I321-F325 VanDerWaalsContact CG2-CD2 3.48Å; I321-F325 HydrophobicContact CG2-CE2 3.29Å; I321-F325 WeakPolarHBondContact O-CD2 3.27Å; I321-F325 PolarHBondContact O-N 3.11Å |
| 322 | M | 86.6 | Confident | 88 | Confident | 1 Ų | 1 | 49.6 Ų | 49.6 | 1% | 0.005 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -70.7 | -49.5 | -175.2 | -167.7 | 61 | 65 | 0 | 0 | 112.9 | I208 A307 S311 Y315 W319 W320 I324 F325 V326 | I208-M322 HydrophobicContact CD1-CE 3.56Å; I208-M322 HydrophobicContact CD1-SD 3.85Å; I208-M322 HydrophobicContact CG1-CE 3.44Å; I208-M322 VanDerWaalsContact CG1-CE 3.44Å; I208-M322 HydrophobicContact CG1-SD 4.39Å; A307-M322 HydrophobicContact CB-CG 3.97Å; A307-M322 HydrophobicContact CB-SD 4.28Å; A307-M322 WeakPolarHBondContact O-CG 3.48Å; S311-M322 WeakPolarHBondContact OG-CB 3.3Å; Y315-M322 HydrophobicContact CE2-CE 4.05Å; W319-M322 PolarHBondContact O-N 3.33Å; W320-M322 VanDerWaalsContact C-N 3.26Å; W320-M322 PolarHBondContact O-N 2.83Å; M322-I324 PolarHBondContact O-N 3.44Å; M322-F325 PolarHBondContact O-N 3.49Å; M322-F325 VanDerWaalsContact O-N 3.07Å; M322-V326 HydrophobicContact CG-CG2 4.42Å; M322-V326 WeakPolarHBondContact O-CG2 3.48Å; M322-V326 PolarHBondContact O-N 2.9Å |
| 323 | P | 87.2 | Confident | 87.9 | Confident | 0 Ų | 0 | 46 Ų | 46 | 0% | 0 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -51.7 | -42 | 170.8 | -27.6 | 33.3 | 0 | 0 | 0 | 113.3 | Y152 Q155 W319 W320 F325 V326 A327 | Y152-P323 WeakPolarHBondContact CB-O 3.39Å; Y152-P323 HydrophobicContact CD1-CB 4.39Å; Q155-P323 HydrophobicContact CB-CB 4.15Å; Q155-P323 HydrophobicContact CG-CB 4.46Å; Q155-P323 HydrophobicContact CG-CG 4.36Å; W319-P323 HydrophobicContact CE3-CG 4.16Å; W319-P323 HydrophobicContact CZ3-CG 3.88Å; W319-P323 VanDerWaalsContact O-CD 3.22Å; W319-P323 WeakPolarHBondContact O-CD 3.39Å; W320-P323 WeakPolarHBondContact O-CD 3.2Å; P323-F325 PolarHBondContact O-N 2.91Å; P323-V326 PolarHBondContact O-N 3.44Å; P323-A327 WeakPolarHBondContact O-CB 3.46Å; P323-A327 PolarHBondContact O-N 3.35Å |
| 324 | I | 88.9 | Confident | 87.9 | Confident | 51 Ų | 51 | 38.4 Ų | 38.4 | 26% | 0.262 | 20% | 0.197 | S | C | . | . | H | α-helix | trans | -61.6 | -47.1 | 176.2 | -67.5 | -175 | 0 | 0 | 0 | 110.9 | P156 W320 I321 M322 V326 A327 L328 | P156-I324 HydrophobicContact CG-CG1 4.32Å; W320-I324 HydrophobicContact CE3-CD1 3.48Å; W320-I324 VanDerWaalsContact CE3-CD1 3.48Å; W320-I324 HydrophobicContact CE3-CG1 4.37Å; W320-I324 HydrophobicContact CZ3-CD1 3.66Å; W320-I324 WeakPolarHBondContact O-CG1 3.49Å; W320-I324 PolarHBondContact O-N 2.85Å; I321-I324 PolarHBondContact O-N 3.21Å; M322-I324 PolarHBondContact O-N 3.44Å; I324-V326 VanDerWaalsContact C-N 3.32Å; I324-V326 PolarHBondContact O-N 3.35Å; I324-A327 WeakPolarHBondContact O-CB 3.22Å; I324-A327 PolarHBondContact O-N 2.82Å; I324-A327 VanDerWaalsContact O-N 3.16Å; I324-L328 HydrophobicContact CG2-CD1 3.96Å; I324-L328 HydrophobicContact CG2-CG 4.21Å; I324-L328 VanDerWaalsContact O-CG 3.29Å; I324-L328 WeakPolarHBondContact O-CG 3.41Å; I324-L328 PolarHBondContact O-N 2.9Å |
| 325 | F | 86.4 | Confident | 88 | Confident | 47 Ų | 47 | 36 Ų | 36 | 21% | 0.206 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -61.6 | -39.1 | 176.3 | -82 | -61.2 | 0 | 0 | 0 | 113.2 | A204 M207 I321 M322 P323 A327 L328 S329 | A204-F325 HydrophobicContact CB-CB 3.66Å; A204-F325 HydrophobicContact CB-CD1 3.69Å; A204-F325 HydrophobicContact CB-CD2 4.05Å; A204-F325 HydrophobicContact CB-CE1 4.33Å; A204-F325 HydrophobicContact CB-CG 3.54Å; M207-F325 HydrophobicContact CE-CD2 3.97Å; M207-F325 HydrophobicContact CE-CE2 3.27Å; M207-F325 HydrophobicContact CE-CZ 3.74Å; I321-F325 HydrophobicContact CG2-CD2 3.48Å; I321-F325 VanDerWaalsContact CG2-CD2 3.48Å; I321-F325 HydrophobicContact CG2-CE2 3.29Å; I321-F325 WeakPolarHBondContact O-CD2 3.27Å; I321-F325 PolarHBondContact O-N 3.11Å; M322-F325 PolarHBondContact O-N 3.49Å; M322-F325 VanDerWaalsContact O-N 3.07Å; P323-F325 PolarHBondContact O-N 2.91Å; F325-A327 VanDerWaalsContact C-N 3.33Å; F325-L328 PolarHBondContact O-N 3.31Å; F325-S329 WeakPolarHBondContact O-CB 3.24Å; F325-S329 PolarHBondContact O-N 3.28Å |
| 326 | V | 84.6 | Confident | 87.9 | Confident | 2 Ų | 2 | 33.3 Ų | 33.3 | 1% | 0.012 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -65 | -38.7 | 175 | -178.8 | 0 | 0 | 0 | 0 | 110.7 | F66 Y152 M322 P323 I324 S329 T330 | F66-V326 HydrophobicContact CD1-CG2 4.35Å; F66-V326 HydrophobicContact CD2-CB 4.45Å; F66-V326 HydrophobicContact CD2-CG1 3.8Å; F66-V326 HydrophobicContact CD2-CG2 3.9Å; F66-V326 HydrophobicContact CE1-CG2 4.23Å; F66-V326 HydrophobicContact CE2-CB 4.3Å; F66-V326 HydrophobicContact CE2-CG1 4.01Å; F66-V326 HydrophobicContact CE2-CG2 3.8Å; F66-V326 HydrophobicContact CG-CG2 4.17Å; F66-V326 HydrophobicContact CZ-CG2 3.95Å; Y152-V326 HydrophobicContact CD2-CB 4.1Å; Y152-V326 HydrophobicContact CD2-CG1 3.35Å; Y152-V326 HydrophobicContact CE2-CB 4.45Å; Y152-V326 HydrophobicContact CE2-CG1 3.43Å; Y152-V326 VanDerWaalsContact CE2-CG1 3.43Å; Y152-V326 HydrophobicContact CG-CB 4.3Å; Y152-V326 HydrophobicContact CG-CG1 4.03Å; M322-V326 HydrophobicContact CG-CG2 4.42Å; M322-V326 WeakPolarHBondContact O-CG2 3.48Å; M322-V326 PolarHBondContact O-N 2.9Å; P323-V326 PolarHBondContact O-N 3.44Å; I324-V326 VanDerWaalsContact C-N 3.32Å; I324-V326 PolarHBondContact O-N 3.35Å; V326-S329 VanDerWaalsContact O-CB 3.27Å; V326-S329 WeakPolarHBondContact O-CB 3.41Å; V326-S329 PolarHBondContact O-N 2.89Å; V326-T330 PolarHBondContact O-N 2.88Å; V326-T330 PolarHBondContact O-OG1 3.49Å |
| 327 | A | 88.5 | Confident | 88 | Confident | 0 Ų | 0 | 31.5 Ų | 31.5 | 0% | 0 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -64.4 | -50.4 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | F149 I153 P323 I324 F325 S329 T330 F331 | F149-A327 HydrophobicContact CD2-CB 3.95Å; F149-A327 WeakPolarHBondContact CD2-O 3.45Å; F149-A327 HydrophobicContact CE2-CB 4.35Å; I153-A327 HydrophobicContact CB-CB 3.92Å; I153-A327 HydrophobicContact CD1-CB 4.03Å; P323-A327 WeakPolarHBondContact O-CB 3.46Å; P323-A327 PolarHBondContact O-N 3.35Å; I324-A327 WeakPolarHBondContact O-CB 3.22Å; I324-A327 PolarHBondContact O-N 2.82Å; I324-A327 VanDerWaalsContact O-N 3.16Å; F325-A327 VanDerWaalsContact C-N 3.33Å; A327-S329 PolarHBondContact O-N 3.43Å; A327-T330 PolarHBondContact O-N 3.44Å; A327-T330 PolarHBondContact O-OG1 3.5Å; A327-F331 WeakPolarHBondContact O-CB 3.27Å; A327-F331 PolarHBondContact O-N 3.28Å |
| 328 | L | 88.3 | Confident | 88.3 | Confident | 55 Ų | 55 | 25.1 Ų | 25.1 | 29% | 0.288 | 12% | 0.116 | S | C | . | . | H | α-helix | trans | -58.5 | -33.8 | 174.9 | -61.3 | 174.8 | 0 | 0 | 0 | 110.8 | F197 I324 F325 G332 | F197-L328 HydrophobicContact CD1-CB 3.92Å; F197-L328 WeakPolarHBondContact CD1-O 3.48Å; F197-L328 HydrophobicContact CE1-CB 3.9Å; F197-L328 HydrophobicContact CE1-CD2 3.64Å; F197-L328 HydrophobicContact CE1-CG 4.3Å; F197-L328 HydrophobicContact CZ-CD2 4.5Å; I324-L328 HydrophobicContact CG2-CD1 3.96Å; I324-L328 HydrophobicContact CG2-CG 4.21Å; I324-L328 VanDerWaalsContact O-CG 3.29Å; I324-L328 WeakPolarHBondContact O-CG 3.41Å; I324-L328 PolarHBondContact O-N 2.9Å; F325-L328 PolarHBondContact O-N 3.31Å; L328-G332 PolarHBondContact O-N 3.49Å; L328-G332 VanDerWaalsContact O-N 3.16Å |
| 329 | S | 86.1 | Confident | 88.3 | Confident | 1 Ų | 1 | 19.4 Ų | 19.4 | 1% | 0.007 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -62 | -55 | 174.1 | -176.2 | 0 | 0 | 0 | 0 | 112.2 | I61 K201 F325 V326 A327 F331 G332 G333 | I61-S329 PolarHBondContact O-OG 2.84Å; K201-S329 WeakPolarHBondContact CD-OG 3.27Å; K201-S329 WeakPolarHBondContact CE-O 3.36Å; K201-S329 WeakPolarHBondContact CG-OG 3.37Å; K201-S329 PolarHBondContact NZ-O 2.96Å; F325-S329 WeakPolarHBondContact O-CB 3.24Å; F325-S329 PolarHBondContact O-N 3.28Å; V326-S329 VanDerWaalsContact O-CB 3.27Å; V326-S329 WeakPolarHBondContact O-CB 3.41Å; V326-S329 PolarHBondContact O-N 2.89Å; A327-S329 PolarHBondContact O-N 3.43Å; S329-F331 VanDerWaalsContact C-N 3.29Å; S329-F331 PolarHBondContact O-N 2.9Å; S329-G332 PolarHBondContact O-N 2.99Å; S329-G333 PolarHBondContact O-N 3.11Å |
| 330 | T | 86.7 | Confident | 88.4 | Confident | 1 Ų | 1 | 16.5 Ų | 16.5 | 1% | 0.006 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -66 | -32.9 | -178.3 | 50.6 | 0 | 0 | 0 | 0 | 111.9 | T148 F149 V326 A327 G332 G333 V334 | T148-T330 HydrophobicContact CG2-CG2 3.83Å; F149-T330 WeakPolarHBondContact CA-OG1 3.36Å; F149-T330 VanDerWaalsContact CB-OG1 3.31Å; F149-T330 WeakPolarHBondContact CB-OG1 3.37Å; F149-T330 PolarHBondContact N-OG1 3.26Å; V326-T330 PolarHBondContact O-N 2.88Å; V326-T330 PolarHBondContact O-OG1 3.49Å; A327-T330 PolarHBondContact O-N 3.44Å; A327-T330 PolarHBondContact O-OG1 3.5Å; T330-G332 PolarHBondContact O-N 2.81Å; T330-G333 WeakPolarHBondContact O-CA 3.48Å; T330-G333 PolarHBondContact O-N 3.21Å; T330-G333 VanDerWaalsContact O-N 3.08Å; T330-V334 WeakPolarHBondContact O-CG2 3.48Å; T330-V334 PolarHBondContact O-N 3.28Å |
| 331 | F | 89.2 | Confident | 88.5 | Confident | 20 Ų | 20 | 11 Ų | 11 | 9% | 0.088 | 6% | 0.056 | C | C | . | . | H | α-helix | trans | -58 | -48 | 171.5 | -169.2 | -88.1 | 0 | 0 | 0 | 112.3 | F149 C175 L178 L179 F197 A327 S329 G333 V334 N335 | F149-F331 HydrophobicContact CD2-CB 3.9Å; F149-F331 HydrophobicContact CD2-CD2 4.09Å; F149-F331 HydrophobicContact CD2-CG 4.49Å; F149-F331 HydrophobicContact CE1-CD2 4.34Å; F149-F331 HydrophobicContact CE2-CB 4.16Å; F149-F331 AromaticContact CE2-CD2 3.79Å; F149-F331 HydrophobicContact CE2-CD2 3.79Å; F149-F331 HydrophobicContact CE2-CG 4.37Å; F149-F331 HydrophobicContact CG-CD2 4.47Å; F149-F331 AromaticContact CZ-CD2 3.92Å; F149-F331 HydrophobicContact CZ-CD2 3.92Å; F149-F331 HydrophobicContact CZ-CE2 4.48Å; C175-F331 HydrophobicContact CB-CE2 4.46Å; C175-F331 WeakPolarHBondContact SG-CD2 3.28Å; L178-F331 HydrophobicContact CD2-CE2 4.44Å; L178-F331 HydrophobicContact CD2-CZ 4.1Å; L179-F331 HydrophobicContact CD1-CD1 4.19Å; L179-F331 HydrophobicContact CD1-CD2 4.18Å; L179-F331 HydrophobicContact CD1-CE1 4.06Å; L179-F331 HydrophobicContact CD1-CE2 4.01Å; L179-F331 HydrophobicContact CD1-CG 4.26Å; L179-F331 HydrophobicContact CD1-CZ 3.95Å; L179-F331 WeakPolarHBondContact CD1-O 3.28Å; L179-F331 HydrophobicContact CD2-CD1 4.14Å; L179-F331 HydrophobicContact CD2-CE1 3.37Å; L179-F331 HydrophobicContact CD2-CE2 4.39Å; L179-F331 HydrophobicContact CD2-CZ 3.51Å; L179-F331 HydrophobicContact CG-CE1 3.95Å; L179-F331 HydrophobicContact CG-CE2 4.08Å; L179-F331 HydrophobicContact CG-CZ 3.65Å; F197-F331 HydrophobicContact CD1-CD1 4.41Å; F197-F331 AromaticContact CD2-CD1 3.89Å; F197-F331 HydrophobicContact CD2-CD1 3.89Å; F197-F331 HydrophobicContact CD2-CE1 4.31Å; F197-F331 HydrophobicContact CE1-CB 4.44Å; F197-F331 AromaticContact CE1-CD1 3.88Å; F197-F331 HydrophobicContact CE1-CD1 3.88Å; F197-F331 HydrophobicContact CE1-CG 4.45Å; F197-F331 AromaticContact CE2-CD1 3.34Å; F197-F331 HydrophobicContact CE2-CD1 3.34Å; F197-F331 AromaticContact CE2-CE1 3.49Å; F197-F331 HydrophobicContact CE2-CE1 3.49Å; F197-F331 VanDerWaalsContact CE2-CE1 3.49Å; F197-F331 HydrophobicContact CG-CD1 4.42Å; F197-F331 AromaticContact CZ-CD1 3.34Å; F197-F331 HydrophobicContact CZ-CD1 3.34Å; F197-F331 AromaticContact CZ-CE1 3.67Å; F197-F331 HydrophobicContact CZ-CE1 3.67Å; F197-F331 HydrophobicContact CZ-CG 4.22Å; A327-F331 WeakPolarHBondContact O-CB 3.27Å; A327-F331 PolarHBondContact O-N 3.28Å; S329-F331 VanDerWaalsContact C-N 3.29Å; S329-F331 PolarHBondContact O-N 2.9Å; F331-G333 VanDerWaalsContact C-N 3.29Å; F331-G333 PolarHBondContact O-N 3.12Å; F331-V334 PolarHBondContact O-N 3.2Å; F331-N335 PolarHBondContact O-N 3.42Å; F331-N335 VanDerWaalsContact O-N 3.16Å |
| 332 | G | 88.1 | Confident | 88.6 | Confident | 0 Ų | 0 | 8.9 Ų | 8.9 | 0% | 0 | 5% | 0.045 | C | C | . | . | H | α-helix | trans | -64.3 | -31.6 | 172.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | Q194 L328 S329 T330 N335 G336 | Q194-G332 PolarHBondContact NE2-O 2.9Å; Q194-G332 PolarHBondContact OE1-O 3.23Å; L328-G332 PolarHBondContact O-N 3.49Å; L328-G332 VanDerWaalsContact O-N 3.16Å; S329-G332 PolarHBondContact O-N 2.99Å; T330-G332 PolarHBondContact O-N 2.81Å; G332-N335 PolarHBondContact O-N 2.97Å; G332-G336 PolarHBondContact O-N 3.4Å |
| 333 | G | 87.9 | Confident | 88.6 | Confident | 4 Ų | 4 | 8.9 Ų | 8.9 | 4% | 0.041 | 5% | 0.045 | C | C | . | . | H | α-helix | trans | -64.9 | -46 | 174 | 0 | 0 | 0 | 0 | 0 | 112.2 | S329 T330 F331 N335 G336 T337 | S329-G333 PolarHBondContact O-N 3.11Å; T330-G333 WeakPolarHBondContact O-CA 3.48Å; T330-G333 PolarHBondContact O-N 3.21Å; T330-G333 VanDerWaalsContact O-N 3.08Å; F331-G333 VanDerWaalsContact C-N 3.29Å; F331-G333 PolarHBondContact O-N 3.12Å; G333-N335 VanDerWaalsContact C-N 3.32Å; G333-N335 PolarHBondContact O-N 2.96Å; G333-G336 PolarHBondContact O-N 3.23Å; G333-T337 PolarHBondContact O-N 3.14Å; G333-T337 PolarHBondContact O-OG1 2.93Å; G333-T337 VanDerWaalsContact O-OG1 3.12Å |
| 334 | V | 91.1 | Very high | 88.7 | Confident | 0 Ų | 0 | 8.9 Ų | 8.9 | 0% | 0 | 5% | 0.045 | C | C | . | . | H | α-helix | trans | -56.9 | -45.9 | 174.9 | 173.9 | 0 | 0 | 0 | 0 | 110.9 | V142 M145 L179 T330 F331 G336 T337 V338 | V142-V334 HydrophobicContact CG1-CG1 4.1Å; M145-V334 HydrophobicContact CB-CG2 3.59Å; L179-V334 HydrophobicContact CD1-CB 3.66Å; L179-V334 HydrophobicContact CD1-CG1 3.47Å; L179-V334 VanDerWaalsContact CD1-CG1 3.47Å; T330-V334 WeakPolarHBondContact O-CG2 3.48Å; T330-V334 PolarHBondContact O-N 3.28Å; F331-V334 PolarHBondContact O-N 3.2Å; V334-G336 PolarHBondContact O-N 3.44Å; V334-T337 PolarHBondContact O-N 3.21Å; V334-V338 HydrophobicContact CG1-CG2 4.17Å; V334-V338 WeakPolarHBondContact O-CG2 3.49Å; V334-V338 PolarHBondContact O-N 2.95Å |
| 335 | N | 91.8 | Very high | 88.7 | Confident | 0 Ų | 0 | 6.4 Ų | 6.4 | 0% | 0 | 3% | 0.033 | C | C | . | . | H | α-helix | trans | -59.2 | -47.5 | 179.4 | -179.2 | 63.9 | 0 | 0 | 0 | 111.8 | L179 N183 S190 Q194 F331 G332 G333 T337 V338 M339 | L179-N335 HydrophobicContact CD1-CB 4.14Å; L179-N335 HydrophobicContact CD2-CB 3.78Å; L179-N335 HydrophobicContact CG-CB 4.45Å; N183-N335 PolarHBondContact ND2-OD1 2.92Å; S190-N335 PolarHBondContact O-ND2 3.13Å; S190-N335 PolarHBondContact OG-ND2 3.23Å; S190-N335 PolarHBondContact OG-OD1 3.14Å; Q194-N335 PolarHBondContact OE1-ND2 2.99Å; F331-N335 PolarHBondContact O-N 3.42Å; F331-N335 VanDerWaalsContact O-N 3.16Å; G332-N335 PolarHBondContact O-N 2.97Å; G333-N335 VanDerWaalsContact C-N 3.32Å; G333-N335 PolarHBondContact O-N 2.96Å; N335-T337 PolarHBondContact O-N 3.47Å; N335-V338 PolarHBondContact O-N 2.6Å; N335-M339 VanDerWaalsContact O-CB 3.23Å; N335-M339 WeakPolarHBondContact O-CB 3.46Å; N335-M339 PolarHBondContact O-N 3.47Å |
| 336 | G | 87.3 | Confident | 88.8 | Confident | 1 Ų | 1 | 4.4 Ų | 4.4 | 1% | 0.01 | 2% | 0.024 | C | C | . | . | H | α-helix | trans | -61.4 | -40.8 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | Q194 G332 G333 V334 T340 | Q194-G336 VanDerWaalsContact OE1-N 3.1Å; G332-G336 PolarHBondContact O-N 3.4Å; G333-G336 PolarHBondContact O-N 3.23Å; V334-G336 PolarHBondContact O-N 3.44Å; G336-T340 WeakPolarHBondContact O-CG2 3.38Å; G336-T340 PolarHBondContact O-N 3.07Å; G336-T340 VanDerWaalsContact O-N 3.08Å; G336-T340 PolarHBondContact O-OG1 3.18Å |
| 337 | T | 89.8 | Confident | 88.9 | Confident | 4 Ų | 4 | 4.3 Ų | 4.3 | 3% | 0.025 | 2% | 0.023 | C | C | . | . | H | α-helix | trans | -71.2 | -41.7 | 179 | -52 | 0 | 0 | 0 | 0 | 112.1 | R138 V142 M145 Y254 G333 V334 N335 M339 T340 T341 | R138-T337 HydrophobicContact CB-CG2 4.47Å; V142-T337 HydrophobicContact CG2-CG2 3.54Å; M145-T337 HydrophobicContact CE-CG2 4.22Å; M145-T337 WeakPolarHBondContact CE-OG1 3.28Å; Y254-T337 HydrophobicContact CE2-CG2 4.28Å; Y254-T337 WeakPolarHBondContact CE2-OG1 3.34Å; G333-T337 PolarHBondContact O-N 3.14Å; G333-T337 PolarHBondContact O-OG1 2.93Å; G333-T337 VanDerWaalsContact O-OG1 3.12Å; V334-T337 PolarHBondContact O-N 3.21Å; N335-T337 PolarHBondContact O-N 3.47Å; T337-M339 VanDerWaalsContact C-N 3.33Å; T337-M339 PolarHBondContact O-N 3.02Å; T337-T340 PolarHBondContact O-N 3.2Å; T337-T340 PolarHBondContact O-OG1 3.36Å; T337-T340 VanDerWaalsContact O-OG1 3.13Å; T337-T341 WeakPolarHBondContact O-CB 3.2Å; T337-T341 PolarHBondContact O-N 3.08Å; T337-T341 PolarHBondContact O-OG1 3.29Å |
| 338 | V | 92 | Very high | 89 | Confident | 0 Ų | 0 | 4.3 Ų | 4.3 | 0% | 0 | 2% | 0.023 | C | C | . | . | H | α-helix | trans | -62.9 | -43.1 | 175.3 | 170.9 | 0 | 0 | 0 | 0 | 110.8 | V142 N183 V334 N335 T340 S342 V372 | V142-V338 HydrophobicContact CG1-CG2 4.16Å; V142-V338 HydrophobicContact CG2-CG2 4.08Å; N183-V338 HydrophobicContact CB-CG1 4.34Å; V334-V338 HydrophobicContact CG1-CG2 4.17Å; V334-V338 WeakPolarHBondContact O-CG2 3.49Å; V334-V338 PolarHBondContact O-N 2.95Å; N335-V338 PolarHBondContact O-N 2.6Å; V338-T340 PolarHBondContact O-N 3.05Å; V338-S342 WeakPolarHBondContact O-CB 3.31Å; V338-S342 PolarHBondContact O-N 3.11Å; V338-S342 VanDerWaalsContact O-N 3.14Å; V338-S342 PolarHBondContact O-OG 3.48Å; V338-V372 HydrophobicContact CG1-CG1 4.45Å |
| 339 | M | 88.9 | Confident | 88.9 | Confident | 0 Ų | 0 | 1.8 Ų | 1.8 | 0% | 0 | 1% | 0.01 | C | C | . | . | H | α-helix | trans | -58.6 | -49.3 | 178.6 | -173.5 | 168.8 | 61.3 | 0 | 0 | 111.1 | I55 N183 T191 M258 N335 T337 S342 R343 | I55-M339 HydrophobicContact CD1-CE 3.95Å; I55-M339 HydrophobicContact CG1-CE 3.95Å; N183-M339 VanDerWaalsContact OD1-CA 3.28Å; N183-M339 WeakPolarHBondContact OD1-CA 3.39Å; N183-M339 VanDerWaalsContact OD1-CB 3.3Å; N183-M339 WeakPolarHBondContact OD1-CB 3.42Å; T191-M339 HydrophobicContact CG2-CE 4.34Å; T191-M339 HydrophobicContact CG2-SD 3.89Å; M258-M339 HydrophobicContact CE-CE 3.96Å; M258-M339 HydrophobicContact CE-CG 3.47Å; M258-M339 VanDerWaalsContact CE-CG 3.47Å; M258-M339 HydrophobicContact CE-SD 3.49Å; M258-M339 WeakPolarHBondContact CE-SD 3.46Å; M258-M339 HydrophobicContact SD-CE 3.57Å; M258-M339 VanDerWaalsContact SD-CE 3.57Å; M258-M339 HydrophobicContact SD-CG 3.73Å; M258-M339 HydrophobicContact SD-SD 3.91Å; N335-M339 VanDerWaalsContact O-CB 3.23Å; N335-M339 WeakPolarHBondContact O-CB 3.46Å; N335-M339 PolarHBondContact O-N 3.47Å; T337-M339 VanDerWaalsContact C-N 3.33Å; T337-M339 PolarHBondContact O-N 3.02Å; M339-S342 PolarHBondContact O-OG 3.26Å; M339-R343 WeakPolarHBondContact O-CD 3.49Å; M339-R343 PolarHBondContact O-NH1 3.18Å |
| 340 | T | 89.1 | Confident | 88.9 | Confident | 0 Ų | 0 | 4.9 Ų | 4.9 | 0% | 0 | 2% | 0.024 | C | C | . | . | H | α-helix | trans | -74.6 | -39.6 | -178.1 | 53.4 | 0 | 0 | 0 | 0 | 113.7 | Y254 C257 M258 G336 T337 V338 S342 R343 M344 | Y254-T340 HydrophobicContact CD2-CG2 3.92Å; Y254-T340 HydrophobicContact CG-CG2 4.1Å; Y254-T340 WeakPolarHBondContact O-CG2 3.39Å; C257-T340 HydrophobicContact CB-CG2 4.25Å; M258-T340 HydrophobicContact CG-CG2 4.19Å; M258-T340 HydrophobicContact SD-CG2 4.07Å; G336-T340 WeakPolarHBondContact O-CG2 3.38Å; G336-T340 PolarHBondContact O-N 3.07Å; G336-T340 VanDerWaalsContact O-N 3.08Å; G336-T340 PolarHBondContact O-OG1 3.18Å; T337-T340 PolarHBondContact O-N 3.2Å; T337-T340 PolarHBondContact O-OG1 3.36Å; T337-T340 VanDerWaalsContact O-OG1 3.13Å; V338-T340 PolarHBondContact O-N 3.05Å; T340-S342 PolarHBondContact O-N 3.36Å; T340-R343 PolarHBondContact O-N 2.7Å; T340-M344 PolarHBondContact O-N 3.45Å; T340-M344 VanDerWaalsContact O-N 3.17Å |
| 341 | T | 91.2 | Very high | 88.9 | Confident | 0 Ų | 0 | 6.2 Ų | 6.2 | 0% | 0 | 3% | 0.032 | C | C | . | . | H | α-helix | trans | -64.4 | -40.7 | -178.2 | -56 | 0 | 0 | 0 | 0 | 111.6 | V134 R138 T337 R343 M344 F345 T375 | V134-T341 HydrophobicContact CG1-CG2 3.93Å; R138-T341 HydrophobicContact CB-CG2 3.88Å; R138-T341 WeakPolarHBondContact CB-OG1 3.47Å; T337-T341 WeakPolarHBondContact O-CB 3.2Å; T337-T341 PolarHBondContact O-N 3.08Å; T337-T341 PolarHBondContact O-OG1 3.29Å; T341-R343 VanDerWaalsContact C-N 3.28Å; T341-R343 PolarHBondContact O-N 2.84Å; T341-M344 PolarHBondContact O-N 3.36Å; T341-F345 HydrophobicContact CG2-CD2 4.04Å; T341-F345 HydrophobicContact CG2-CE2 3.67Å; T341-F345 WeakPolarHBondContact O-CD2 3.36Å; T341-F345 PolarHBondContact O-N 2.91Å; T341-F345 VanDerWaalsContact O-N 3.08Å; T341-T375 HydrophobicContact CG2-CG2 3.78Å |
| 342 | S | 90.4 | Very high | 88.7 | Confident | 0 Ų | 0 | 9.9 Ų | 9.9 | 0% | 0 | 5% | 0.053 | C | C | . | . | H | α-helix | trans | -60.2 | -35.6 | 175.4 | 55.1 | 0 | 0 | 0 | 0 | 112.8 | V338 M339 T340 F345 F346 A371 | V338-S342 WeakPolarHBondContact O-CB 3.31Å; V338-S342 PolarHBondContact O-N 3.11Å; V338-S342 VanDerWaalsContact O-N 3.14Å; V338-S342 PolarHBondContact O-OG 3.48Å; M339-S342 PolarHBondContact O-OG 3.26Å; T340-S342 PolarHBondContact O-N 3.36Å; S342-F345 PolarHBondContact O-N 3.38Å; S342-F346 WeakPolarHBondContact O-CB 3.4Å; S342-F346 PolarHBondContact O-N 3.19Å; S342-A371 VanDerWaalsContact O-CB 3.24Å; S342-A371 WeakPolarHBondContact O-CB 3.27Å |
| 343 | R | 87.5 | Confident | 88.7 | Confident | 0 Ų | 0 | 10.4 Ų | 10.4 | 0% | 0 | 6% | 0.055 | C | C | . | . | H | α-helix | trans | -72.6 | -34.9 | 177 | -83.3 | 74.6 | 179.2 | 177.6 | -11.4 | 112.3 | C257 E261 M339 T340 T341 F346 V347 | C257-R343 WeakPolarHBondContact O-CB 3.46Å; E261-R343 IonicContact OE1-CZ 3.6Å; E261-R343 IonicContact OE1-NE 3.14Å; E261-R343 PolarHBondContact OE1-NE 3.22Å; E261-R343 IonicContact OE1-NH2 3.45Å; E261-R343 PolarHBondContact OE1-NH2 3.5Å; E261-R343 VanDerWaalsContact OE1-NH2 3.14Å; E261-R343 IonicContact OE2-NH2 3.44Å; E261-R343 PolarHBondContact OE2-NH2 2.93Å; M339-R343 WeakPolarHBondContact O-CD 3.49Å; M339-R343 PolarHBondContact O-NH1 3.18Å; T340-R343 PolarHBondContact O-N 2.7Å; T341-R343 VanDerWaalsContact C-N 3.28Å; T341-R343 PolarHBondContact O-N 2.84Å; R343-F346 WeakPolarHBondContact O-CB 3.41Å; R343-F346 PolarHBondContact O-N 2.92Å; R343-V347 WeakPolarHBondContact O-CG2 3.47Å; R343-V347 PolarHBondContact O-N 3.12Å |
| 344 | M | 88.3 | Confident | 88.8 | Confident | 0 Ų | 0 | 11.5 Ų | 11.5 | 0% | 0 | 6% | 0.06 | C | C | . | . | H | α-helix | trans | -63.7 | -42.3 | 173.4 | -69.3 | -170.5 | -74.5 | 0 | 0 | 111.7 | V134 R138 C257 T340 T341 F346 V347 A348 | V134-M344 HydrophobicContact CG1-CB 3.8Å; V134-M344 HydrophobicContact CG1-CE 4.3Å; V134-M344 HydrophobicContact CG2-CB 3.95Å; V134-M344 HydrophobicContact CG2-CE 3.9Å; V134-M344 HydrophobicContact CG2-CG 4.44Å; V134-M344 HydrophobicContact CG2-SD 3.65Å; R138-M344 HydrophobicContact CG-CE 4.08Å; R138-M344 VanDerWaalsContact NH1-CE 3.29Å; C257-M344 HydrophobicContact CB-CG 4.25Å; T340-M344 PolarHBondContact O-N 3.45Å; T340-M344 VanDerWaalsContact O-N 3.17Å; T341-M344 PolarHBondContact O-N 3.36Å; M344-F346 VanDerWaalsContact C-N 3.34Å; M344-F346 PolarHBondContact O-N 3.16Å; M344-V347 PolarHBondContact O-N 3.35Å; M344-A348 VanDerWaalsContact O-CB 3.22Å; M344-A348 WeakPolarHBondContact O-CB 3.43Å; M344-A348 PolarHBondContact O-N 2.96Å |
| 345 | F | 90.3 | Very high | 88.6 | Confident | 0 Ų | 0 | 14.2 Ų | 14.2 | 0% | 0 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -63.2 | -39.5 | 172.7 | -76.6 | -54.2 | 0 | 0 | 0 | 112.9 | V134 V135 T341 S342 A348 S349 M354 L358 A371 F374 T375 | V134-F345 HydrophobicContact CB-CE1 4.48Å; V134-F345 HydrophobicContact CG1-CD1 3.97Å; V134-F345 HydrophobicContact CG1-CD2 4.1Å; V134-F345 HydrophobicContact CG1-CE1 3.72Å; V134-F345 HydrophobicContact CG1-CE2 3.9Å; V134-F345 HydrophobicContact CG1-CG 4.14Å; V134-F345 HydrophobicContact CG1-CZ 3.69Å; V134-F345 WeakPolarHBondContact O-CZ 3.35Å; V135-F345 HydrophobicContact CG2-CE1 4.04Å; V135-F345 HydrophobicContact CG2-CZ 4.44Å; T341-F345 HydrophobicContact CG2-CD2 4.04Å; T341-F345 HydrophobicContact CG2-CE2 3.67Å; T341-F345 WeakPolarHBondContact O-CD2 3.36Å; T341-F345 PolarHBondContact O-N 2.91Å; T341-F345 VanDerWaalsContact O-N 3.08Å; S342-F345 PolarHBondContact O-N 3.38Å; F345-A348 PolarHBondContact O-N 3.41Å; F345-S349 WeakPolarHBondContact O-CB 3.38Å; F345-S349 PolarHBondContact O-N 3.07Å; F345-S349 PolarHBondContact O-OG 2.92Å; F345-M354 HydrophobicContact CD1-CG 4.15Å; F345-M354 HydrophobicContact CD1-SD 4.18Å; F345-M354 HydrophobicContact CE1-CE 4.33Å; F345-M354 HydrophobicContact CE1-SD 4.27Å; F345-L358 HydrophobicContact CB-CD1 4.16Å; F345-L358 HydrophobicContact CD1-CD1 4.4Å; F345-L358 HydrophobicContact CG-CD1 4.44Å; F345-A371 HydrophobicContact CB-CB 4.16Å; F345-F374 HydrophobicContact CD1-CD1 4.1Å; F345-F374 HydrophobicContact CD1-CE1 4.05Å; F345-F374 AromaticContact CD2-CD1 3.93Å; F345-F374 HydrophobicContact CD2-CD1 3.93Å; F345-F374 HydrophobicContact CD2-CE1 4.48Å; F345-F374 AromaticContact CE1-CD1 3.96Å; F345-F374 HydrophobicContact CE1-CD1 3.96Å; F345-F374 AromaticContact CE1-CE1 3.56Å; F345-F374 HydrophobicContact CE1-CE1 3.56Å; F345-F374 AromaticContact CE2-CD1 3.75Å; F345-F374 HydrophobicContact CE2-CD1 3.75Å; F345-F374 HydrophobicContact CE2-CE1 4.01Å; F345-F374 HydrophobicContact CG-CD1 4.11Å; F345-F374 AromaticContact CZ-CD1 3.77Å; F345-F374 HydrophobicContact CZ-CD1 3.77Å; F345-F374 AromaticContact CZ-CE1 3.53Å; F345-F374 HydrophobicContact CZ-CE1 3.53Å; F345-T375 WeakPolarHBondContact CD2-OG1 3.43Å |
| 346 | F | 88.4 | Confident | 88.2 | Confident | 4 Ų | 4 | 19.2 Ų | 19.2 | 2% | 0.018 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -59.5 | -51.4 | 175 | 172.4 | -91.9 | 0 | 0 | 0 | 111.7 | L43 S342 R343 M344 A348 S349 Q350 L358 C359 L361 P368 A371 | L43-F346 HydrophobicContact CD1-CD1 4.46Å; L43-F346 HydrophobicContact CD1-CE1 4.16Å; L43-F346 HydrophobicContact CG-CE1 4.47Å; S342-F346 WeakPolarHBondContact O-CB 3.4Å; S342-F346 PolarHBondContact O-N 3.19Å; R343-F346 WeakPolarHBondContact O-CB 3.41Å; R343-F346 PolarHBondContact O-N 2.92Å; M344-F346 VanDerWaalsContact C-N 3.34Å; M344-F346 PolarHBondContact O-N 3.16Å; F346-A348 PolarHBondContact O-N 2.62Å; F346-S349 PolarHBondContact O-N 3.27Å; F346-S349 PolarHBondContact O-OG 3.48Å; F346-Q350 VanDerWaalsContact CE1-NE2 3.29Å; F346-Q350 PolarHBondContact O-N 2.92Å; F346-L358 WeakPolarHBondContact CD2-O 3.27Å; F346-C359 HydrophobicContact CD2-CB 4.37Å; F346-C359 VanDerWaalsContact CE2-C 3.5Å; F346-C359 HydrophobicContact CE2-CB 4.34Å; F346-C359 WeakPolarHBondContact CE2-O 3.15Å; F346-L361 HydrophobicContact CD2-CD2 4.05Å; F346-L361 HydrophobicContact CE2-CD1 4.18Å; F346-L361 HydrophobicContact CE2-CD2 3.47Å; F346-L361 VanDerWaalsContact CE2-CD2 3.47Å; F346-L361 HydrophobicContact CE2-CG 3.69Å; F346-L361 HydrophobicContact CZ-CD1 4.11Å; F346-L361 HydrophobicContact CZ-CD2 4.06Å; F346-L361 HydrophobicContact CZ-CG 4.14Å; F346-P368 HydrophobicContact CB-CB 4.34Å; F346-P368 HydrophobicContact CD2-CB 3.9Å; F346-P368 HydrophobicContact CG-CB 4.37Å; F346-A371 HydrophobicContact CB-CB 4.46Å |
| 347 | V | 87 | Confident | 88 | Confident | 1 Ų | 1 | 19.9 Ų | 19.9 | 1% | 0.006 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -66.7 | -39.9 | 178.9 | 175.5 | 0 | 0 | 0 | 0 | 111.7 | Y114 I115 R343 M344 S349 Q350 V351 | Y114-V347 HydrophobicContact CE1-CG1 4.29Å; I115-V347 HydrophobicContact CD1-CG1 4.2Å; R343-V347 WeakPolarHBondContact O-CG2 3.47Å; R343-V347 PolarHBondContact O-N 3.12Å; M344-V347 PolarHBondContact O-N 3.35Å; V347-S349 PolarHBondContact O-N 3.48Å; V347-Q350 WeakPolarHBondContact O-CB 3.49Å; V347-Q350 PolarHBondContact O-N 3.24Å; V347-V351 PolarHBondContact O-N 2.96Å |
| 348 | A | 89.1 | Confident | 87.8 | Confident | 0 Ų | 0 | 20.1 Ų | 20.1 | 0% | 0 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -62.8 | -31.3 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | Y114 L130 M344 F345 F346 V351 Q353 M354 | Y114-A348 HydrophobicContact CD1-CB 4.47Å; Y114-A348 HydrophobicContact CE1-CB 3.75Å; L130-A348 HydrophobicContact CD1-CB 3.53Å; L130-A348 HydrophobicContact CD2-CB 3.59Å; L130-A348 HydrophobicContact CG-CB 4.22Å; M344-A348 VanDerWaalsContact O-CB 3.22Å; M344-A348 WeakPolarHBondContact O-CB 3.43Å; M344-A348 PolarHBondContact O-N 2.96Å; F345-A348 PolarHBondContact O-N 3.41Å; F346-A348 PolarHBondContact O-N 2.62Å; A348-V351 WeakPolarHBondContact O-CG2 3.49Å; A348-Q353 WeakPolarHBondContact O-CA 3.3Å; A348-Q353 WeakPolarHBondContact O-CB 3.4Å; A348-Q353 PolarHBondContact O-N 3.44Å; A348-M354 HydrophobicContact CB-CB 4.26Å; A348-M354 HydrophobicContact CB-CG 3.83Å; A348-M354 PolarHBondContact O-N 3.43Å |
| 349 | S | 86.8 | Confident | 87.4 | Confident | 1 Ų | 1 | 20.7 Ų | 20.7 | 1% | 0.007 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -77.7 | -27.5 | 176.5 | 48.9 | 0 | 0 | 0 | 0 | 113 | F345 F346 V347 V351 N352 P355 L358 C359 | F345-S349 WeakPolarHBondContact O-CB 3.38Å; F345-S349 PolarHBondContact O-N 3.07Å; F345-S349 PolarHBondContact O-OG 2.92Å; F346-S349 PolarHBondContact O-N 3.27Å; F346-S349 PolarHBondContact O-OG 3.48Å; V347-S349 PolarHBondContact O-N 3.48Å; S349-V351 VanDerWaalsContact C-N 3.29Å; S349-V351 PolarHBondContact O-N 3.46Å; S349-N352 PolarHBondContact O-N 3.33Å; S349-P355 VanDerWaalsContact CB-O 3.26Å; S349-P355 WeakPolarHBondContact CB-O 3.49Å; S349-L358 WeakPolarHBondContact OG-CB 3.33Å; S349-C359 WeakPolarHBondContact OG-CA 3.37Å; S349-C359 VanDerWaalsContact OG-CB 3.3Å; S349-C359 WeakPolarHBondContact OG-CB 3.46Å; S349-C359 PolarHBondContact OG-N 2.86Å |
| 350 | Q | 86.4 | Confident | 87.2 | Confident | 67 Ų | 67 | 21.5 Ų | 21.5 | 31% | 0.313 | 11% | 0.111 | S | C | . | . | H | α-helix | trans | -61.9 | -36.9 | 171.5 | -68.5 | 179.1 | -32.4 | 0 | 0 | 112.1 | F346 V347 N352 C359 S500 | F346-Q350 VanDerWaalsContact CE1-NE2 3.29Å; F346-Q350 PolarHBondContact O-N 2.92Å; V347-Q350 WeakPolarHBondContact O-CB 3.49Å; V347-Q350 PolarHBondContact O-N 3.24Å; Q350-N352 VanDerWaalsContact C-N 3.31Å; Q350-N352 PolarHBondContact O-N 2.7Å; Q350-C359 HydrophobicContact CG-CB 3.66Å; Q350-S500 PolarHBondContact NE2-OG 2.94Å |
| 351 | V | 86.3 | Confident | 86.9 | Confident | 28 Ų | 28 | 21.5 Ų | 21.5 | 17% | 0.17 | 11% | 0.111 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -93.3 | 19.8 | 176.9 | -61.2 | 0 | 0 | 0 | 0 | 113.6 | Y114 Y118 V347 A348 S349 Q353 | Y114-V351 HydrophobicContact CE1-CG2 4.47Å; Y114-V351 WeakPolarHBondContact OH-CG2 3.5Å; Y118-V351 HydrophobicContact CE1-CG1 4.42Å; Y118-V351 HydrophobicContact CE2-CB 4.28Å; Y118-V351 HydrophobicContact CE2-CG2 4.12Å; V347-V351 PolarHBondContact O-N 2.96Å; A348-V351 WeakPolarHBondContact O-CG2 3.49Å; S349-V351 VanDerWaalsContact C-N 3.29Å; S349-V351 PolarHBondContact O-N 3.46Å; V351-Q353 HydrophobicContact CG2-CG 4.23Å; V351-Q353 PolarHBondContact O-N 3.16Å |
| 352 | N | 85.6 | Confident | 86.5 | Confident | 98 Ų | 98 | 22.9 Ų | 22.9 | 52% | 0.524 | 12% | 0.117 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 59.4 | 24.4 | 176.6 | -55.6 | -75.6 | 0 | 0 | 0 | 115.5 | S349 Q350 K356 | S349-N352 PolarHBondContact O-N 3.33Å; Q350-N352 VanDerWaalsContact C-N 3.31Å; Q350-N352 PolarHBondContact O-N 2.7Å; N352-K356 WeakPolarHBondContact OD1-CE 3.22Å |
| 353 | Q | 88 | Confident | 85.8 | Confident | 11 Ų | 11 | 26.6 Ų | 26.6 | 5% | 0.051 | 14% | 0.135 | C | C | . | . | S | Bend | trans | -91.3 | -13.3 | 172.6 | -69.4 | -160.8 | -17.4 | 0 | 0 | 113.5 | Y114 P123 F127 L130 A348 V351 | Y114-Q353 VanDerWaalsContact CZ-OE1 3.29Å; Y114-Q353 VanDerWaalsContact OH-CD 3.28Å; Y114-Q353 PolarHBondContact OH-OE1 3.27Å; P123-Q353 PolarHBondContact O-NE2 3.21Å; F127-Q353 HydrophobicContact CD2-CB 4.06Å; F127-Q353 HydrophobicContact CD2-CG 4.33Å; L130-Q353 HydrophobicContact CD2-CB 3.83Å; A348-Q353 WeakPolarHBondContact O-CA 3.3Å; A348-Q353 WeakPolarHBondContact O-CB 3.4Å; A348-Q353 PolarHBondContact O-N 3.44Å; V351-Q353 HydrophobicContact CG2-CG 4.23Å; V351-Q353 PolarHBondContact O-N 3.16Å |
| 354 | M | 89.8 | Confident | 85.3 | Confident | 27 Ų | 27 | 32.2 Ų | 32.2 | 13% | 0.133 | 17% | 0.166 | C | C | . | . | S | Bend | trans | -129.2 | 163.3 | 171.8 | -76.6 | -69 | 155.7 | 0 | 0 | 109.9 | L130 V135 F345 A348 K356 L358 | L130-M354 HydrophobicContact CD2-CE 3.51Å; L130-M354 HydrophobicContact CD2-CG 3.95Å; L130-M354 HydrophobicContact CG-CE 3.89Å; V135-M354 HydrophobicContact CG2-CE 3.67Å; F345-M354 HydrophobicContact CD1-CG 4.15Å; F345-M354 HydrophobicContact CD1-SD 4.18Å; F345-M354 HydrophobicContact CE1-CE 4.33Å; F345-M354 HydrophobicContact CE1-SD 4.27Å; A348-M354 HydrophobicContact CB-CB 4.26Å; A348-M354 HydrophobicContact CB-CG 3.83Å; A348-M354 PolarHBondContact O-N 3.43Å; M354-K356 PolarHBondContact O-N 3.47Å; M354-L358 HydrophobicContact CB-CD1 4.19Å |
| 355 | P | 85.8 | Confident | 84.7 | Confident | 56 Ų | 56 | 38.2 Ų | 38.2 | 36% | 0.364 | 19% | 0.188 | S | C | . | . | trans | -56.3 | 132.6 | 178.2 | -20.5 | 30.7 | 0 | 0 | 0 | 111.3 | S349 L357 L358 F484 | S349-P355 VanDerWaalsContact CB-O 3.26Å; S349-P355 WeakPolarHBondContact CB-O 3.49Å; P355-L357 PolarHBondContact O-N 2.74Å; P355-L358 PolarHBondContact O-N 3.46Å; P355-F484 HydrophobicContact CB-CE1 4.45Å; P355-F484 HydrophobicContact CB-CE2 4.07Å; P355-F484 HydrophobicContact CB-CZ 3.52Å | ||
| 356 | K | 83.9 | Confident | 84.2 | Confident | 105 Ų | 105 | 40.3 Ų | 40.3 | 46% | 0.457 | 20% | 0.199 | S | C | . | . | G | 310 helix | trans | -53.8 | -26.7 | -175.6 | -69.5 | -172.4 | 175.4 | -173.4 | 0 | 114.1 | N352 M354 L358 C359 F360 | N352-K356 WeakPolarHBondContact OD1-CE 3.22Å; M354-K356 PolarHBondContact O-N 3.47Å; K356-L358 PolarHBondContact O-N 2.91Å; K356-L358 VanDerWaalsContact O-N 3.08Å; K356-C359 PolarHBondContact O-N 2.89Å; K356-C359 VanDerWaalsContact O-N 3.11Å; K356-C359 PolarHBondContact O-SG 3.42Å; K356-F360 WeakPolarHBondContact O-CD1 3.29Å; K356-F360 WeakPolarHBondContact O-CE1 3.49Å |
| 357 | L | 84 | Confident | 84.1 | Confident | 15 Ų | 15 | 40.1 Ų | 40.1 | 8% | 0.079 | 20% | 0.198 | C | C | . | . | G | 310 helix | trans | -53.6 | -29.9 | 175.4 | 177.6 | 62.6 | 0 | 0 | 0 | 113.2 | P355 C359 F360 S370 F487 T488 V491 L497 | P355-L357 PolarHBondContact O-N 2.74Å; L357-C359 VanDerWaalsContact C-N 3.32Å; L357-C359 PolarHBondContact O-N 2.92Å; L357-F360 HydrophobicContact CD1-CD2 3.96Å; L357-F360 HydrophobicContact CD1-CE2 4.27Å; L357-F360 PolarHBondContact O-N 3.02Å; L357-S370 WeakPolarHBondContact O-CB 3.18Å; L357-S370 PolarHBondContact O-OG 3.49Å; L357-F487 HydrophobicContact CD2-CD1 4.23Å; L357-F487 HydrophobicContact CD2-CE1 3.64Å; L357-T488 HydrophobicContact CB-CG2 4.41Å; L357-T488 HydrophobicContact CD1-CG2 4.15Å; L357-V491 HydrophobicContact CD1-CB 3.79Å; L357-V491 HydrophobicContact CD1-CG1 3.69Å; L357-V491 HydrophobicContact CD2-CB 4.12Å; L357-V491 HydrophobicContact CD2-CG1 4.07Å; L357-V491 HydrophobicContact CD2-CG2 4.03Å; L357-V491 HydrophobicContact CG-CG1 4.37Å; L357-L497 HydrophobicContact CD1-CD1 4.38Å |
| 358 | L | 85.6 | Confident | 84.1 | Confident | 9 Ų | 9 | 40.1 Ų | 40.1 | 5% | 0.047 | 20% | 0.197 | C | C | . | . | G | 310 helix | trans | -77 | -14.7 | -176.9 | -53.5 | -174.2 | 0 | 0 | 0 | 113.4 | F345 F346 S349 M354 P355 K356 F360 A371 F374 | F345-L358 HydrophobicContact CB-CD1 4.16Å; F345-L358 HydrophobicContact CD1-CD1 4.4Å; F345-L358 HydrophobicContact CG-CD1 4.44Å; F346-L358 WeakPolarHBondContact CD2-O 3.27Å; S349-L358 WeakPolarHBondContact OG-CB 3.33Å; M354-L358 HydrophobicContact CB-CD1 4.19Å; P355-L358 PolarHBondContact O-N 3.46Å; K356-L358 PolarHBondContact O-N 2.91Å; K356-L358 VanDerWaalsContact O-N 3.08Å; L358-F360 VanDerWaalsContact C-N 3.3Å; L358-A371 HydrophobicContact CB-CB 4.41Å; L358-F374 HydrophobicContact CD1-CB 4.42Å; L358-F374 HydrophobicContact CD1-CD1 3.98Å; L358-F374 HydrophobicContact CD1-CE1 4.43Å; L358-F374 HydrophobicContact CD1-CG 4.09Å; L358-F374 HydrophobicContact CD2-CB 3.81Å; L358-F374 HydrophobicContact CD2-CG 4.2Å |
| 359 | C | 84.2 | Confident | 84.1 | Confident | 12 Ų | 12 | 41 Ų | 41 | 8% | 0.081 | 20% | 0.202 | C | C | . | . | G | 310 helix | trans | -90.9 | 7.7 | 176 | 69.7 | 0 | 0 | 0 | 0 | 112.7 | F346 S349 Q350 K356 L357 S500 | F346-C359 HydrophobicContact CD2-CB 4.37Å; F346-C359 VanDerWaalsContact CE2-C 3.5Å; F346-C359 HydrophobicContact CE2-CB 4.34Å; F346-C359 WeakPolarHBondContact CE2-O 3.15Å; S349-C359 WeakPolarHBondContact OG-CA 3.37Å; S349-C359 VanDerWaalsContact OG-CB 3.3Å; S349-C359 WeakPolarHBondContact OG-CB 3.46Å; S349-C359 PolarHBondContact OG-N 2.86Å; Q350-C359 HydrophobicContact CG-CB 3.66Å; K356-C359 PolarHBondContact O-N 2.89Å; K356-C359 VanDerWaalsContact O-N 3.11Å; K356-C359 PolarHBondContact O-SG 3.42Å; L357-C359 VanDerWaalsContact C-N 3.32Å; L357-C359 PolarHBondContact O-N 2.92Å; C359-S500 WeakPolarHBondContact O-CB 3.07Å; C359-S500 PolarHBondContact O-N 3.28Å; C359-S500 PolarHBondContact O-OG 2.8Å; C359-S500 VanDerWaalsContact O-OG 3.07Å |
| 360 | F | 83.9 | Confident | 84.2 | Confident | 17 Ų | 17 | 41.3 Ų | 41.3 | 8% | 0.075 | 20% | 0.204 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -88.8 | 141.7 | -179.3 | -60.3 | -7.8 | 0 | 0 | 0 | 111.2 | K356 L357 L358 T488 Q492 L497 V498 P499 | K356-F360 WeakPolarHBondContact O-CD1 3.29Å; K356-F360 WeakPolarHBondContact O-CE1 3.49Å; L357-F360 HydrophobicContact CD1-CD2 3.96Å; L357-F360 HydrophobicContact CD1-CE2 4.27Å; L357-F360 PolarHBondContact O-N 3.02Å; L358-F360 VanDerWaalsContact C-N 3.3Å; F360-T488 HydrophobicContact CE2-CG2 3.48Å; F360-T488 VanDerWaalsContact CE2-CG2 3.48Å; F360-T488 HydrophobicContact CZ-CG2 3.96Å; F360-Q492 HydrophobicContact CD2-CG 3.56Å; F360-Q492 VanDerWaalsContact CE2-CD 3.43Å; F360-Q492 HydrophobicContact CE2-CG 3.48Å; F360-Q492 VanDerWaalsContact CE2-CG 3.48Å; F360-L497 HydrophobicContact CB-CB 3.75Å; F360-L497 HydrophobicContact CB-CD1 4.31Å; F360-L497 HydrophobicContact CD2-CB 4.28Å; F360-V498 CarbonylContact C-O 3.42Å; F360-V498 WeakPolarHBondContact CA-O 3.49Å; F360-P499 VanDerWaalsContact CD1-CA 3.48Å; F360-P499 HydrophobicContact CD1-CB 3.91Å; F360-P499 HydrophobicContact CE1-CB 3.73Å |
| 361 | L | 83.5 | Confident | 84.5 | Confident | 0 Ų | 0 | 38.1 Ų | 38.1 | 0% | 0 | 19% | 0.189 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -110.1 | 144.9 | 179.2 | -63 | 175.1 | 0 | 0 | 0 | 110.1 | V41 L43 F346 P368 L497 V498 | V41-L361 HydrophobicContact CG1-CB 3.82Å; V41-L361 HydrophobicContact CG1-CD1 3.83Å; V41-L361 HydrophobicContact CG1-CG 4.42Å; L43-L361 HydrophobicContact CD2-CD1 4.4Å; L43-L361 HydrophobicContact CD2-CD2 3.86Å; F346-L361 HydrophobicContact CD2-CD2 4.05Å; F346-L361 HydrophobicContact CE2-CD1 4.18Å; F346-L361 HydrophobicContact CE2-CD2 3.47Å; F346-L361 VanDerWaalsContact CE2-CD2 3.47Å; F346-L361 HydrophobicContact CE2-CG 3.69Å; F346-L361 HydrophobicContact CZ-CD1 4.11Å; F346-L361 HydrophobicContact CZ-CD2 4.06Å; F346-L361 HydrophobicContact CZ-CG 4.14Å; L361-P368 HydrophobicContact CD2-CB 3.89Å; L361-L497 CarbonylContact O-C 3.02Å; L361-L497 WeakPolarHBondContact O-CA 3.26Å; L361-V498 PolarHBondContact N-O 3.21Å; L361-V498 PolarHBondContact O-N 2.97Å |
| 362 | H | 82.8 | Confident | 84.8 | Confident | 29 Ų | 29 | 36.8 Ų | 36.8 | 13% | 0.134 | 18% | 0.181 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -68.7 | 130.4 | 173.2 | -178.4 | -67.9 | 0 | 0 | 0 | 110.8 | D364 R365 M366 T367 I369 F495 L497 | H362-D364 IonicContact CE1-OD2 2.62Å; H362-D364 PolarHBondContact ND1-N 2.94Å; H362-D364 PolarHBondContact O-N 2.73Å; H362-R365 HydrophobicContact CB-CB 4.23Å; H362-R365 PolarHBondContact ND1-N 3.16Å; H362-R365 PolarHBondContact O-N 3.48Å; H362-M366 WeakPolarHBondContact O-CA 3.23Å; H362-M366 PolarHBondContact O-N 2.93Å; H362-T367 PolarHBondContact N-O 3.41Å; H362-I369 HydrophobicContact CB-CD1 3.7Å; H362-I369 HydrophobicContact CB-CG1 4.13Å; H362-I369 VanDerWaalsContact CD2-CD1 3.42Å; H362-I369 WeakPolarHBondContact CD2-CD1 3.45Å; H362-F495 PolarHBondContact CD2-O 2.86Å; H362-L497 HydrophobicContact CB-CD2 4.13Å |
| 363 | M | 74 | Confident | 85.1 | Confident | 78 Ų | 78 | 34.7 Ų | 34.7 | 38% | 0.384 | 17% | 0.172 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -52.3 | -48.5 | -173.1 | -70 | -146.4 | -65 | 0 | 0 | 114.4 | V17 K496 V498 | V17-M363 HydrophobicContact CG2-CE 4.41Å; V17-M363 HydrophobicContact CG2-SD 4.11Å; M363-K496 WeakPolarHBondContact CG-O 3.48Å; M363-K496 PolarHBondContact N-O 3.24Å; M363-V498 HydrophobicContact CG-CB 4.31Å; M363-V498 HydrophobicContact CG-CG2 3.34Å; M363-V498 HydrophobicContact SD-CG2 3.46Å; M363-V498 WeakPolarHBondContact SD-CG2 3.42Å |
| 364 | D | 77.5 | Confident | 85.4 | Confident | 119 Ų | 119 | 37.3 Ų | 37.3 | 64% | 0.636 | 18% | 0.183 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -88.1 | -24.1 | -174.3 | -51.3 | -44.4 | 0 | 0 | 0 | 114 | H362 | H362-D364 IonicContact CE1-OD2 2.62Å; H362-D364 PolarHBondContact ND1-N 2.94Å; H362-D364 PolarHBondContact O-N 2.73Å |
| 365 | R | 76.3 | Confident | 85.5 | Confident | 126 Ų | 126 | 36 Ų | 36 | 48% | 0.475 | 18% | 0.177 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -105.6 | -20.1 | -168.9 | -63.3 | -64.4 | -169.9 | -169.5 | 1.4 | 112.5 | F185 H362 T367 | F185-R365 VanDerWaalsContact CZ-NH2 3.29Å; F185-R365 WeakPolarHBondContact O-CD 3.26Å; H362-R365 HydrophobicContact CB-CB 4.23Å; H362-R365 PolarHBondContact ND1-N 3.16Å; H362-R365 PolarHBondContact O-N 3.48Å; R365-T367 HydrophobicContact CB-CG2 4.19Å; R365-T367 WeakPolarHBondContact CB-OG1 3.43Å; R365-T367 PolarHBondContact O-N 3.21Å |
| 366 | M | 80.2 | Confident | 86 | Confident | 44 Ų | 44 | 34 Ų | 34 | 22% | 0.217 | 16% | 0.164 | C | C | . | . | trans | 56.4 | 27.5 | -175.4 | -46.6 | -63.4 | -78.9 | 0 | 0 | 112.5 | V41 Q42 H362 | V41-M366 HydrophobicContact CB-CE 3.96Å; V41-M366 HydrophobicContact CG1-CE 3.34Å; V41-M366 HydrophobicContact CG1-SD 3.71Å; Q42-M366 WeakPolarHBondContact O-CE 3.46Å; H362-M366 WeakPolarHBondContact O-CA 3.23Å; H362-M366 PolarHBondContact O-N 2.93Å | ||
| 367 | T | 85.1 | Confident | 86.5 | Confident | 0 Ų | 0 | 33.6 Ų | 33.6 | 0% | 0 | 17% | 0.166 | C | C | . | . | trans | -100.8 | 142.5 | -179.8 | 49.1 | 0 | 0 | 0 | 0 | 110.6 | A184 V187 H362 R365 I369 | A184-T367 WeakPolarHBondContact O-CB 3.39Å; A184-T367 PolarHBondContact O-OG1 3.4Å; V187-T367 HydrophobicContact CG2-CG2 3.69Å; H362-T367 PolarHBondContact N-O 3.41Å; R365-T367 HydrophobicContact CB-CG2 4.19Å; R365-T367 WeakPolarHBondContact CB-OG1 3.43Å; R365-T367 PolarHBondContact O-N 3.21Å; T367-I369 VanDerWaalsContact C-N 3.28Å; T367-I369 PolarHBondContact O-N 2.94Å | ||
| 368 | P | 86.6 | Confident | 87 | Confident | 0 Ų | 0 | 33.9 Ų | 33.9 | 0% | 0 | 17% | 0.168 | C | C | . | . | trans | -82.6 | 69.2 | 177.8 | 34.1 | -35.7 | 0 | 0 | 0 | 111.2 | F346 L361 S370 A371 V372 | F346-P368 HydrophobicContact CB-CB 4.34Å; F346-P368 HydrophobicContact CD2-CB 3.9Å; F346-P368 HydrophobicContact CG-CB 4.37Å; L361-P368 HydrophobicContact CD2-CB 3.89Å; P368-S370 VanDerWaalsContact C-N 3.32Å; P368-S370 PolarHBondContact O-N 3.31Å; P368-A371 HydrophobicContact CB-CB 4.13Å; P368-A371 PolarHBondContact O-N 3.21Å; P368-V372 WeakPolarHBondContact O-CG2 3.29Å; P368-V372 PolarHBondContact O-N 3.2Å | ||
| 369 | I | 89.9 | Confident | 87.4 | Confident | 19 Ų | 19 | 33.4 Ų | 33.4 | 10% | 0.097 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -57 | -43.4 | -173.5 | -62.3 | -177.2 | 0 | 0 | 0 | 111.9 | A184 H362 T367 A371 V372 V373 F495 L497 | A184-I369 HydrophobicContact CB-CG1 4.2Å; A184-I369 HydrophobicContact CB-CG2 4.2Å; H362-I369 HydrophobicContact CB-CD1 3.7Å; H362-I369 HydrophobicContact CB-CG1 4.13Å; H362-I369 VanDerWaalsContact CD2-CD1 3.42Å; H362-I369 WeakPolarHBondContact CD2-CD1 3.45Å; T367-I369 VanDerWaalsContact C-N 3.28Å; T367-I369 PolarHBondContact O-N 2.94Å; I369-A371 VanDerWaalsContact C-N 3.35Å; I369-A371 PolarHBondContact O-N 3.48Å; I369-V372 PolarHBondContact O-N 3.47Å; I369-V373 HydrophobicContact CG2-CG2 4.15Å; I369-V373 VanDerWaalsContact O-CG2 3.31Å; I369-V373 WeakPolarHBondContact O-CG2 3.34Å; I369-V373 PolarHBondContact O-N 3.5Å; I369-F495 HydrophobicContact CG2-CD1 4.38Å; I369-F495 HydrophobicContact CG2-CD2 4.46Å; I369-F495 HydrophobicContact CG2-CG 4.27Å; I369-L497 HydrophobicContact CB-CD2 4.26Å |
| 370 | S | 89.9 | Confident | 88 | Confident | 7 Ų | 7 | 34.8 Ų | 34.8 | 5% | 0.049 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -62.3 | -40.8 | -179.6 | 51.4 | 0 | 0 | 0 | 0 | 112.3 | L357 P368 V373 F374 | L357-S370 WeakPolarHBondContact O-CB 3.18Å; L357-S370 PolarHBondContact O-OG 3.49Å; P368-S370 VanDerWaalsContact C-N 3.32Å; P368-S370 PolarHBondContact O-N 3.31Å; S370-V373 PolarHBondContact O-N 3.05Å; S370-F374 WeakPolarHBondContact O-CB 3.47Å; S370-F374 PolarHBondContact O-N 3.38Å |
| 371 | A | 91.3 | Very high | 88.5 | Confident | 0 Ų | 0 | 37.5 Ų | 37.5 | 0% | 0 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -67.9 | -36.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | S342 F345 F346 L358 P368 I369 F374 T375 | S342-A371 VanDerWaalsContact O-CB 3.24Å; S342-A371 WeakPolarHBondContact O-CB 3.27Å; F345-A371 HydrophobicContact CB-CB 4.16Å; F346-A371 HydrophobicContact CB-CB 4.46Å; L358-A371 HydrophobicContact CB-CB 4.41Å; P368-A371 HydrophobicContact CB-CB 4.13Å; P368-A371 PolarHBondContact O-N 3.21Å; I369-A371 VanDerWaalsContact C-N 3.35Å; I369-A371 PolarHBondContact O-N 3.48Å; A371-F374 PolarHBondContact O-N 3.22Å; A371-T375 WeakPolarHBondContact O-CB 3.22Å; A371-T375 PolarHBondContact O-N 3.33Å; A371-T375 PolarHBondContact O-OG1 2.98Å |
| 372 | V | 92.5 | Very high | 88.9 | Confident | 1 Ų | 1 | 39.7 Ų | 39.7 | 1% | 0.006 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -66.1 | -45.9 | 174.3 | 176.4 | 0 | 0 | 0 | 0 | 111 | S180 N183 A184 V338 P368 I369 F374 T375 C376 | S180-V372 WeakPolarHBondContact O-CG1 3.21Å; N183-V372 HydrophobicContact CB-CG1 3.92Å; N183-V372 HydrophobicContact CB-CG2 4.24Å; A184-V372 HydrophobicContact CB-CB 4.43Å; A184-V372 HydrophobicContact CB-CG1 4.13Å; V338-V372 HydrophobicContact CG1-CG1 4.45Å; P368-V372 WeakPolarHBondContact O-CG2 3.29Å; P368-V372 PolarHBondContact O-N 3.2Å; I369-V372 PolarHBondContact O-N 3.47Å; V372-F374 VanDerWaalsContact C-N 3.32Å; V372-F374 PolarHBondContact O-N 2.87Å; V372-T375 WeakPolarHBondContact O-CB 3.21Å; V372-T375 PolarHBondContact O-N 2.8Å; V372-C376 WeakPolarHBondContact O-CB 3.44Å; V372-C376 PolarHBondContact O-N 3.33Å |
| 373 | V | 93.1 | Very high | 89.3 | Confident | 54 Ų | 54 | 38.6 Ų | 38.6 | 33% | 0.327 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -61 | -42.8 | 176.3 | 170.4 | 0 | 0 | 0 | 0 | 110.8 | I369 S370 C376 I377 | I369-V373 HydrophobicContact CG2-CG2 4.15Å; I369-V373 VanDerWaalsContact O-CG2 3.31Å; I369-V373 WeakPolarHBondContact O-CG2 3.34Å; I369-V373 PolarHBondContact O-N 3.5Å; S370-V373 PolarHBondContact O-N 3.05Å; V373-C376 WeakPolarHBondContact O-CB 3.22Å; V373-C376 PolarHBondContact O-N 2.98Å; V373-I377 HydrophobicContact CG1-CD1 3.77Å; V373-I377 HydrophobicContact CG1-CG1 4.42Å; V373-I377 VanDerWaalsContact O-CG1 3.32Å; V373-I377 WeakPolarHBondContact O-CG1 3.35Å; V373-I377 PolarHBondContact O-N 3.33Å |
| 374 | F | 93.2 | Very high | 90 | Very high | 66 Ų | 66 | 42.2 Ų | 42.2 | 29% | 0.289 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -60.6 | -47.7 | 175.8 | -173.6 | -103.5 | 0 | 0 | 0 | 111.7 | F345 L358 S370 A371 V372 C376 I377 T378 | F345-F374 HydrophobicContact CD1-CD1 4.1Å; F345-F374 HydrophobicContact CD1-CE1 4.05Å; F345-F374 AromaticContact CD2-CD1 3.93Å; F345-F374 HydrophobicContact CD2-CD1 3.93Å; F345-F374 HydrophobicContact CD2-CE1 4.48Å; F345-F374 AromaticContact CE1-CD1 3.96Å; F345-F374 HydrophobicContact CE1-CD1 3.96Å; F345-F374 AromaticContact CE1-CE1 3.56Å; F345-F374 HydrophobicContact CE1-CE1 3.56Å; F345-F374 AromaticContact CE2-CD1 3.75Å; F345-F374 HydrophobicContact CE2-CD1 3.75Å; F345-F374 HydrophobicContact CE2-CE1 4.01Å; F345-F374 HydrophobicContact CG-CD1 4.11Å; F345-F374 AromaticContact CZ-CD1 3.77Å; F345-F374 HydrophobicContact CZ-CD1 3.77Å; F345-F374 AromaticContact CZ-CE1 3.53Å; F345-F374 HydrophobicContact CZ-CE1 3.53Å; L358-F374 HydrophobicContact CD1-CB 4.42Å; L358-F374 HydrophobicContact CD1-CD1 3.98Å; L358-F374 HydrophobicContact CD1-CE1 4.43Å; L358-F374 HydrophobicContact CD1-CG 4.09Å; L358-F374 HydrophobicContact CD2-CB 3.81Å; L358-F374 HydrophobicContact CD2-CG 4.2Å; S370-F374 WeakPolarHBondContact O-CB 3.47Å; S370-F374 PolarHBondContact O-N 3.38Å; A371-F374 PolarHBondContact O-N 3.22Å; V372-F374 VanDerWaalsContact C-N 3.32Å; V372-F374 PolarHBondContact O-N 2.87Å; F374-C376 VanDerWaalsContact C-N 3.29Å; F374-C376 PolarHBondContact O-N 2.9Å; F374-I377 PolarHBondContact O-N 2.82Å; F374-T378 HydrophobicContact CD1-CG2 4.2Å; F374-T378 HydrophobicContact CE1-CG2 3.79Å; F374-T378 HydrophobicContact CE2-CG2 4.18Å; F374-T378 HydrophobicContact CZ-CG2 3.78Å; F374-T378 WeakPolarHBondContact O-CG2 3.38Å; F374-T378 PolarHBondContact O-N 3.41Å; F374-T378 PolarHBondContact O-OG1 2.86Å; F374-T378 VanDerWaalsContact O-OG1 3.11Å |
| 375 | T | 93.2 | Very high | 90.5 | Very high | 0 Ų | 0 | 39.5 Ų | 39.5 | 0% | 0 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -58 | -41.5 | 175.8 | -54.9 | 0 | 0 | 0 | 0 | 111.8 | T341 F345 A371 V372 T378 S379 | T341-T375 HydrophobicContact CG2-CG2 3.78Å; F345-T375 WeakPolarHBondContact CD2-OG1 3.43Å; A371-T375 WeakPolarHBondContact O-CB 3.22Å; A371-T375 PolarHBondContact O-N 3.33Å; A371-T375 PolarHBondContact O-OG1 2.98Å; V372-T375 WeakPolarHBondContact O-CB 3.21Å; V372-T375 PolarHBondContact O-N 2.8Å; T375-T378 WeakPolarHBondContact CA-OG1 3.35Å; T375-T378 PolarHBondContact O-OG1 3.47Å; T375-S379 VanDerWaalsContact O-CB 3.3Å; T375-S379 WeakPolarHBondContact O-CB 3.33Å; T375-S379 PolarHBondContact O-N 3.39Å; T375-S379 PolarHBondContact O-OG 3.39Å |
| 376 | C | 95.4 | Very high | 90.4 | Very high | 14 Ų | 14 | 36.9 Ų | 36.9 | 10% | 0.095 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -61.9 | -50.6 | 176.9 | -176 | 0 | 0 | 0 | 0 | 111.1 | S180 V372 V373 F374 S379 I380 | S180-C376 WeakPolarHBondContact OG-CB 3.2Å; V372-C376 WeakPolarHBondContact O-CB 3.44Å; V372-C376 PolarHBondContact O-N 3.33Å; V373-C376 WeakPolarHBondContact O-CB 3.22Å; V373-C376 PolarHBondContact O-N 2.98Å; F374-C376 VanDerWaalsContact C-N 3.29Å; F374-C376 PolarHBondContact O-N 2.9Å; C376-S379 PolarHBondContact O-N 3.1Å; C376-I380 VanDerWaalsContact O-CG1 3.3Å; C376-I380 WeakPolarHBondContact O-CG1 3.36Å; C376-I380 PolarHBondContact O-N 2.96Å |
| 377 | I | 95.3 | Very high | 90.4 | Very high | 95 Ų | 95 | 38.9 Ų | 38.9 | 49% | 0.487 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -61.8 | -49.3 | -179.2 | -68.1 | 167.1 | 0 | 0 | 0 | 110.3 | V373 F374 S379 I380 C381 | V373-I377 HydrophobicContact CG1-CD1 3.77Å; V373-I377 HydrophobicContact CG1-CG1 4.42Å; V373-I377 VanDerWaalsContact O-CG1 3.32Å; V373-I377 WeakPolarHBondContact O-CG1 3.35Å; V373-I377 PolarHBondContact O-N 3.33Å; F374-I377 PolarHBondContact O-N 2.82Å; I377-S379 VanDerWaalsContact C-N 3.29Å; I377-S379 PolarHBondContact O-N 3.4Å; I377-I380 PolarHBondContact O-N 2.96Å; I377-C381 PolarHBondContact O-N 2.87Å; I377-C381 PolarHBondContact O-SG 3.3Å |
| 378 | T | 93.7 | Very high | 89.8 | Confident | 21 Ų | 21 | 39.5 Ų | 39.5 | 13% | 0.129 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -59.8 | -42.7 | 179.5 | 53.4 | 0 | 0 | 0 | 0 | 111.1 | F374 T375 I380 C381 Y382 | F374-T378 HydrophobicContact CD1-CG2 4.2Å; F374-T378 HydrophobicContact CE1-CG2 3.79Å; F374-T378 HydrophobicContact CE2-CG2 4.18Å; F374-T378 HydrophobicContact CZ-CG2 3.78Å; F374-T378 WeakPolarHBondContact O-CG2 3.38Å; F374-T378 PolarHBondContact O-N 3.41Å; F374-T378 PolarHBondContact O-OG1 2.86Å; F374-T378 VanDerWaalsContact O-OG1 3.11Å; T375-T378 WeakPolarHBondContact CA-OG1 3.35Å; T375-T378 PolarHBondContact O-OG1 3.47Å; T378-I380 PolarHBondContact O-N 3.35Å; T378-C381 WeakPolarHBondContact O-CB 3.19Å; T378-C381 PolarHBondContact O-N 3.11Å; T378-Y382 VanDerWaalsContact O-CD2 3.25Å; T378-Y382 WeakPolarHBondContact O-CD2 3.23Å; T378-Y382 PolarHBondContact O-N 2.83Å; T378-Y382 VanDerWaalsContact O-N 3.16Å |
| 379 | S | 94.8 | Very high | 89.2 | Confident | 0 Ų | 0 | 44.8 Ų | 44.8 | 0% | 0 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -66.7 | -37.9 | 179.5 | -53 | 0 | 0 | 0 | 0 | 112.5 | T375 C376 I377 Y382 L383 | T375-S379 VanDerWaalsContact O-CB 3.3Å; T375-S379 WeakPolarHBondContact O-CB 3.33Å; T375-S379 PolarHBondContact O-N 3.39Å; T375-S379 PolarHBondContact O-OG 3.39Å; C376-S379 PolarHBondContact O-N 3.1Å; I377-S379 VanDerWaalsContact C-N 3.29Å; I377-S379 PolarHBondContact O-N 3.4Å; S379-Y382 PolarHBondContact O-N 3.05Å; S379-L383 PolarHBondContact O-N 3.35Å |
| 380 | I | 95.5 | Very high | 88.6 | Confident | 40 Ų | 40 | 45.4 Ų | 45.4 | 21% | 0.205 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -65.1 | -40.8 | 173.6 | -70.4 | 168 | 0 | 0 | 0 | 110.8 | I176 I177 C376 I377 T378 Y382 L383 F384 | I176-I380 HydrophobicContact CG2-CG1 4.21Å; I177-I380 HydrophobicContact CD1-CD1 4.14Å; I177-I380 HydrophobicContact CG1-CD1 3.78Å; C376-I380 VanDerWaalsContact O-CG1 3.3Å; C376-I380 WeakPolarHBondContact O-CG1 3.36Å; C376-I380 PolarHBondContact O-N 2.96Å; I377-I380 PolarHBondContact O-N 2.96Å; T378-I380 PolarHBondContact O-N 3.35Å; I380-Y382 PolarHBondContact O-N 3.11Å; I380-L383 WeakPolarHBondContact O-CB 3.36Å; I380-L383 PolarHBondContact O-N 2.79Å; I380-F384 HydrophobicContact CG2-CE2 4.01Å; I380-F384 VanDerWaalsContact O-CD2 3.29Å; I380-F384 WeakPolarHBondContact O-CD2 3.28Å; I380-F384 WeakPolarHBondContact O-CE2 3.46Å |
| 381 | C | 94.6 | Very high | 88 | Confident | 74 Ų | 74 | 46.5 Ų | 46.5 | 50% | 0.5 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -57.6 | -38.2 | 174.8 | -69 | 0 | 0 | 0 | 0 | 111.8 | I377 T378 L383 F384 | I377-C381 PolarHBondContact O-N 2.87Å; I377-C381 PolarHBondContact O-SG 3.3Å; T378-C381 WeakPolarHBondContact O-CB 3.19Å; T378-C381 PolarHBondContact O-N 3.11Å; C381-L383 VanDerWaalsContact C-N 3.28Å; C381-L383 PolarHBondContact O-N 2.84Å; C381-F384 PolarHBondContact O-N 3.21Å |
| 382 | Y | 92 | Very high | 87.1 | Confident | 47 Ų | 47 | 48 Ų | 48 | 18% | 0.184 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -65.3 | -26.2 | 175.9 | -86 | -79.9 | 0 | 0 | 0 | 113.5 | P139 A140 T378 S379 I380 F384 V385 I388 L391 | P139-Y382 HydrophobicContact CB-CD2 3.52Å; P139-Y382 HydrophobicContact CB-CE2 3.74Å; P139-Y382 HydrophobicContact CG-CE2 4.47Å; A140-Y382 HydrophobicContact CB-CD1 4.07Å; A140-Y382 HydrophobicContact CB-CE1 4.25Å; A140-Y382 HydrophobicContact CB-CG 4.46Å; T378-Y382 VanDerWaalsContact O-CD2 3.25Å; T378-Y382 WeakPolarHBondContact O-CD2 3.23Å; T378-Y382 PolarHBondContact O-N 2.83Å; T378-Y382 VanDerWaalsContact O-N 3.16Å; S379-Y382 PolarHBondContact O-N 3.05Å; I380-Y382 PolarHBondContact O-N 3.11Å; Y382-F384 PolarHBondContact O-N 3.24Å; Y382-F384 VanDerWaalsContact O-N 3.14Å; Y382-V385 HydrophobicContact CD1-CG2 4.14Å; Y382-V385 WeakPolarHBondContact O-CB 3.37Å; Y382-V385 PolarHBondContact O-N 3.24Å; Y382-I388 WeakPolarHBondContact O-CD1 3.43Å; Y382-L391 HydrophobicContact CD1-CD2 4.14Å; Y382-L391 HydrophobicContact CE1-CD2 3.54Å |
| 383 | L | 91.3 | Very high | 86.3 | Confident | 6 Ų | 6 | 52.7 Ų | 52.7 | 3% | 0.031 | 29% | 0.292 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -63 | -18.3 | 174.7 | -65.4 | 177.2 | 0 | 0 | 0 | 113.8 | A143 M147 A172 A173 I176 S379 I380 C381 | A143-L383 HydrophobicContact CB-CD2 3.85Å; A143-L383 HydrophobicContact CB-CG 4.37Å; M147-L383 HydrophobicContact CG-CD2 3.68Å; M147-L383 HydrophobicContact SD-CD2 3.93Å; A172-L383 HydrophobicContact CB-CD1 4.25Å; A172-L383 HydrophobicContact CB-CD2 4.02Å; A173-L383 HydrophobicContact CB-CD1 3.82Å; I176-L383 HydrophobicContact CD1-CD1 4Å; I176-L383 HydrophobicContact CD1-CG 4.3Å; S379-L383 PolarHBondContact O-N 3.35Å; I380-L383 WeakPolarHBondContact O-CB 3.36Å; I380-L383 PolarHBondContact O-N 2.79Å; C381-L383 VanDerWaalsContact C-N 3.28Å; C381-L383 PolarHBondContact O-N 2.84Å |
| 384 | F | 89.5 | Confident | 85.6 | Confident | 154 Ų | 154 | 53.4 Ų | 53.4 | 68% | 0.675 | 29% | 0.289 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.8 | -7.8 | 176.1 | -60.7 | -81.3 | 0 | 0 | 0 | 113.2 | I380 C381 Y382 | I380-F384 HydrophobicContact CG2-CE2 4.01Å; I380-F384 VanDerWaalsContact O-CD2 3.29Å; I380-F384 WeakPolarHBondContact O-CD2 3.28Å; I380-F384 WeakPolarHBondContact O-CE2 3.46Å; C381-F384 PolarHBondContact O-N 3.21Å; Y382-F384 PolarHBondContact O-N 3.24Å; Y382-F384 VanDerWaalsContact O-N 3.14Å |
| 385 | V | 86.4 | Confident | 84.8 | Confident | 62 Ų | 62 | 50.6 Ų | 50.6 | 38% | 0.376 | 28% | 0.277 | S | S | . | . | trans | -79.7 | 124.5 | 176.6 | 178.2 | 0 | 0 | 0 | 0 | 108.3 | Y382 D387 I388 | Y382-V385 HydrophobicContact CD1-CG2 4.14Å; Y382-V385 WeakPolarHBondContact O-CB 3.37Å; Y382-V385 PolarHBondContact O-N 3.24Å; V385-D387 PolarHBondContact O-N 3.13Å; V385-I388 HydrophobicContact CB-CG1 4.16Å; V385-I388 HydrophobicContact CG1-CG1 4.47Å; V385-I388 WeakPolarHBondContact O-CG1 3.17Å | ||
| 386 | G | 74.6 | Confident | 84 | Confident | 70 Ų | 70 | 51.5 Ų | 51.5 | 72% | 0.722 | 29% | 0.287 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.1 | -35.6 | -171.7 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||
| 387 | D | 80.5 | Confident | 83.1 | Confident | 87 Ų | 87 | 51.5 Ų | 51.5 | 47% | 0.465 | 29% | 0.285 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -122.6 | 64.4 | -174.9 | -166.6 | 3.5 | 0 | 0 | 0 | 112.8 | V385 Y389 S390 L391 | V385-D387 PolarHBondContact O-N 3.13Å; D387-Y389 VanDerWaalsContact C-N 3.3Å; D387-S390 VanDerWaalsContact OD1-CB 3.25Å; D387-S390 WeakPolarHBondContact OD1-CB 3.26Å; D387-S390 PolarHBondContact OD1-N 3.38Å; D387-S390 PolarHBondContact OD1-OG 3.33Å; D387-S390 WeakPolarHBondContact OD2-CB 3.5Å; D387-S390 PolarHBondContact OD2-OG 3.24Å; D387-L391 PolarHBondContact O-N 2.92Å |
| 388 | I | 72.3 | Confident | 82.3 | Confident | 13 Ų | 13 | 47.2 Ų | 47.2 | 7% | 0.067 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -68.5 | -33.1 | 178.7 | -40.7 | 174.9 | 0 | 0 | 0 | 110.8 | A140 A143 I144 Y382 V385 L391 I392 | A140-I388 HydrophobicContact CB-CG2 3.89Å; A143-I388 HydrophobicContact CB-CD1 3.98Å; I144-I388 HydrophobicContact CD1-CB 4.22Å; I144-I388 HydrophobicContact CD1-CG2 3.91Å; I144-I388 WeakPolarHBondContact CD1-O 3.28Å; I144-I388 HydrophobicContact CG1-CB 3.97Å; I144-I388 HydrophobicContact CG1-CG2 3.54Å; Y382-I388 WeakPolarHBondContact O-CD1 3.43Å; V385-I388 HydrophobicContact CB-CG1 4.16Å; V385-I388 HydrophobicContact CG1-CG1 4.47Å; V385-I388 WeakPolarHBondContact O-CG1 3.17Å; I388-L391 WeakPolarHBondContact O-CB 3.39Å; I388-L391 PolarHBondContact O-N 3.46Å; I388-I392 PolarHBondContact O-N 3.22Å; I388-I392 VanDerWaalsContact O-N 3.08Å |
| 389 | Y | 74.2 | Confident | 81.8 | Confident | 111 Ų | 111 | 47.5 Ų | 47.5 | 44% | 0.435 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -64.4 | -48.5 | -178.6 | -73.5 | -86.4 | 0 | 0 | 0 | 111.3 | I144 D387 L391 I392 T393 | I144-Y389 HydrophobicContact CD1-CD1 3.79Å; I144-Y389 HydrophobicContact CD1-CE1 4.16Å; I144-Y389 HydrophobicContact CD1-CG 3.99Å; I144-Y389 HydrophobicContact CG2-CD1 4.12Å; I144-Y389 HydrophobicContact CG2-CE1 3.49Å; I144-Y389 VanDerWaalsContact CG2-CE1 3.49Å; D387-Y389 VanDerWaalsContact C-N 3.3Å; Y389-L391 VanDerWaalsContact C-N 3.28Å; Y389-L391 PolarHBondContact O-N 3.12Å; Y389-I392 PolarHBondContact O-N 3.46Å; Y389-T393 PolarHBondContact O-N 3.46Å; Y389-T393 PolarHBondContact O-OG1 2.88Å; Y389-T393 VanDerWaalsContact O-OG1 3.1Å |
| 390 | S | 76.7 | Confident | 81.3 | Confident | 32 Ų | 32 | 47.8 Ų | 47.8 | 22% | 0.224 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -63 | -36.9 | 174.8 | -58.5 | 0 | 0 | 0 | 0 | 112 | D387 I392 T393 Y394 | D387-S390 VanDerWaalsContact OD1-CB 3.25Å; D387-S390 WeakPolarHBondContact OD1-CB 3.26Å; D387-S390 PolarHBondContact OD1-N 3.38Å; D387-S390 PolarHBondContact OD1-OG 3.33Å; D387-S390 WeakPolarHBondContact OD2-CB 3.5Å; D387-S390 PolarHBondContact OD2-OG 3.24Å; S390-I392 VanDerWaalsContact C-N 3.33Å; S390-I392 PolarHBondContact O-N 2.86Å; S390-T393 WeakPolarHBondContact O-CB 3.4Å; S390-T393 PolarHBondContact O-N 3.47Å; S390-T393 VanDerWaalsContact O-N 3.12Å; S390-Y394 WeakPolarHBondContact O-CD2 3.46Å; S390-Y394 PolarHBondContact O-N 3.3Å |
| 391 | L | 77.8 | Confident | 80.8 | Confident | 29 Ų | 29 | 48.8 Ų | 48.8 | 15% | 0.152 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -57.2 | -45.2 | 176 | 179.9 | 67.2 | 0 | 0 | 0 | 112 | V136 A140 Y382 D387 I388 Y389 Y394 L395 I459 | V136-L391 HydrophobicContact CG1-CD1 4.37Å; V136-L391 HydrophobicContact CG1-CD2 4.25Å; A140-L391 HydrophobicContact CB-CD2 4.1Å; Y382-L391 HydrophobicContact CD1-CD2 4.14Å; Y382-L391 HydrophobicContact CE1-CD2 3.54Å; D387-L391 PolarHBondContact O-N 2.92Å; I388-L391 WeakPolarHBondContact O-CB 3.39Å; I388-L391 PolarHBondContact O-N 3.46Å; Y389-L391 VanDerWaalsContact C-N 3.28Å; Y389-L391 PolarHBondContact O-N 3.12Å; L391-Y394 PolarHBondContact O-N 2.95Å; L391-L395 HydrophobicContact CD1-CD1 4.22Å; L391-L395 HydrophobicContact CG-CD1 4.1Å; L391-L395 VanDerWaalsContact O-CG 3.27Å; L391-L395 WeakPolarHBondContact O-CG 3.38Å; L391-L395 PolarHBondContact O-N 3.03Å; L391-L395 VanDerWaalsContact O-N 3.12Å; L391-I459 HydrophobicContact CD1-CD1 3.74Å |
| 392 | I | 72.9 | Confident | 80.5 | Confident | 33 Ų | 33 | 46 Ų | 46 | 17% | 0.169 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -68 | -38 | 176.7 | -64.8 | -162.9 | 0 | 0 | 0 | 111.1 | A140 S141 I144 I388 Y389 S390 Y394 L395 G396 | A140-I392 HydrophobicContact CB-CD1 4.11Å; A140-I392 HydrophobicContact CB-CG1 4Å; S141-I392 VanDerWaalsContact CA-CD1 3.48Å; I144-I392 HydrophobicContact CB-CD1 4.31Å; I144-I392 HydrophobicContact CD1-CB 4.13Å; I144-I392 HydrophobicContact CD1-CD1 3.33Å; I144-I392 HydrophobicContact CD1-CG1 3.69Å; I144-I392 HydrophobicContact CG1-CD1 3.87Å; I388-I392 PolarHBondContact O-N 3.22Å; I388-I392 VanDerWaalsContact O-N 3.08Å; Y389-I392 PolarHBondContact O-N 3.46Å; S390-I392 VanDerWaalsContact C-N 3.33Å; S390-I392 PolarHBondContact O-N 2.86Å; I392-Y394 VanDerWaalsContact C-N 3.35Å; I392-Y394 PolarHBondContact O-N 3.36Å; I392-L395 CarbonylContact O-C 3.43Å; I392-L395 PolarHBondContact O-N 3.36Å; I392-L395 VanDerWaalsContact O-N 3.13Å; I392-G396 PolarHBondContact O-N 3.49Å |
| 393 | T | 75.7 | Confident | 80.5 | Confident | 98 Ų | 98 | 43.7 Ų | 43.7 | 60% | 0.601 | 24% | 0.243 | S | C | * | . | H | α-helix | trans | -58.5 | -46.4 | 175.2 | -58 | 0 | 0 | 0 | 0 | 111.5 | Y389 S390 L395 G396 | Y389-T393 PolarHBondContact O-N 3.46Å; Y389-T393 PolarHBondContact O-OG1 2.88Å; Y389-T393 VanDerWaalsContact O-OG1 3.1Å; S390-T393 WeakPolarHBondContact O-CB 3.4Å; S390-T393 PolarHBondContact O-N 3.47Å; S390-T393 VanDerWaalsContact O-N 3.12Å; T393-L395 VanDerWaalsContact C-N 3.26Å; T393-L395 PolarHBondContact O-N 3.17Å; T393-G396 PolarHBondContact O-N 3.24Å |
| 394 | Y | 77.4 | Confident | 80.6 | Confident | 69 Ų | 69 | 43.8 Ų | 43.8 | 27% | 0.271 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -63.1 | -32.6 | 176.4 | -54.7 | -32.7 | 0 | 0 | 0 | 112.5 | S390 L391 I392 E452 L455 G456 | S390-Y394 WeakPolarHBondContact O-CD2 3.46Å; S390-Y394 PolarHBondContact O-N 3.3Å; L391-Y394 PolarHBondContact O-N 2.95Å; I392-Y394 VanDerWaalsContact C-N 3.35Å; I392-Y394 PolarHBondContact O-N 3.36Å; Y394-E452 HydrophobicContact CD1-CB 3.84Å; Y394-E452 HydrophobicContact CD1-CG 3.87Å; Y394-E452 HydrophobicContact CE1-CB 4.26Å; Y394-E452 HydrophobicContact CE1-CG 3.78Å; Y394-L455 HydrophobicContact CD2-CD1 4.45Å; Y394-L455 HydrophobicContact CE1-CD1 4.31Å; Y394-L455 HydrophobicContact CE2-CD1 4.21Å; Y394-L455 HydrophobicContact CG-CB 4.43Å; Y394-G456 WeakPolarHBondContact O-CA 3.43Å |
| 395 | L | 76.6 | Confident | 80.9 | Confident | 7 Ų | 7 | 39.1 Ų | 39.1 | 4% | 0.037 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -83.5 | -16.8 | 178.4 | -68.6 | 171.3 | 0 | 0 | 0 | 113.9 | V136 A137 L391 I392 T393 F397 V398 Q399 I459 | V136-L395 HydrophobicContact CB-CD1 4.31Å; V136-L395 HydrophobicContact CG1-CD1 3.54Å; A137-L395 HydrophobicContact CB-CD1 4.04Å; L391-L395 HydrophobicContact CD1-CD1 4.22Å; L391-L395 HydrophobicContact CG-CD1 4.1Å; L391-L395 VanDerWaalsContact O-CG 3.27Å; L391-L395 WeakPolarHBondContact O-CG 3.38Å; L391-L395 PolarHBondContact O-N 3.03Å; L391-L395 VanDerWaalsContact O-N 3.12Å; I392-L395 CarbonylContact O-C 3.43Å; I392-L395 PolarHBondContact O-N 3.36Å; I392-L395 VanDerWaalsContact O-N 3.13Å; T393-L395 VanDerWaalsContact C-N 3.26Å; T393-L395 PolarHBondContact O-N 3.17Å; L395-F397 PolarHBondContact O-N 3.01Å; L395-V398 WeakPolarHBondContact O-CB 3.47Å; L395-V398 PolarHBondContact O-N 3.1Å; L395-V398 VanDerWaalsContact O-N 3.1Å; L395-Q399 WeakPolarHBondContact O-CB 3.4Å; L395-Q399 PolarHBondContact O-N 3.25Å; L395-I459 HydrophobicContact CD2-CB 4.23Å; L395-I459 HydrophobicContact CD2-CD1 4.17Å; L395-I459 HydrophobicContact CD2-CG2 3.86Å; L395-I459 HydrophobicContact CG-CD1 4.4Å |
| 396 | G | 76.5 | Confident | 81.3 | Confident | 19 Ų | 19 | 36.2 Ų | 36.2 | 20% | 0.196 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -57.7 | -47.9 | -178.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | I392 T393 V398 Q399 W400 | I392-G396 PolarHBondContact O-N 3.49Å; T393-G396 PolarHBondContact O-N 3.24Å; G396-V398 PolarHBondContact O-N 3.06Å; G396-Q399 WeakPolarHBondContact O-CB 3.07Å; G396-Q399 PolarHBondContact O-N 3.39Å; G396-W400 PolarHBondContact O-N 3.08Å |
| 397 | F | 76.9 | Confident | 82.3 | Confident | 15 Ų | 15 | 32.9 Ų | 32.9 | 7% | 0.066 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -58.3 | -47.3 | 173.4 | 164.5 | -93.5 | 0 | 0 | 0 | 112.3 | L395 Q399 W400 L401 V442 A445 F446 | L395-F397 PolarHBondContact O-N 3.01Å; F397-Q399 VanDerWaalsContact C-N 3.25Å; F397-Q399 PolarHBondContact O-N 3.12Å; F397-W400 PolarHBondContact O-N 3.28Å; F397-W400 VanDerWaalsContact O-N 3.16Å; F397-L401 HydrophobicContact CE1-CB 4.49Å; F397-L401 HydrophobicContact CE1-CD2 4.18Å; F397-L401 HydrophobicContact CZ-CB 4.42Å; F397-L401 HydrophobicContact CZ-CD2 4.29Å; F397-L401 PolarHBondContact O-N 3.33Å; F397-V442 HydrophobicContact CD2-CG2 4.44Å; F397-V442 HydrophobicContact CE2-CB 3.82Å; F397-V442 HydrophobicContact CE2-CG1 3.69Å; F397-V442 HydrophobicContact CE2-CG2 3.68Å; F397-V442 HydrophobicContact CZ-CB 4.3Å; F397-V442 HydrophobicContact CZ-CG1 3.72Å; F397-V442 HydrophobicContact CZ-CG2 4.11Å; F397-A445 HydrophobicContact CD2-CB 3.4Å; F397-A445 VanDerWaalsContact CD2-CB 3.4Å; F397-A445 HydrophobicContact CE2-CB 3.77Å; F397-A445 HydrophobicContact CG-CB 4.41Å; F397-F446 AromaticContact CE1-CE2 3.82Å; F397-F446 HydrophobicContact CE1-CE2 3.82Å; F397-F446 AromaticContact CE1-CZ 3.93Å; F397-F446 HydrophobicContact CE1-CZ 3.93Å; F397-F446 HydrophobicContact CE2-CD2 4.12Å; F397-F446 AromaticContact CE2-CE2 3.98Å; F397-F446 HydrophobicContact CE2-CE2 3.98Å; F397-F446 AromaticContact CZ-CD2 3.84Å; F397-F446 HydrophobicContact CZ-CD2 3.84Å; F397-F446 AromaticContact CZ-CE2 3.24Å; F397-F446 HydrophobicContact CZ-CE2 3.24Å; F397-F446 AromaticContact CZ-CZ 3.84Å; F397-F446 HydrophobicContact CZ-CZ 3.84Å |
| 398 | V | 78.5 | Confident | 83.1 | Confident | 4 Ų | 4 | 30 Ų | 30 | 2% | 0.024 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -59.1 | -40 | 179.8 | 167.9 | 0 | 0 | 0 | 0 | 111.2 | L395 G396 L401 A402 G456 I460 | L395-V398 WeakPolarHBondContact O-CB 3.47Å; L395-V398 PolarHBondContact O-N 3.1Å; L395-V398 VanDerWaalsContact O-N 3.1Å; G396-V398 PolarHBondContact O-N 3.06Å; V398-L401 PolarHBondContact O-N 3.04Å; V398-A402 VanDerWaalsContact O-CB 3.28Å; V398-A402 WeakPolarHBondContact O-CB 3.45Å; V398-A402 PolarHBondContact O-N 3.12Å; V398-G456 WeakPolarHBondContact CG2-O 3.33Å; V398-I460 HydrophobicContact CB-CD1 4.18Å; V398-I460 HydrophobicContact CG1-CD1 3.31Å; V398-I460 HydrophobicContact CG1-CG1 3.56Å; V398-I460 HydrophobicContact CG2-CD1 3.89Å; V398-I460 HydrophobicContact CG2-CG1 4.23Å |
| 399 | Q | 83.2 | Confident | 84.2 | Confident | 27 Ų | 27 | 29.4 Ų | 29.4 | 13% | 0.126 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -61.5 | -46.6 | 178 | -171 | 177.3 | 17.8 | 0 | 0 | 110.7 | L395 G396 F397 A402 I403 | L395-Q399 WeakPolarHBondContact O-CB 3.4Å; L395-Q399 PolarHBondContact O-N 3.25Å; G396-Q399 WeakPolarHBondContact O-CB 3.07Å; G396-Q399 PolarHBondContact O-N 3.39Å; F397-Q399 VanDerWaalsContact C-N 3.25Å; F397-Q399 PolarHBondContact O-N 3.12Å; Q399-A402 PolarHBondContact O-N 3.38Å; Q399-I403 HydrophobicContact CG-CD1 4.11Å; Q399-I403 VanDerWaalsContact O-CG1 3.27Å; Q399-I403 WeakPolarHBondContact O-CG1 3.45Å; Q399-I403 PolarHBondContact O-N 2.9Å |
| 400 | W | 83.9 | Confident | 85.3 | Confident | 7 Ų | 7 | 24.1 Ų | 24.1 | 3% | 0.027 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -68.8 | -40.1 | 178.9 | -67.7 | 112.5 | 0 | 0 | 0 | 113 | Y243 L246 G396 F397 A402 I403 G404 T438 | Y243-W400 AromaticContact CD1-CD1 3.47Å; Y243-W400 VanDerWaalsContact CD1-CD1 3.47Å; Y243-W400 HydrophobicContact CD1-CG 4.29Å; Y243-W400 HydrophobicContact CE1-CB 4.06Å; Y243-W400 AromaticContact CE1-CD1 3.5Å; Y243-W400 AromaticContact CE1-CG 3.99Å; Y243-W400 HydrophobicContact CE1-CG 3.99Å; L246-W400 HydrophobicContact CB-CD2 4.41Å; L246-W400 HydrophobicContact CB-CH2 3.79Å; L246-W400 HydrophobicContact CB-CZ2 3.39Å; L246-W400 HydrophobicContact CB-CZ3 4.44Å; L246-W400 HydrophobicContact CD1-CD2 3.97Å; L246-W400 HydrophobicContact CD1-CE3 4.04Å; L246-W400 HydrophobicContact CD1-CH2 4.37Å; L246-W400 HydrophobicContact CD1-CZ2 4.34Å; L246-W400 HydrophobicContact CD1-CZ3 4.21Å; L246-W400 HydrophobicContact CD2-CH2 4.38Å; L246-W400 HydrophobicContact CG-CH2 4.42Å; L246-W400 HydrophobicContact CG-CZ2 4.39Å; L246-W400 VanDerWaalsContact O-CZ2 3.28Å; L246-W400 WeakPolarHBondContact O-CZ2 3.47Å; G396-W400 PolarHBondContact O-N 3.08Å; F397-W400 PolarHBondContact O-N 3.28Å; F397-W400 VanDerWaalsContact O-N 3.16Å; W400-A402 VanDerWaalsContact C-N 3.29Å; W400-A402 PolarHBondContact O-N 2.93Å; W400-I403 HydrophobicContact CD2-CD1 4.48Å; W400-I403 HydrophobicContact CE3-CD1 3.83Å; W400-I403 HydrophobicContact CH2-CD1 4.31Å; W400-I403 HydrophobicContact CZ3-CD1 3.76Å; W400-I403 PolarHBondContact O-N 3.32Å; W400-G404 PolarHBondContact O-N 2.66Å; W400-T438 WeakPolarHBondContact O-CG2 3.3Å |
| 401 | L | 85.9 | Confident | 86.2 | Confident | 60 Ų | 60 | 24.8 Ų | 24.8 | 31% | 0.314 | 14% | 0.141 | S | C | . | . | H | α-helix | trans | -56.8 | -46.7 | 170.9 | 176 | 62.8 | 0 | 0 | 0 | 110.7 | F397 V398 I403 G404 V405 V442 | F397-L401 HydrophobicContact CE1-CB 4.49Å; F397-L401 HydrophobicContact CE1-CD2 4.18Å; F397-L401 HydrophobicContact CZ-CB 4.42Å; F397-L401 HydrophobicContact CZ-CD2 4.29Å; F397-L401 PolarHBondContact O-N 3.33Å; V398-L401 PolarHBondContact O-N 3.04Å; L401-I403 PolarHBondContact O-N 2.91Å; L401-G404 PolarHBondContact O-N 2.88Å; L401-V405 WeakPolarHBondContact O-CG2 3.46Å; L401-V405 PolarHBondContact O-N 3.36Å; L401-V442 HydrophobicContact CB-CG2 4.09Å; L401-V442 HydrophobicContact CD1-CG1 4.3Å; L401-V442 HydrophobicContact CD1-CG2 4.05Å |
| 402 | A | 88.6 | Confident | 87.1 | Confident | 15 Ų | 15 | 25.7 Ų | 25.7 | 12% | 0.124 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -65.7 | -38.6 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | V398 Q399 W400 V405 C406 | V398-A402 VanDerWaalsContact O-CB 3.28Å; V398-A402 WeakPolarHBondContact O-CB 3.45Å; V398-A402 PolarHBondContact O-N 3.12Å; Q399-A402 PolarHBondContact O-N 3.38Å; W400-A402 VanDerWaalsContact C-N 3.29Å; W400-A402 PolarHBondContact O-N 2.93Å; A402-V405 PolarHBondContact O-N 2.94Å; A402-C406 WeakPolarHBondContact O-CB 3.28Å; A402-C406 PolarHBondContact O-N 3.35Å |
| 403 | I | 91.4 | Very high | 88.2 | Confident | 0 Ų | 0 | 24.3 Ų | 24.3 | 0% | 0 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -64.9 | -41.6 | 173.1 | -66.3 | 165.6 | 0 | 0 | 0 | 110.2 | Y100 W252 Q399 W400 L401 V405 C406 V407 Y434 | Y100-I403 HydrophobicContact CE2-CG2 4.13Å; W252-I403 HydrophobicContact CH2-CG2 3.82Å; W252-I403 HydrophobicContact CZ2-CG2 3.9Å; Q399-I403 HydrophobicContact CG-CD1 4.11Å; Q399-I403 VanDerWaalsContact O-CG1 3.27Å; Q399-I403 WeakPolarHBondContact O-CG1 3.45Å; Q399-I403 PolarHBondContact O-N 2.9Å; W400-I403 HydrophobicContact CD2-CD1 4.48Å; W400-I403 HydrophobicContact CE3-CD1 3.83Å; W400-I403 HydrophobicContact CH2-CD1 4.31Å; W400-I403 HydrophobicContact CZ3-CD1 3.76Å; W400-I403 PolarHBondContact O-N 3.32Å; L401-I403 PolarHBondContact O-N 2.91Å; I403-V405 PolarHBondContact O-N 3.43Å; I403-C406 CarbonylContact O-C 3.16Å; I403-C406 WeakPolarHBondContact O-CA 3.37Å; I403-C406 WeakPolarHBondContact O-CB 3.23Å; I403-C406 PolarHBondContact O-N 3.47Å; I403-C406 VanDerWaalsContact O-N 3.11Å; I403-V407 HydrophobicContact CG2-CG2 4.4Å; I403-V407 WeakPolarHBondContact O-CG2 3.4Å; I403-V407 PolarHBondContact O-N 2.86Å; I403-Y434 HydrophobicContact CG2-CE1 3.91Å; I403-Y434 VanDerWaalsContact CG2-OH 3.22Å; I403-Y434 WeakPolarHBondContact CG2-OH 3.48Å |
| 404 | G | 93.6 | Very high | 89.1 | Confident | 8 Ų | 8 | 21.5 Ų | 21.5 | 8% | 0.082 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -58.7 | -46 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | W400 L401 C406 V407 S408 | W400-G404 PolarHBondContact O-N 2.66Å; L401-G404 PolarHBondContact O-N 2.88Å; G404-C406 VanDerWaalsContact C-N 3.29Å; G404-C406 PolarHBondContact O-N 2.98Å; G404-V407 PolarHBondContact O-N 3.35Å; G404-S408 PolarHBondContact O-N 3.45Å |
| 405 | V | 94.5 | Very high | 89.8 | Confident | 56 Ų | 56 | 24.7 Ų | 24.7 | 34% | 0.339 | 14% | 0.139 | S | C | . | . | H | α-helix | trans | -58.9 | -44 | 172.4 | 170.6 | 0 | 0 | 0 | 0 | 110.2 | F121 L401 A402 I403 S408 I409 | F121-V405 HydrophobicContact CD2-CG1 4.42Å; F121-V405 HydrophobicContact CE2-CG1 3.73Å; F121-V405 HydrophobicContact CZ-CG1 4.45Å; L401-V405 WeakPolarHBondContact O-CG2 3.46Å; L401-V405 PolarHBondContact O-N 3.36Å; A402-V405 PolarHBondContact O-N 2.94Å; I403-V405 PolarHBondContact O-N 3.43Å; V405-S408 WeakPolarHBondContact O-CB 3.41Å; V405-S408 PolarHBondContact O-N 3.4Å; V405-S408 PolarHBondContact O-OG 2.86Å; V405-I409 PolarHBondContact O-N 3.24Å |
| 406 | C | 95 | Very high | 90.7 | Very high | 0 Ų | 0 | 28.7 Ų | 28.7 | 0% | 0 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -62.8 | -44.8 | 178.5 | -161.4 | 0 | 0 | 0 | 0 | 112.6 | Y100 L103 A402 I403 G404 S408 I409 | Y100-C406 HydrophobicContact CE2-CB 3.99Å; Y100-C406 VanDerWaalsContact CZ-SG 3.56Å; Y100-C406 VanDerWaalsContact OH-CB 3.24Å; Y100-C406 WeakPolarHBondContact OH-CB 3.41Å; Y100-C406 PolarHBondContact OH-SG 2.87Å; L103-C406 WeakPolarHBondContact CD1-O 3.42Å; A402-C406 WeakPolarHBondContact O-CB 3.28Å; A402-C406 PolarHBondContact O-N 3.35Å; I403-C406 CarbonylContact O-C 3.16Å; I403-C406 WeakPolarHBondContact O-CA 3.37Å; I403-C406 WeakPolarHBondContact O-CB 3.23Å; I403-C406 PolarHBondContact O-N 3.47Å; I403-C406 VanDerWaalsContact O-N 3.11Å; G404-C406 VanDerWaalsContact C-N 3.29Å; G404-C406 PolarHBondContact O-N 2.98Å; C406-S408 VanDerWaalsContact C-N 3.29Å; C406-S408 PolarHBondContact O-N 2.86Å; C406-I409 WeakPolarHBondContact O-CB 3.39Å; C406-I409 WeakPolarHBondContact O-CG1 3.38Å; C406-I409 PolarHBondContact O-N 3.39Å; C406-I409 VanDerWaalsContact O-N 3.11Å |
| 407 | V | 96.4 | Very high | 91.3 | Very high | 0 Ų | 0 | 31 Ų | 31 | 0% | 0 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -64.8 | -34.7 | 176 | 176.3 | 0 | 0 | 0 | 0 | 111.5 | C99 Y100 I403 G404 I409 V410 A431 Y434 V435 | C99-V407 HydrophobicContact CB-CG1 3.94Å; C99-V407 HydrophobicContact CB-CG2 4.3Å; Y100-V407 HydrophobicContact CD2-CG2 4.16Å; Y100-V407 HydrophobicContact CE2-CG2 3.87Å; I403-V407 HydrophobicContact CG2-CG2 4.4Å; I403-V407 WeakPolarHBondContact O-CG2 3.4Å; I403-V407 PolarHBondContact O-N 2.86Å; G404-V407 PolarHBondContact O-N 3.35Å; V407-I409 PolarHBondContact O-N 3.28Å; V407-I409 VanDerWaalsContact O-N 3.17Å; V407-V410 WeakPolarHBondContact O-CB 3.15Å; V407-V410 PolarHBondContact O-N 3.29Å; V407-A431 HydrophobicContact CG1-CB 4.02Å; V407-Y434 HydrophobicContact CB-CD1 3.85Å; V407-Y434 HydrophobicContact CB-CE1 4.33Å; V407-Y434 HydrophobicContact CG1-CD1 3.92Å; V407-Y434 HydrophobicContact CG1-CG 4.15Å; V407-Y434 HydrophobicContact CG2-CD1 3.67Å; V407-Y434 HydrophobicContact CG2-CE1 3.75Å; V407-Y434 HydrophobicContact CG2-CG 4.29Å; V407-V435 HydrophobicContact CB-CG2 4.48Å; V407-V435 HydrophobicContact CG1-CG2 4.22Å |
| 408 | S | 96.6 | Very high | 91.9 | Very high | 28 Ų | 28 | 39.5 Ų | 39.5 | 20% | 0.196 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -61.4 | -23.7 | 175.4 | 81.1 | 0 | 0 | 0 | 0 | 113.1 | G404 V405 C406 V410 I411 V412 | G404-S408 PolarHBondContact O-N 3.45Å; V405-S408 WeakPolarHBondContact O-CB 3.41Å; V405-S408 PolarHBondContact O-N 3.4Å; V405-S408 PolarHBondContact O-OG 2.86Å; C406-S408 VanDerWaalsContact C-N 3.29Å; C406-S408 PolarHBondContact O-N 2.86Å; S408-V410 PolarHBondContact O-N 2.94Å; S408-I411 WeakPolarHBondContact O-CA 3.34Å; S408-I411 WeakPolarHBondContact O-CB 3.43Å; S408-I411 PolarHBondContact O-N 2.86Å; S408-V412 PolarHBondContact O-N 3.3Å |
| 409 | I | 96.5 | Very high | 92.3 | Very high | 0 Ų | 0 | 46.7 Ų | 46.7 | 0% | 0 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -60.2 | -32.7 | 174 | -61.3 | 169.2 | 0 | 0 | 0 | 111 | L103 Y116 V117 A120 F121 V405 C406 V407 I411 V412 F413 | L103-I409 HydrophobicContact CD1-CB 4.49Å; L103-I409 HydrophobicContact CD2-CB 4.36Å; L103-I409 HydrophobicContact CD2-CG2 3.91Å; Y116-I409 WeakPolarHBondContact O-CD1 3.4Å; V117-I409 HydrophobicContact CG2-CD1 4.1Å; A120-I409 HydrophobicContact CB-CB 4.31Å; A120-I409 HydrophobicContact CB-CD1 3.72Å; A120-I409 HydrophobicContact CB-CG1 3.71Å; A120-I409 HydrophobicContact CB-CG2 3.65Å; F121-I409 HydrophobicContact CD2-CD1 4.44Å; F121-I409 HydrophobicContact CD2-CG1 4.48Å; F121-I409 HydrophobicContact CE2-CD1 3.95Å; F121-I409 HydrophobicContact CE2-CG1 3.61Å; F121-I409 HydrophobicContact CZ-CG1 4.05Å; V405-I409 PolarHBondContact O-N 3.24Å; C406-I409 WeakPolarHBondContact O-CB 3.39Å; C406-I409 WeakPolarHBondContact O-CG1 3.38Å; C406-I409 PolarHBondContact O-N 3.39Å; C406-I409 VanDerWaalsContact O-N 3.11Å; V407-I409 PolarHBondContact O-N 3.28Å; V407-I409 VanDerWaalsContact O-N 3.17Å; I409-I411 VanDerWaalsContact C-N 3.26Å; I409-I411 PolarHBondContact O-N 3Å; I409-V412 PolarHBondContact O-N 3.09Å; I409-F413 HydrophobicContact CG2-CD1 3.96Å; I409-F413 HydrophobicContact CG2-CD2 3.61Å; I409-F413 HydrophobicContact CG2-CE1 3.79Å; I409-F413 HydrophobicContact CG2-CE2 3.4Å; I409-F413 VanDerWaalsContact CG2-CE2 3.4Å; I409-F413 HydrophobicContact CG2-CG 3.88Å; I409-F413 HydrophobicContact CG2-CZ 3.51Å; I409-F413 VanDerWaalsContact O-CB 3.32Å; I409-F413 WeakPolarHBondContact O-CB 3.4Å; I409-F413 WeakPolarHBondContact O-CG 3.25Å; I409-F413 PolarHBondContact O-N 3.46Å |
| 410 | V | 96.2 | Very high | 92.6 | Very high | 0 Ų | 0 | 49.4 Ų | 49.4 | 0% | 0 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -58.6 | -43.2 | 174.4 | 177.1 | 0 | 0 | 0 | 0 | 110.1 | C99 L103 V407 S408 R414 A431 | C99-V410 HydrophobicContact CB-CG2 4.07Å; L103-V410 HydrophobicContact CD1-CG2 4.01Å; L103-V410 HydrophobicContact CD2-CG2 3.83Å; L103-V410 HydrophobicContact CG-CG2 3.72Å; V407-V410 WeakPolarHBondContact O-CB 3.15Å; V407-V410 PolarHBondContact O-N 3.29Å; S408-V410 PolarHBondContact O-N 2.94Å; V410-R414 WeakPolarHBondContact O-CG 3.38Å; V410-R414 PolarHBondContact O-N 3.43Å; V410-A431 HydrophobicContact CB-CB 4.26Å; V410-A431 HydrophobicContact CG1-CB 4.25Å |
| 411 | I | 96.3 | Very high | 92.8 | Very high | 46 Ų | 46 | 53.7 Ų | 53.7 | 24% | 0.236 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -66.8 | -47.1 | 177.4 | -54.6 | 174.4 | 0 | 0 | 0 | 110 | S408 I409 F413 R414 A431 I432 V435 | S408-I411 WeakPolarHBondContact O-CA 3.34Å; S408-I411 WeakPolarHBondContact O-CB 3.43Å; S408-I411 PolarHBondContact O-N 2.86Å; I409-I411 VanDerWaalsContact C-N 3.26Å; I409-I411 PolarHBondContact O-N 3Å; I411-F413 PolarHBondContact O-N 2.93Å; I411-R414 WeakPolarHBondContact O-CB 3.31Å; I411-R414 PolarHBondContact O-N 3.15Å; I411-A431 HydrophobicContact CD1-CB 4.29Å; I411-A431 HydrophobicContact CG1-CB 3.9Å; I411-I432 HydrophobicContact CD1-CG1 4.16Å; I411-V435 HydrophobicContact CD1-CG2 4.18Å |
| 412 | V | 95.8 | Very high | 93.2 | Very high | 48 Ų | 48 | 53.3 Ų | 53.3 | 29% | 0.291 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -58.3 | -47.5 | 177.7 | 175.3 | 0 | 0 | 0 | 0 | 111.1 | S408 I409 R414 I415 T416 | S408-V412 PolarHBondContact O-N 3.3Å; I409-V412 PolarHBondContact O-N 3.09Å; V412-R414 VanDerWaalsContact C-N 3.29Å; V412-R414 PolarHBondContact O-N 3.18Å; V412-I415 WeakPolarHBondContact O-CA 3.49Å; V412-I415 WeakPolarHBondContact O-CB 3.33Å; V412-I415 PolarHBondContact O-N 3.45Å; V412-T416 HydrophobicContact CG1-CG2 3.98Å; V412-T416 PolarHBondContact O-N 2.82Å; V412-T416 PolarHBondContact O-OG1 3.34Å; V412-T416 VanDerWaalsContact O-OG1 3.06Å |
| 413 | F | 95.8 | Very high | 93.3 | Very high | 4 Ų | 4 | 55.1 Ų | 55.1 | 2% | 0.018 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -71.1 | -19.5 | -179.8 | -74.9 | -3 | 0 | 0 | 0 | 114 | L103 M106 I107 A120 I409 I411 I415 K417 R422 | L103-F413 HydrophobicContact CD2-CD2 4.13Å; L103-F413 HydrophobicContact CD2-CE2 4.34Å; M106-F413 HydrophobicContact CE-CB 4.33Å; M106-F413 HydrophobicContact CE-CD2 3.68Å; M106-F413 HydrophobicContact CE-CE2 4.23Å; M106-F413 HydrophobicContact CE-CG 4.16Å; M106-F413 HydrophobicContact SD-CD2 4.02Å; I107-F413 HydrophobicContact CD1-CE2 3.72Å; I107-F413 HydrophobicContact CD1-CZ 4.25Å; A120-F413 HydrophobicContact CB-CE1 3.79Å; A120-F413 HydrophobicContact CB-CZ 3.8Å; I409-F413 HydrophobicContact CG2-CD1 3.96Å; I409-F413 HydrophobicContact CG2-CD2 3.61Å; I409-F413 HydrophobicContact CG2-CE1 3.79Å; I409-F413 HydrophobicContact CG2-CE2 3.4Å; I409-F413 VanDerWaalsContact CG2-CE2 3.4Å; I409-F413 HydrophobicContact CG2-CG 3.88Å; I409-F413 HydrophobicContact CG2-CZ 3.51Å; I409-F413 VanDerWaalsContact O-CB 3.32Å; I409-F413 WeakPolarHBondContact O-CB 3.4Å; I409-F413 WeakPolarHBondContact O-CG 3.25Å; I409-F413 PolarHBondContact O-N 3.46Å; I411-F413 PolarHBondContact O-N 2.93Å; F413-I415 PolarHBondContact O-N 2.76Å; F413-K417 HydrophobicContact CB-CB 4.43Å; F413-K417 HydrophobicContact CD1-CD 4.1Å; F413-K417 HydrophobicContact CD1-CG 4.37Å; F413-K417 HydrophobicContact CE1-CD 4.12Å; F413-K417 HydrophobicContact CG-CD 4.34Å; F413-K417 HydrophobicContact CZ-CD 4.39Å; F413-K417 CarbonylContact O-C 3.59Å; F413-K417 VanDerWaalsContact O-C 3.26Å; F413-K417 WeakPolarHBondContact O-CA 3.46Å; F413-K417 PolarHBondContact O-N 3.42Å; F413-K417 VanDerWaalsContact O-N 3.12Å; F413-R422 PolarHBondContact O-NH2 3.11Å |
| 414 | R | 95 | Very high | 93.3 | Very high | 39 Ų | 39 | 55.5 Ų | 55.5 | 15% | 0.147 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -63.6 | -33 | 167 | -70.9 | -87.9 | 180 | -78.7 | -1.8 | 111.2 | E102 V410 I411 V412 A426 I428 | E102-R414 IonicContact OE1-CZ 3.27Å; E102-R414 IonicContact OE1-NH1 3.19Å; E102-R414 PolarHBondContact OE1-NH1 3.43Å; E102-R414 IonicContact OE1-NH2 2.6Å; E102-R414 PolarHBondContact OE1-NH2 3.3Å; E102-R414 IonicContact OE2-CZ 3.57Å; E102-R414 IonicContact OE2-NH1 3.59Å; E102-R414 IonicContact OE2-NH2 3.8Å; E102-R414 PolarHBondContact OE2-NH2 3.33Å; V410-R414 WeakPolarHBondContact O-CG 3.38Å; V410-R414 PolarHBondContact O-N 3.43Å; I411-R414 WeakPolarHBondContact O-CB 3.31Å; I411-R414 PolarHBondContact O-N 3.15Å; V412-R414 VanDerWaalsContact C-N 3.29Å; V412-R414 PolarHBondContact O-N 3.18Å; R414-A426 PolarHBondContact NH2-O 2.96Å; R414-I428 HydrophobicContact CB-CD1 4.33Å; R414-I428 HydrophobicContact CG-CD1 3.98Å |
| 415 | I | 93.3 | Very high | 93.3 | Very high | 135 Ų | 135 | 62 Ų | 62 | 69% | 0.692 | 31% | 0.313 | S | S | * | . | H | α-helix | trans | -89.2 | -53 | -178.6 | -55.3 | 170.7 | 0 | 0 | 0 | 110.4 | V412 F413 | V412-I415 WeakPolarHBondContact O-CA 3.49Å; V412-I415 WeakPolarHBondContact O-CB 3.33Å; V412-I415 PolarHBondContact O-N 3.45Å; F413-I415 PolarHBondContact O-N 2.76Å |
| 416 | T | 93.8 | Very high | 93.3 | Very high | 92 Ų | 92 | 59.3 Ų | 59.3 | 56% | 0.564 | 30% | 0.297 | S | S | * | . | H | α-helix | trans | -81.8 | -33.3 | -170.9 | 59.4 | 0 | 0 | 0 | 0 | 114 | V412 | V412-T416 HydrophobicContact CG1-CG2 3.98Å; V412-T416 PolarHBondContact O-N 2.82Å; V412-T416 PolarHBondContact O-OG1 3.34Å; V412-T416 VanDerWaalsContact O-OG1 3.06Å |
| 417 | K | 91.1 | Very high | 93.3 | Very high | 66 Ų | 66 | 62.2 Ų | 62.2 | 29% | 0.287 | 32% | 0.315 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -119.8 | 43.2 | -176.4 | -67.3 | -174 | 179.6 | 177.3 | 0 | 111.6 | M106 F413 N419 H420 R422 | M106-K417 HydrophobicContact CE-CB 3.85Å; M106-K417 HydrophobicContact CE-CD 3.68Å; M106-K417 HydrophobicContact CE-CG 4.39Å; F413-K417 HydrophobicContact CB-CB 4.43Å; F413-K417 HydrophobicContact CD1-CD 4.1Å; F413-K417 HydrophobicContact CD1-CG 4.37Å; F413-K417 HydrophobicContact CE1-CD 4.12Å; F413-K417 HydrophobicContact CG-CD 4.34Å; F413-K417 HydrophobicContact CZ-CD 4.39Å; F413-K417 CarbonylContact O-C 3.59Å; F413-K417 VanDerWaalsContact O-C 3.26Å; F413-K417 WeakPolarHBondContact O-CA 3.46Å; F413-K417 PolarHBondContact O-N 3.42Å; F413-K417 VanDerWaalsContact O-N 3.12Å; K417-N419 VanDerWaalsContact C-N 3.28Å; K417-N419 PolarHBondContact O-N 3.24Å; K417-N419 VanDerWaalsContact O-N 3.14Å; K417-H420 HydrophobicContact CB-CB 4.2Å; K417-H420 WeakPolarHBondContact O-CB 3.47Å; K417-H420 PolarHBondContact O-N 3.45Å; K417-H420 VanDerWaalsContact O-N 3.12Å; K417-R422 PolarHBondContact O-NH2 3.43Å |
| 418 | R | 87.4 | Confident | 93.2 | Very high | 195 Ų | 195 | 65.8 Ų | 65.8 | 74% | 0.736 | 33% | 0.334 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -52.4 | -40 | -172.3 | -170.5 | 176 | 178.5 | 177.9 | -0.3 | 114 | R422 | R418-R422 PolarHBondContact O-NH1 3.3Š|
| 419 | N | 87.9 | Confident | 93.2 | Very high | 155 Ų | 155 | 69.3 Ų | 69.3 | 83% | 0.829 | 35% | 0.35 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.5 | -0.6 | -174.9 | -62.3 | -18.2 | 0 | 0 | 0 | 114.6 | K417 | K417-N419 VanDerWaalsContact C-N 3.28Å; K417-N419 PolarHBondContact O-N 3.24Å; K417-N419 VanDerWaalsContact O-N 3.14Å |
| 420 | H | 88.7 | Confident | 93.2 | Very high | 84 Ų | 84 | 72.4 Ų | 72.4 | 39% | 0.389 | 36% | 0.363 | S | S | . | . | S | Bend | trans | -67.4 | 137.2 | 179.7 | -158.9 | -75.3 | 0 | 0 | 0 | 110.6 | M106 K417 R422 | M106-H420 HydrophobicContact CE-CB 3.7Å; K417-H420 HydrophobicContact CB-CB 4.2Å; K417-H420 WeakPolarHBondContact O-CB 3.47Å; K417-H420 PolarHBondContact O-N 3.45Å; K417-H420 VanDerWaalsContact O-N 3.12Å; H420-R422 PolarHBondContact O-N 2.99Å; H420-R422 PolarHBondContact O-NH1 2.74Å; H420-R422 VanDerWaalsContact O-NH1 3.12Å |
| 421 | P | 89.9 | Confident | 93.2 | Very high | 97 Ų | 97 | 72.4 Ų | 72.4 | 63% | 0.63 | 36% | 0.363 | S | S | * | . | trans | -55.3 | 133.5 | 174.4 | -26.1 | 34.1 | 0 | 0 | 0 | 111.5 | ||||
| 422 | R | 93 | Very high | 93.2 | Very high | 51 Ų | 51 | 73.4 Ų | 73.4 | 19% | 0.192 | 37% | 0.369 | C | S | . | . | trans | -127.3 | 90.1 | 178.1 | -69.6 | 176.9 | -171.6 | 90.6 | -9.1 | 109.1 | E102 M106 F413 K417 R418 H420 V424 | E102-R422 WeakPolarHBondContact OE1-CD 3.27Å; E102-R422 IonicContact OE1-NE 2.82Å; M106-R422 HydrophobicContact SD-CG 4.17Å; F413-R422 PolarHBondContact O-NH2 3.11Å; K417-R422 PolarHBondContact O-NH2 3.43Å; R418-R422 PolarHBondContact O-NH1 3.3Å; H420-R422 PolarHBondContact O-N 2.99Å; H420-R422 PolarHBondContact O-NH1 2.74Å; H420-R422 VanDerWaalsContact O-NH1 3.12Å; R422-V424 PolarHBondContact O-N 3.09Å | ||
| 423 | P | 91 | Very high | 93.3 | Very high | 53 Ų | 53 | 74.1 Ų | 74.1 | 34% | 0.344 | 37% | 0.37 | S | S | . | . | S | Bend | trans | -60.3 | -36.9 | -179.2 | -23.1 | 33.9 | 0 | 0 | 0 | 112.6 | R266 | R266-P423 HydrophobicContact CB-CB 4.36Å; R266-P423 HydrophobicContact CG-CB 3.69Å; R266-P423 HydrophobicContact CG-CG 4.39Å |
| 424 | V | 92.2 | Very high | 93.3 | Very high | 9 Ų | 9 | 74 Ų | 74 | 6% | 0.055 | 37% | 0.37 | C | S | . | . | S | Bend | trans | -114.7 | 132.9 | 167 | 178.9 | 0 | 0 | 0 | 0 | 107.6 | A101 E102 T105 P270 R422 | A101-V424 HydrophobicContact CB-CG1 4.06Å; E102-V424 WeakPolarHBondContact CB-O 3.21Å; E102-V424 WeakPolarHBondContact CG-O 3.27Å; T105-V424 HydrophobicContact CG2-CB 4.29Å; T105-V424 HydrophobicContact CG2-CG2 3.79Å; T105-V424 WeakPolarHBondContact OG1-CB 3.27Å; T105-V424 PolarHBondContact OG1-N 3.17Å; P270-V424 HydrophobicContact CB-CG1 4.45Å; P270-V424 HydrophobicContact CG-CG2 3.99Å; R422-V424 PolarHBondContact O-N 3.09Å |
| 425 | K | 93.7 | Very high | 93.3 | Very high | 143 Ų | 143 | 74 Ų | 74 | 62% | 0.622 | 37% | 0.374 | S | S | * | . | trans | -125.2 | 108.8 | -179.3 | -171.3 | -177.2 | 178.6 | -176.6 | 0 | 109.2 | ||||
| 426 | A | 93.5 | Very high | 93.4 | Very high | 1 Ų | 1 | 72.7 Ų | 72.7 | 1% | 0.008 | 37% | 0.368 | C | S | . | . | trans | -70.9 | 138 | 171.9 | 0 | 0 | 0 | 0 | 0 | 110.3 | Y98 E102 R414 I428 | Y98-A426 HydrophobicContact CD1-CB 3.82Å; Y98-A426 HydrophobicContact CE1-CB 4.3Å; E102-A426 HydrophobicContact CB-CB 4.33Å; E102-A426 WeakPolarHBondContact OE2-CB 3.44Å; E102-A426 PolarHBondContact OE2-N 3.49Å; R414-A426 PolarHBondContact NH2-O 2.96Å; A426-I428 PolarHBondContact O-N 3.34Å | ||
| 427 | P | 95.2 | Very high | 93.4 | Very high | 60 Ų | 60 | 71.1 Ų | 71.1 | 39% | 0.39 | 36% | 0.355 | S | S | . | . | trans | -54.2 | 131.1 | 166 | -24.3 | 34.2 | 0 | 0 | 0 | 109.9 | L429 F430 | P427-L429 PolarHBondContact O-N 3.1Å; P427-L429 VanDerWaalsContact O-N 3.16Å; P427-F430 HydrophobicContact CB-CD1 4.16Å; P427-F430 HydrophobicContact CB-CD2 4.33Å; P427-F430 HydrophobicContact CB-CE1 4.29Å; P427-F430 HydrophobicContact CB-CE2 4.46Å; P427-F430 HydrophobicContact CB-CG 4.17Å; P427-F430 HydrophobicContact CB-CZ 4.44Å; P427-F430 HydrophobicContact CG-CD1 4.46Å; P427-F430 HydrophobicContact CG-CD2 4.01Å; P427-F430 HydrophobicContact CG-CE1 4.26Å; P427-F430 HydrophobicContact CG-CE2 3.78Å; P427-F430 HydrophobicContact CG-CG 4.34Å; P427-F430 HydrophobicContact CG-CZ 3.92Å; P427-F430 WeakPolarHBondContact O-CB 3.4Å; P427-F430 PolarHBondContact O-N 3.14Å | ||
| 428 | I | 94.9 | Very high | 93.6 | Very high | 76 Ų | 76 | 68.3 Ų | 68.3 | 39% | 0.39 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -62.1 | -28 | -177.9 | -162.2 | 167.9 | 0 | 0 | 0 | 112 | R414 A426 F430 A431 I432 | R414-I428 HydrophobicContact CB-CD1 4.33Å; R414-I428 HydrophobicContact CG-CD1 3.98Å; A426-I428 PolarHBondContact O-N 3.34Å; I428-F430 PolarHBondContact O-N 3.44Å; I428-A431 PolarHBondContact O-N 3.34Å; I428-A431 VanDerWaalsContact O-N 3.17Å; I428-I432 HydrophobicContact CG1-CD1 4.22Å; I428-I432 HydrophobicContact CG1-CG1 4.46Å; I428-I432 HydrophobicContact CG2-CD1 4.42Å; I428-I432 WeakPolarHBondContact O-CG1 3.28Å; I428-I432 PolarHBondContact O-N 2.94Å |
| 429 | L | 96.2 | Very high | 93.8 | Very high | 101 Ų | 101 | 63.6 Ų | 63.6 | 53% | 0.529 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -57 | -37.2 | 174.9 | -176.4 | 62.4 | 0 | 0 | 0 | 112 | P427 I432 I433 | P427-L429 PolarHBondContact O-N 3.1Å; P427-L429 VanDerWaalsContact O-N 3.16Å; L429-I432 PolarHBondContact O-N 3.4Å; L429-I433 HydrophobicContact CD1-CD1 3.96Å; L429-I433 HydrophobicContact CD1-CG1 4.14Å; L429-I433 HydrophobicContact CD2-CD1 4.39Å; L429-I433 HydrophobicContact CG-CD1 3.75Å; L429-I433 HydrophobicContact CG-CG1 4.34Å; L429-I433 WeakPolarHBondContact O-CB 3.28Å; L429-I433 VanDerWaalsContact O-CG1 3.26Å; L429-I433 WeakPolarHBondContact O-CG1 3.38Å; L429-I433 PolarHBondContact O-N 3.09Å |
| 430 | F | 96 | Very high | 93.9 | Very high | 65 Ų | 65 | 60 Ų | 60 | 29% | 0.285 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -64.6 | -44.3 | 178.5 | -65.2 | -1.8 | 0 | 0 | 0 | 110.9 | L95 Y98 P427 I428 Y434 | L95-F430 HydrophobicContact CD2-CB 4.02Å; L95-F430 HydrophobicContact CD2-CD1 3.68Å; L95-F430 HydrophobicContact CD2-CD2 3.87Å; L95-F430 HydrophobicContact CD2-CE1 4.04Å; L95-F430 HydrophobicContact CD2-CE2 4.21Å; L95-F430 HydrophobicContact CD2-CG 3.6Å; L95-F430 HydrophobicContact CD2-CZ 4.3Å; Y98-F430 HydrophobicContact CD1-CD2 4.21Å; Y98-F430 HydrophobicContact CD1-CE2 4.34Å; P427-F430 HydrophobicContact CB-CD1 4.16Å; P427-F430 HydrophobicContact CB-CD2 4.33Å; P427-F430 HydrophobicContact CB-CE1 4.29Å; P427-F430 HydrophobicContact CB-CE2 4.46Å; P427-F430 HydrophobicContact CB-CG 4.17Å; P427-F430 HydrophobicContact CB-CZ 4.44Å; P427-F430 HydrophobicContact CG-CD1 4.46Å; P427-F430 HydrophobicContact CG-CD2 4.01Å; P427-F430 HydrophobicContact CG-CE1 4.26Å; P427-F430 HydrophobicContact CG-CE2 3.78Å; P427-F430 HydrophobicContact CG-CG 4.34Å; P427-F430 HydrophobicContact CG-CZ 3.92Å; P427-F430 WeakPolarHBondContact O-CB 3.4Å; P427-F430 PolarHBondContact O-N 3.14Å; I428-F430 PolarHBondContact O-N 3.44Å; F430-Y434 VanDerWaalsContact O-CB 3.26Å; F430-Y434 WeakPolarHBondContact O-CB 3.34Å; F430-Y434 PolarHBondContact O-N 3.31Å |
| 431 | A | 96.4 | Very high | 93.9 | Very high | 0 Ų | 0 | 56.3 Ų | 56.3 | 0% | 0 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -64.8 | -41.4 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | V407 V410 I411 I428 Y434 V435 | V407-A431 HydrophobicContact CG1-CB 4.02Å; V410-A431 HydrophobicContact CB-CB 4.26Å; V410-A431 HydrophobicContact CG1-CB 4.25Å; I411-A431 HydrophobicContact CD1-CB 4.29Å; I411-A431 HydrophobicContact CG1-CB 3.9Å; I428-A431 PolarHBondContact O-N 3.34Å; I428-A431 VanDerWaalsContact O-N 3.17Å; A431-Y434 PolarHBondContact O-N 3.19Å; A431-V435 WeakPolarHBondContact O-CB 3.38Å; A431-V435 VanDerWaalsContact O-CG2 3.23Å; A431-V435 WeakPolarHBondContact O-CG2 3.38Å; A431-V435 PolarHBondContact O-N 3.36Å |
| 432 | I | 97 | Very high | 93.7 | Very high | 68 Ų | 68 | 52.3 Ų | 52.3 | 35% | 0.349 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -62.8 | -50.9 | 178 | -66.4 | 165.8 | 0 | 0 | 0 | 110.6 | I411 I428 L429 Y434 V435 L436 | I411-I432 HydrophobicContact CD1-CG1 4.16Å; I428-I432 HydrophobicContact CG1-CD1 4.22Å; I428-I432 HydrophobicContact CG1-CG1 4.46Å; I428-I432 HydrophobicContact CG2-CD1 4.42Å; I428-I432 WeakPolarHBondContact O-CG1 3.28Å; I428-I432 PolarHBondContact O-N 2.94Å; L429-I432 PolarHBondContact O-N 3.4Å; I432-Y434 VanDerWaalsContact C-N 3.31Å; I432-Y434 PolarHBondContact O-N 3.26Å; I432-V435 PolarHBondContact O-N 3.08Å; I432-L436 HydrophobicContact CG2-CD1 3.9Å; I432-L436 HydrophobicContact CG2-CG 4.37Å; I432-L436 WeakPolarHBondContact O-CB 3.49Å; I432-L436 VanDerWaalsContact O-CG 3.31Å; I432-L436 WeakPolarHBondContact O-CG 3.32Å; I432-L436 PolarHBondContact O-N 3.31Å |
| 433 | I | 96.5 | Very high | 93.4 | Very high | 63 Ų | 63 | 54.1 Ų | 54.1 | 32% | 0.323 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -58.4 | -46.4 | 178.4 | -68.9 | 169.3 | 0 | 0 | 0 | 110.2 | L95 L429 V435 L436 I437 | L95-I433 HydrophobicContact CD1-CG2 4.07Å; L429-I433 HydrophobicContact CD1-CD1 3.96Å; L429-I433 HydrophobicContact CD1-CG1 4.14Å; L429-I433 HydrophobicContact CD2-CD1 4.39Å; L429-I433 HydrophobicContact CG-CD1 3.75Å; L429-I433 HydrophobicContact CG-CG1 4.34Å; L429-I433 WeakPolarHBondContact O-CB 3.28Å; L429-I433 VanDerWaalsContact O-CG1 3.26Å; L429-I433 WeakPolarHBondContact O-CG1 3.38Å; L429-I433 PolarHBondContact O-N 3.09Å; I433-V435 PolarHBondContact O-N 3.18Å; I433-L436 PolarHBondContact O-N 3.21Å; I433-I437 HydrophobicContact CG2-CD1 3.67Å; I433-I437 HydrophobicContact CG2-CG1 4.45Å; I433-I437 WeakPolarHBondContact O-CG1 3.43Å; I433-I437 PolarHBondContact O-N 2.9Å |
| 434 | Y | 96 | Very high | 93.1 | Very high | 0 Ų | 0 | 54.5 Ų | 54.5 | 0% | 0 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -62.2 | -45.2 | -179 | -166.3 | -79.1 | 0 | 0 | 0 | 112 | F92 L95 G96 I403 V407 F430 A431 I432 T438 | F92-Y434 HydrophobicContact CD1-CD2 4.39Å; F92-Y434 AromaticContact CD1-CE2 3.74Å; F92-Y434 HydrophobicContact CD1-CE2 3.74Å; F92-Y434 AromaticContact CD2-CD2 3.87Å; F92-Y434 HydrophobicContact CD2-CD2 3.87Å; F92-Y434 HydrophobicContact CD2-CE2 4.05Å; F92-Y434 HydrophobicContact CE1-CD2 4.11Å; F92-Y434 HydrophobicContact CE1-CE1 4.24Å; F92-Y434 AromaticContact CE1-CE2 3.37Å; F92-Y434 HydrophobicContact CE1-CE2 3.37Å; F92-Y434 AromaticContact CE1-CZ 3.44Å; F92-Y434 VanDerWaalsContact CE1-CZ 3.44Å; F92-Y434 WeakPolarHBondContact CE1-OH 3.46Å; F92-Y434 HydrophobicContact CE2-CD1 4.26Å; F92-Y434 AromaticContact CE2-CD2 3.47Å; F92-Y434 HydrophobicContact CE2-CD2 3.47Å; F92-Y434 VanDerWaalsContact CE2-CD2 3.47Å; F92-Y434 HydrophobicContact CE2-CE1 4.38Å; F92-Y434 AromaticContact CE2-CE2 3.65Å; F92-Y434 HydrophobicContact CE2-CE2 3.65Å; F92-Y434 AromaticContact CE2-CG 3.81Å; F92-Y434 HydrophobicContact CE2-CG 3.81Å; F92-Y434 HydrophobicContact CG-CD2 4.33Å; F92-Y434 HydrophobicContact CG-CE2 4.11Å; F92-Y434 HydrophobicContact CZ-CD1 4.03Å; F92-Y434 AromaticContact CZ-CD2 3.64Å; F92-Y434 HydrophobicContact CZ-CD2 3.64Å; F92-Y434 AromaticContact CZ-CE1 3.73Å; F92-Y434 HydrophobicContact CZ-CE1 3.73Å; F92-Y434 AromaticContact CZ-CE2 3.33Å; F92-Y434 HydrophobicContact CZ-CE2 3.33Å; F92-Y434 AromaticContact CZ-CG 3.99Å; F92-Y434 HydrophobicContact CZ-CG 3.99Å; F92-Y434 AromaticContact CZ-CZ 3.37Å; F92-Y434 WeakPolarHBondContact O-CD2 3.5Å; F92-Y434 VanDerWaalsContact O-CE2 3.27Å; F92-Y434 WeakPolarHBondContact O-CE2 3.26Å; L95-Y434 HydrophobicContact CB-CD2 4.23Å; G96-Y434 VanDerWaalsContact CA-CD2 3.43Å; G96-Y434 VanDerWaalsContact N-CD2 3.34Å; I403-Y434 HydrophobicContact CG2-CE1 3.91Å; I403-Y434 VanDerWaalsContact CG2-OH 3.22Å; I403-Y434 WeakPolarHBondContact CG2-OH 3.48Å; V407-Y434 HydrophobicContact CB-CD1 3.85Å; V407-Y434 HydrophobicContact CB-CE1 4.33Å; V407-Y434 HydrophobicContact CG1-CD1 3.92Å; V407-Y434 HydrophobicContact CG1-CG 4.15Å; V407-Y434 HydrophobicContact CG2-CD1 3.67Å; V407-Y434 HydrophobicContact CG2-CE1 3.75Å; V407-Y434 HydrophobicContact CG2-CG 4.29Å; F430-Y434 VanDerWaalsContact O-CB 3.26Å; F430-Y434 WeakPolarHBondContact O-CB 3.34Å; F430-Y434 PolarHBondContact O-N 3.31Å; A431-Y434 PolarHBondContact O-N 3.19Å; I432-Y434 VanDerWaalsContact C-N 3.31Å; I432-Y434 PolarHBondContact O-N 3.26Å; Y434-T438 WeakPolarHBondContact CD1-OG1 3.17Å; Y434-T438 VanDerWaalsContact CE1-OG1 3.29Å; Y434-T438 WeakPolarHBondContact CE1-OG1 3.39Å; Y434-T438 WeakPolarHBondContact O-CB 3.49Å; Y434-T438 PolarHBondContact O-N 2.74Å; Y434-T438 PolarHBondContact O-OG1 3.41Å |
| 435 | V | 96.2 | Very high | 92.5 | Very high | 39 Ų | 39 | 54.5 Ų | 54.5 | 24% | 0.236 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -65.3 | -41.4 | 178.6 | 170.1 | 0 | 0 | 0 | 0 | 111.3 | V407 I411 A431 I432 I433 T438 L439 | V407-V435 HydrophobicContact CB-CG2 4.48Å; V407-V435 HydrophobicContact CG1-CG2 4.22Å; I411-V435 HydrophobicContact CD1-CG2 4.18Å; A431-V435 WeakPolarHBondContact O-CB 3.38Å; A431-V435 VanDerWaalsContact O-CG2 3.23Å; A431-V435 WeakPolarHBondContact O-CG2 3.38Å; A431-V435 PolarHBondContact O-N 3.36Å; I432-V435 PolarHBondContact O-N 3.08Å; I433-V435 PolarHBondContact O-N 3.18Å; V435-T438 PolarHBondContact O-N 2.63Å; V435-L439 WeakPolarHBondContact O-CB 3.11Å; V435-L439 PolarHBondContact O-N 3.13Å |
| 436 | L | 95.6 | Very high | 91.9 | Very high | 109 Ų | 109 | 51.4 Ų | 51.4 | 57% | 0.571 | 26% | 0.263 | S | S | * | . | H | α-helix | trans | -63.6 | -46.5 | 177.5 | -72.5 | 175 | 0 | 0 | 0 | 112.1 | I432 I433 L439 F440 | I432-L436 HydrophobicContact CG2-CD1 3.9Å; I432-L436 HydrophobicContact CG2-CG 4.37Å; I432-L436 WeakPolarHBondContact O-CB 3.49Å; I432-L436 VanDerWaalsContact O-CG 3.31Å; I432-L436 WeakPolarHBondContact O-CG 3.32Å; I432-L436 PolarHBondContact O-N 3.31Å; I433-L436 PolarHBondContact O-N 3.21Å; L436-L439 PolarHBondContact O-N 3.31Å; L436-F440 WeakPolarHBondContact O-CB 3.37Å; L436-F440 PolarHBondContact O-N 3.18Å |
| 437 | I | 93.9 | Very high | 91.3 | Very high | 58 Ų | 58 | 56.6 Ų | 56.6 | 30% | 0.297 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -65.8 | -41.4 | 177 | -66.9 | 169.4 | 0 | 0 | 0 | 110.2 | F92 I433 L439 F440 L441 | F92-I437 HydrophobicContact CD2-CB 4.14Å; F92-I437 HydrophobicContact CD2-CD1 3.94Å; F92-I437 HydrophobicContact CD2-CG2 3.78Å; F92-I437 HydrophobicContact CE2-CB 3.62Å; F92-I437 HydrophobicContact CE2-CD1 4.25Å; F92-I437 HydrophobicContact CE2-CG2 3.43Å; F92-I437 VanDerWaalsContact CE2-CG2 3.43Å; F92-I437 HydrophobicContact CZ-CB 4.48Å; F92-I437 HydrophobicContact CZ-CG2 4.05Å; I433-I437 HydrophobicContact CG2-CD1 3.67Å; I433-I437 HydrophobicContact CG2-CG1 4.45Å; I433-I437 WeakPolarHBondContact O-CG1 3.43Å; I433-I437 PolarHBondContact O-N 2.9Å; I437-L439 VanDerWaalsContact C-N 3.32Å; I437-L439 PolarHBondContact O-N 3.31Å; I437-F440 WeakPolarHBondContact O-CB 3.47Å; I437-F440 PolarHBondContact O-N 3.29Å; I437-L441 HydrophobicContact CG2-CD1 3.99Å; I437-L441 HydrophobicContact CG2-CG 4.24Å; I437-L441 VanDerWaalsContact O-CG 3.28Å; I437-L441 WeakPolarHBondContact O-CG 3.32Å; I437-L441 PolarHBondContact O-N 3.45Å |
| 438 | T | 93.5 | Very high | 90.5 | Very high | 7 Ų | 7 | 56 Ų | 56 | 4% | 0.043 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -62.3 | -41.8 | 176.6 | -52.7 | 0 | 0 | 0 | 0 | 111.3 | W400 Y434 V435 L441 V442 | W400-T438 WeakPolarHBondContact O-CG2 3.3Å; Y434-T438 WeakPolarHBondContact CD1-OG1 3.17Å; Y434-T438 VanDerWaalsContact CE1-OG1 3.29Å; Y434-T438 WeakPolarHBondContact CE1-OG1 3.39Å; Y434-T438 WeakPolarHBondContact O-CB 3.49Å; Y434-T438 PolarHBondContact O-N 2.74Å; Y434-T438 PolarHBondContact O-OG1 3.41Å; V435-T438 PolarHBondContact O-N 2.63Å; T438-L441 PolarHBondContact O-N 3.11Å; T438-V442 HydrophobicContact CG2-CG2 4.26Å; T438-V442 VanDerWaalsContact O-CB 3.27Å; T438-V442 WeakPolarHBondContact O-CB 3.49Å; T438-V442 WeakPolarHBondContact O-CG2 3.46Å; T438-V442 PolarHBondContact O-N 2.85Å |
| 439 | L | 91.4 | Very high | 89.7 | Confident | 97 Ų | 97 | 54 Ų | 54 | 51% | 0.508 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -62.4 | -43.6 | 175.9 | -177.4 | 65.1 | 0 | 0 | 0 | 111.4 | V435 L436 I437 V442 I443 | V435-L439 WeakPolarHBondContact O-CB 3.11Å; V435-L439 PolarHBondContact O-N 3.13Å; L436-L439 PolarHBondContact O-N 3.31Å; I437-L439 VanDerWaalsContact C-N 3.32Å; I437-L439 PolarHBondContact O-N 3.31Å; L439-V442 PolarHBondContact O-N 3.27Å; L439-I443 HydrophobicContact CD1-CD1 4.08Å; L439-I443 HydrophobicContact CD1-CG1 4.38Å; L439-I443 HydrophobicContact CG-CD1 3.88Å; L439-I443 VanDerWaalsContact O-CG1 3.27Å; L439-I443 WeakPolarHBondContact O-CG1 3.33Å; L439-I443 PolarHBondContact O-N 2.91Å |
| 440 | F | 91 | Very high | 89.1 | Confident | 80 Ų | 80 | 52.2 Ų | 52.2 | 35% | 0.351 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -58 | -53.3 | 174.1 | 172 | -90.5 | 0 | 0 | 0 | 111.5 | P235 T239 L436 I437 V442 I443 F444 | P235-F440 HydrophobicContact CB-CZ 4.19Å; T239-F440 WeakPolarHBondContact OG1-CE1 3.28Å; L436-F440 WeakPolarHBondContact O-CB 3.37Å; L436-F440 PolarHBondContact O-N 3.18Å; I437-F440 WeakPolarHBondContact O-CB 3.47Å; I437-F440 PolarHBondContact O-N 3.29Å; F440-V442 PolarHBondContact O-N 2.94Å; F440-I443 PolarHBondContact O-N 3.29Å; F440-F444 HydrophobicContact CD1-CD2 4.39Å; F440-F444 AromaticContact CD2-CD2 3.71Å; F440-F444 HydrophobicContact CD2-CD2 3.71Å; F440-F444 AromaticContact CD2-CE2 3.58Å; F440-F444 HydrophobicContact CD2-CE2 3.58Å; F440-F444 HydrophobicContact CE1-CD2 4.17Å; F440-F444 AromaticContact CE2-CD2 3.47Å; F440-F444 HydrophobicContact CE2-CD2 3.47Å; F440-F444 VanDerWaalsContact CE2-CD2 3.47Å; F440-F444 AromaticContact CE2-CE2 3.16Å; F440-F444 HydrophobicContact CE2-CE2 3.16Å; F440-F444 HydrophobicContact CE2-CZ 4.06Å; F440-F444 HydrophobicContact CG-CD2 4.17Å; F440-F444 HydrophobicContact CG-CE2 4.47Å; F440-F444 AromaticContact CZ-CD2 3.71Å; F440-F444 HydrophobicContact CZ-CD2 3.71Å; F440-F444 AromaticContact CZ-CE2 3.76Å; F440-F444 HydrophobicContact CZ-CE2 3.76Å; F440-F444 HydrophobicContact CZ-CG 4.47Å; F440-F444 WeakPolarHBondContact O-CD2 3.36Å; F440-F444 PolarHBondContact O-N 2.93Å |
| 441 | L | 88.5 | Confident | 88.6 | Confident | 5 Ų | 5 | 53.5 Ų | 53.5 | 3% | 0.026 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -58 | -38.6 | 178 | -68.1 | 172.7 | 0 | 0 | 0 | 111.2 | T239 F242 Y243 L246 I437 T438 A445 | T239-L441 HydrophobicContact CG2-CD2 3.95Å; F242-L441 HydrophobicContact CB-CD2 3.88Å; F242-L441 HydrophobicContact CD1-CD1 3.58Å; F242-L441 HydrophobicContact CD1-CD2 3.88Å; F242-L441 HydrophobicContact CD1-CG 4.35Å; F242-L441 HydrophobicContact CE1-CD1 3.99Å; F242-L441 HydrophobicContact CG-CD2 4.13Å; Y243-L441 HydrophobicContact CE2-CB 4.15Å; Y243-L441 WeakPolarHBondContact CE2-O 3.31Å; Y243-L441 PolarHBondContact OH-O 3.41Å; L246-L441 HydrophobicContact CD1-CD1 3.87Å; I437-L441 HydrophobicContact CG2-CD1 3.99Å; I437-L441 HydrophobicContact CG2-CG 4.24Å; I437-L441 VanDerWaalsContact O-CG 3.28Å; I437-L441 WeakPolarHBondContact O-CG 3.32Å; I437-L441 PolarHBondContact O-N 3.45Å; T438-L441 PolarHBondContact O-N 3.11Å; L441-A445 WeakPolarHBondContact O-CB 3.37Å; L441-A445 PolarHBondContact O-N 2.89Å |
| 442 | V | 86.2 | Confident | 88 | Confident | 14 Ų | 14 | 57.2 Ų | 57.2 | 9% | 0.085 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -67.8 | -46.7 | -178.8 | 156.7 | 0 | 0 | 0 | 0 | 111.5 | Y243 F397 L401 T438 L439 F440 A445 F446 | Y243-V442 PolarHBondContact OH-N 3.15Å; F397-V442 HydrophobicContact CD2-CG2 4.44Å; F397-V442 HydrophobicContact CE2-CB 3.82Å; F397-V442 HydrophobicContact CE2-CG1 3.69Å; F397-V442 HydrophobicContact CE2-CG2 3.68Å; F397-V442 HydrophobicContact CZ-CB 4.3Å; F397-V442 HydrophobicContact CZ-CG1 3.72Å; F397-V442 HydrophobicContact CZ-CG2 4.11Å; L401-V442 HydrophobicContact CB-CG2 4.09Å; L401-V442 HydrophobicContact CD1-CG1 4.3Å; L401-V442 HydrophobicContact CD1-CG2 4.05Å; T438-V442 HydrophobicContact CG2-CG2 4.26Å; T438-V442 VanDerWaalsContact O-CB 3.27Å; T438-V442 WeakPolarHBondContact O-CB 3.49Å; T438-V442 WeakPolarHBondContact O-CG2 3.46Å; T438-V442 PolarHBondContact O-N 2.85Å; L439-V442 PolarHBondContact O-N 3.27Å; F440-V442 PolarHBondContact O-N 2.94Å; V442-A445 PolarHBondContact O-N 3.45Å; V442-F446 HydrophobicContact CG1-CD2 4.41Å; V442-F446 HydrophobicContact CG1-CE2 4.37Å; V442-F446 WeakPolarHBondContact O-CD2 3.49Å; V442-F446 PolarHBondContact O-N 3.33Å |
| 443 | I | 87.1 | Confident | 87.2 | Confident | 89 Ų | 89 | 54.1 Ų | 54.1 | 46% | 0.456 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -61.8 | -47.7 | 179.4 | -69.6 | 165.8 | 0 | 0 | 0 | 110.2 | L439 F440 A445 F446 V447 | L439-I443 HydrophobicContact CD1-CD1 4.08Å; L439-I443 HydrophobicContact CD1-CG1 4.38Å; L439-I443 HydrophobicContact CG-CD1 3.88Å; L439-I443 VanDerWaalsContact O-CG1 3.27Å; L439-I443 WeakPolarHBondContact O-CG1 3.33Å; L439-I443 PolarHBondContact O-N 2.91Å; F440-I443 PolarHBondContact O-N 3.29Å; I443-A445 VanDerWaalsContact C-N 3.3Å; I443-A445 PolarHBondContact O-N 3.31Å; I443-F446 PolarHBondContact O-N 2.85Å; I443-V447 PolarHBondContact O-N 3.37Å |
| 444 | F | 84.3 | Confident | 86.8 | Confident | 61 Ų | 61 | 56.2 Ų | 56.2 | 27% | 0.268 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -70.7 | -24.2 | -179.1 | -82.1 | -82.3 | 0 | 0 | 0 | 113.2 | P235 T239 F440 V447 A448 | P235-F444 HydrophobicContact CB-CD1 4.23Å; P235-F444 HydrophobicContact CB-CE1 3.7Å; P235-F444 HydrophobicContact CB-CE2 4.49Å; P235-F444 HydrophobicContact CB-CZ 3.85Å; T239-F444 HydrophobicContact CG2-CB 3.78Å; T239-F444 WeakPolarHBondContact OG1-CB 3.32Å; F440-F444 HydrophobicContact CD1-CD2 4.39Å; F440-F444 AromaticContact CD2-CD2 3.71Å; F440-F444 HydrophobicContact CD2-CD2 3.71Å; F440-F444 AromaticContact CD2-CE2 3.58Å; F440-F444 HydrophobicContact CD2-CE2 3.58Å; F440-F444 HydrophobicContact CE1-CD2 4.17Å; F440-F444 AromaticContact CE2-CD2 3.47Å; F440-F444 HydrophobicContact CE2-CD2 3.47Å; F440-F444 VanDerWaalsContact CE2-CD2 3.47Å; F440-F444 AromaticContact CE2-CE2 3.16Å; F440-F444 HydrophobicContact CE2-CE2 3.16Å; F440-F444 HydrophobicContact CE2-CZ 4.06Å; F440-F444 HydrophobicContact CG-CD2 4.17Å; F440-F444 HydrophobicContact CG-CE2 4.47Å; F440-F444 AromaticContact CZ-CD2 3.71Å; F440-F444 HydrophobicContact CZ-CD2 3.71Å; F440-F444 AromaticContact CZ-CE2 3.76Å; F440-F444 HydrophobicContact CZ-CE2 3.76Å; F440-F444 HydrophobicContact CZ-CG 4.47Å; F440-F444 WeakPolarHBondContact O-CD2 3.36Å; F440-F444 PolarHBondContact O-N 2.93Å; F444-V447 PolarHBondContact O-N 3.4Å; F444-A448 WeakPolarHBondContact O-CB 3.21Å; F444-A448 PolarHBondContact O-N 3.28Å |
| 445 | A | 79 | Confident | 86.4 | Confident | 9 Ų | 9 | 59.8 Ų | 59.8 | 7% | 0.074 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -64.3 | -43.7 | 170 | 0 | 0 | 0 | 0 | 0 | 112.3 | Y243 F397 L441 V442 I443 V447 A448 A449 S453 | Y243-A445 HydrophobicContact CE2-CB 3.75Å; F397-A445 HydrophobicContact CD2-CB 3.4Å; F397-A445 VanDerWaalsContact CD2-CB 3.4Å; F397-A445 HydrophobicContact CE2-CB 3.77Å; F397-A445 HydrophobicContact CG-CB 4.41Å; L441-A445 WeakPolarHBondContact O-CB 3.37Å; L441-A445 PolarHBondContact O-N 2.89Å; V442-A445 PolarHBondContact O-N 3.45Å; I443-A445 VanDerWaalsContact C-N 3.3Å; I443-A445 PolarHBondContact O-N 3.31Å; A445-V447 VanDerWaalsContact C-N 3.25Å; A445-V447 PolarHBondContact O-N 3.41Å; A445-A448 PolarHBondContact O-N 3.2Å; A445-A449 CarbonylContact O-C 3.59Å; A445-A449 WeakPolarHBondContact O-CA 3.06Å; A445-A449 PolarHBondContact O-N 2.74Å; A445-S453 PolarHBondContact O-OG 3.16Å |
| 446 | F | 81 | Confident | 86 | Confident | 77 Ų | 77 | 57.9 Ų | 57.9 | 34% | 0.338 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -65 | -30.7 | 175.9 | -84.6 | -74.4 | 0 | 0 | 0 | 112.9 | F397 V442 I443 P450 L454 V457 | F397-F446 AromaticContact CE1-CE2 3.82Å; F397-F446 HydrophobicContact CE1-CE2 3.82Å; F397-F446 AromaticContact CE1-CZ 3.93Å; F397-F446 HydrophobicContact CE1-CZ 3.93Å; F397-F446 HydrophobicContact CE2-CD2 4.12Å; F397-F446 AromaticContact CE2-CE2 3.98Å; F397-F446 HydrophobicContact CE2-CE2 3.98Å; F397-F446 AromaticContact CZ-CD2 3.84Å; F397-F446 HydrophobicContact CZ-CD2 3.84Å; F397-F446 AromaticContact CZ-CE2 3.24Å; F397-F446 HydrophobicContact CZ-CE2 3.24Å; F397-F446 AromaticContact CZ-CZ 3.84Å; F397-F446 HydrophobicContact CZ-CZ 3.84Å; V442-F446 HydrophobicContact CG1-CD2 4.41Å; V442-F446 HydrophobicContact CG1-CE2 4.37Å; V442-F446 WeakPolarHBondContact O-CD2 3.49Å; V442-F446 PolarHBondContact O-N 3.33Å; I443-F446 PolarHBondContact O-N 2.85Å; F446-P450 WeakPolarHBondContact O-CA 3.06Å; F446-P450 WeakPolarHBondContact O-CB 3.49Å; F446-L454 HydrophobicContact CE1-CD2 4.48Å; F446-V457 HydrophobicContact CZ-CG2 4.12Å |
| 447 | V | 82.3 | Confident | 85.6 | Confident | 110 Ų | 110 | 55.1 Ų | 55.1 | 67% | 0.667 | 31% | 0.305 | S | S | * | . | H | α-helix | trans | -76.4 | -41.5 | 176.1 | 176.8 | 0 | 0 | 0 | 0 | 111.3 | I443 F444 A445 | I443-V447 PolarHBondContact O-N 3.37Å; F444-V447 PolarHBondContact O-N 3.4Å; A445-V447 VanDerWaalsContact C-N 3.25Å; A445-V447 PolarHBondContact O-N 3.41Å |
| 448 | A | 77.9 | Confident | 85.5 | Confident | 49 Ų | 49 | 54.7 Ų | 54.7 | 41% | 0.405 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -82.2 | -34.6 | -175 | 0 | 0 | 0 | 0 | 0 | 113.9 | F444 A445 | F444-A448 WeakPolarHBondContact O-CB 3.21Å; F444-A448 PolarHBondContact O-N 3.28Å; A445-A448 PolarHBondContact O-N 3.2Å |
| 449 | A | 78 | Confident | 85.2 | Confident | 32 Ų | 32 | 55.8 Ų | 55.8 | 26% | 0.264 | 32% | 0.315 | S | S | . | . | trans | -142.7 | 66.6 | -173.3 | 0 | 0 | 0 | 0 | 0 | 110.8 | A445 V451 E452 S453 | A445-A449 CarbonylContact O-C 3.59Å; A445-A449 WeakPolarHBondContact O-CA 3.06Å; A445-A449 PolarHBondContact O-N 2.74Å; A449-V451 PolarHBondContact O-N 3.07Å; A449-E452 VanDerWaalsContact C-OE2 3.3Å; A449-E452 WeakPolarHBondContact CA-OE2 3.4Å; A449-E452 HydrophobicContact CB-CB 4.34Å; A449-E452 WeakPolarHBondContact CB-OE2 3.39Å; A449-S453 WeakPolarHBondContact O-CB 3.47Å; A449-S453 PolarHBondContact O-N 3.05Å; A449-S453 VanDerWaalsContact O-N 3.11Å; A449-S453 PolarHBondContact O-OG 3.4Å | ||
| 450 | P | 83.6 | Confident | 85.1 | Confident | 64 Ų | 64 | 52.7 Ų | 52.7 | 42% | 0.416 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -64.8 | -37.6 | -173.1 | 22.7 | -32.6 | 0 | 0 | 0 | 113.2 | F446 L454 | F446-P450 WeakPolarHBondContact O-CA 3.06Å; F446-P450 WeakPolarHBondContact O-CB 3.49Å; P450-L454 WeakPolarHBondContact O-CB 3.32Å; P450-L454 WeakPolarHBondContact O-CG 3.39Å; P450-L454 PolarHBondContact O-N 2.95Å |
| 451 | V | 86.3 | Confident | 85.2 | Confident | 93 Ų | 93 | 51.7 Ų | 51.7 | 56% | 0.564 | 30% | 0.301 | S | S | * | . | H | α-helix | trans | -68 | -48.9 | -175.7 | 177.4 | 0 | 0 | 0 | 0 | 110.2 | A449 S453 L454 L455 | A449-V451 PolarHBondContact O-N 3.07Å; V451-S453 VanDerWaalsContact C-N 3.32Å; V451-S453 PolarHBondContact O-N 3.26Å; V451-L454 PolarHBondContact O-N 3.4Å; V451-L455 HydrophobicContact CG1-CD1 4.09Å; V451-L455 HydrophobicContact CG1-CG 4.5Å; V451-L455 WeakPolarHBondContact O-CB 3.4Å; V451-L455 VanDerWaalsContact O-CG 3.3Å; V451-L455 WeakPolarHBondContact O-CG 3.38Å; V451-L455 PolarHBondContact O-N 2.72Å |
| 452 | E | 81.8 | Confident | 85.4 | Confident | 77 Ų | 77 | 54.9 Ų | 54.9 | 36% | 0.36 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -60.8 | -43.7 | 178.2 | -61.5 | 84.1 | 172.6 | 0 | 0 | 110.8 | Y394 A449 L455 G456 | Y394-E452 HydrophobicContact CD1-CB 3.84Å; Y394-E452 HydrophobicContact CD1-CG 3.87Å; Y394-E452 HydrophobicContact CE1-CB 4.26Å; Y394-E452 HydrophobicContact CE1-CG 3.78Å; A449-E452 VanDerWaalsContact C-OE2 3.3Å; A449-E452 WeakPolarHBondContact CA-OE2 3.4Å; A449-E452 HydrophobicContact CB-CB 4.34Å; A449-E452 WeakPolarHBondContact CB-OE2 3.39Å; E452-L455 PolarHBondContact O-N 2.66Å; E452-G456 PolarHBondContact O-N 3.2Å |
| 453 | S | 82.1 | Confident | 85.7 | Confident | 3 Ų | 3 | 54.2 Ų | 54.2 | 2% | 0.021 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -64.2 | -43.4 | 177.8 | -57.8 | 0 | 0 | 0 | 0 | 111.8 | A445 A449 V451 G456 V457 | A445-S453 PolarHBondContact O-OG 3.16Å; A449-S453 WeakPolarHBondContact O-CB 3.47Å; A449-S453 PolarHBondContact O-N 3.05Å; A449-S453 VanDerWaalsContact O-N 3.11Å; A449-S453 PolarHBondContact O-OG 3.4Å; V451-S453 VanDerWaalsContact C-N 3.32Å; V451-S453 PolarHBondContact O-N 3.26Å; S453-G456 PolarHBondContact O-N 3.28Å; S453-V457 WeakPolarHBondContact O-CG2 3.19Å; S453-V457 PolarHBondContact O-N 3.18Å; S453-V457 VanDerWaalsContact O-N 3.08Å |
| 454 | L | 87 | Confident | 86.1 | Confident | 108 Ų | 108 | 52.6 Ų | 52.6 | 57% | 0.565 | 31% | 0.309 | S | S | * | . | H | α-helix | trans | -66.8 | -40.1 | 176.8 | -75 | 170.9 | 0 | 0 | 0 | 112.3 | F446 P450 V451 G456 V457 A458 | F446-L454 HydrophobicContact CE1-CD2 4.48Å; P450-L454 WeakPolarHBondContact O-CB 3.32Å; P450-L454 WeakPolarHBondContact O-CG 3.39Å; P450-L454 PolarHBondContact O-N 2.95Å; V451-L454 PolarHBondContact O-N 3.4Å; L454-G456 VanDerWaalsContact C-N 3.33Å; L454-V457 PolarHBondContact O-N 2.99Å; L454-A458 WeakPolarHBondContact O-CB 3.45Å; L454-A458 PolarHBondContact O-N 2.96Å |
| 455 | L | 88.1 | Confident | 86.5 | Confident | 74 Ų | 74 | 53 Ų | 53 | 39% | 0.387 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -62.4 | -41.6 | 174.1 | -73.1 | 174.1 | 0 | 0 | 0 | 111.2 | Y394 V451 E452 V457 A458 I459 | Y394-L455 HydrophobicContact CD2-CD1 4.45Å; Y394-L455 HydrophobicContact CE1-CD1 4.31Å; Y394-L455 HydrophobicContact CE2-CD1 4.21Å; Y394-L455 HydrophobicContact CG-CB 4.43Å; V451-L455 HydrophobicContact CG1-CD1 4.09Å; V451-L455 HydrophobicContact CG1-CG 4.5Å; V451-L455 WeakPolarHBondContact O-CB 3.4Å; V451-L455 VanDerWaalsContact O-CG 3.3Å; V451-L455 WeakPolarHBondContact O-CG 3.38Å; V451-L455 PolarHBondContact O-N 2.72Å; E452-L455 PolarHBondContact O-N 2.66Å; L455-V457 PolarHBondContact O-N 3.49Å; L455-A458 WeakPolarHBondContact O-CB 3.24Å; L455-A458 PolarHBondContact O-N 3.39Å; L455-I459 VanDerWaalsContact O-CG1 3.28Å; L455-I459 WeakPolarHBondContact O-CG1 3.2Å; L455-I459 PolarHBondContact O-N 2.73Å |
| 456 | G | 86.7 | Confident | 87.1 | Confident | 0 Ų | 0 | 55.3 Ų | 55.3 | 0% | 0 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -55.9 | -49.6 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | Y394 V398 E452 S453 L454 A458 I459 I460 | Y394-G456 WeakPolarHBondContact O-CA 3.43Å; V398-G456 WeakPolarHBondContact CG2-O 3.33Å; E452-G456 PolarHBondContact O-N 3.2Å; S453-G456 PolarHBondContact O-N 3.28Å; L454-G456 VanDerWaalsContact C-N 3.33Å; G456-A458 VanDerWaalsContact C-N 3.34Å; G456-A458 PolarHBondContact O-N 3.49Å; G456-I459 PolarHBondContact O-N 2.97Å; G456-I460 PolarHBondContact O-N 3.35Å |
| 457 | V | 88.6 | Confident | 87.7 | Confident | 50 Ų | 50 | 53.4 Ų | 53.4 | 30% | 0.303 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -61.9 | -42.2 | 176.2 | 174.8 | 0 | 0 | 0 | 0 | 111.4 | F446 S453 L454 L455 I459 I460 C461 | F446-V457 HydrophobicContact CZ-CG2 4.12Å; S453-V457 WeakPolarHBondContact O-CG2 3.19Å; S453-V457 PolarHBondContact O-N 3.18Å; S453-V457 VanDerWaalsContact O-N 3.08Å; L454-V457 PolarHBondContact O-N 2.99Å; L455-V457 PolarHBondContact O-N 3.49Å; V457-I459 VanDerWaalsContact C-N 3.29Å; V457-I459 PolarHBondContact O-N 3.04Å; V457-I460 WeakPolarHBondContact O-CB 3.39Å; V457-I460 PolarHBondContact O-N 3.4Å; V457-I460 VanDerWaalsContact O-N 3.14Å; V457-C461 PolarHBondContact O-N 3.25Å; V457-C461 PolarHBondContact O-SG 2.88Å; V457-C461 VanDerWaalsContact O-SG 3.39Å |
| 458 | A | 90.3 | Very high | 88.1 | Confident | 50 Ų | 50 | 52.7 Ų | 52.7 | 41% | 0.413 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -59 | -41.7 | 177 | 0 | 0 | 0 | 0 | 0 | 111.5 | L454 L455 G456 I460 C461 T462 | L454-A458 WeakPolarHBondContact O-CB 3.45Å; L454-A458 PolarHBondContact O-N 2.96Å; L455-A458 WeakPolarHBondContact O-CB 3.24Å; L455-A458 PolarHBondContact O-N 3.39Å; G456-A458 VanDerWaalsContact C-N 3.34Å; G456-A458 PolarHBondContact O-N 3.49Å; A458-I460 VanDerWaalsContact C-N 3.35Å; A458-I460 PolarHBondContact O-N 3.32Å; A458-C461 WeakPolarHBondContact O-CB 3.27Å; A458-C461 PolarHBondContact O-N 3.25Å; A458-C461 VanDerWaalsContact O-N 3.13Å; A458-T462 WeakPolarHBondContact O-CG2 3.45Å; A458-T462 PolarHBondContact O-N 2.9Å |
| 459 | I | 88.9 | Confident | 88.6 | Confident | 30 Ų | 30 | 55.4 Ų | 55.4 | 15% | 0.154 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -61.1 | -41.4 | 175.9 | -65.5 | 160.3 | 0 | 0 | 0 | 111.1 | V136 L391 L395 L455 G456 V457 C461 T462 | V136-I459 HydrophobicContact CG1-CG2 4.09Å; V136-I459 HydrophobicContact CG2-CG2 4.32Å; L391-I459 HydrophobicContact CD1-CD1 3.74Å; L395-I459 HydrophobicContact CD2-CB 4.23Å; L395-I459 HydrophobicContact CD2-CD1 4.17Å; L395-I459 HydrophobicContact CD2-CG2 3.86Å; L395-I459 HydrophobicContact CG-CD1 4.4Å; L455-I459 VanDerWaalsContact O-CG1 3.28Å; L455-I459 WeakPolarHBondContact O-CG1 3.2Å; L455-I459 PolarHBondContact O-N 2.73Å; G456-I459 PolarHBondContact O-N 2.97Å; V457-I459 VanDerWaalsContact C-N 3.29Å; V457-I459 PolarHBondContact O-N 3.04Å; I459-C461 VanDerWaalsContact C-N 3.33Å; I459-C461 PolarHBondContact O-N 3.3Å; I459-T462 PolarHBondContact O-N 3.42Å; I459-T462 PolarHBondContact O-OG1 3.14Å |
| 460 | I | 89.4 | Confident | 88.9 | Confident | 31 Ų | 31 | 55.4 Ų | 55.4 | 16% | 0.159 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -60.9 | -45.7 | 173.6 | -55.1 | 170.1 | 0 | 0 | 0 | 110.5 | L128 V398 G456 V457 A458 T462 G463 | L128-I460 HydrophobicContact CB-CG2 4.15Å; L128-I460 HydrophobicContact CD2-CG2 4.38Å; V398-I460 HydrophobicContact CB-CD1 4.18Å; V398-I460 HydrophobicContact CG1-CD1 3.31Å; V398-I460 HydrophobicContact CG1-CG1 3.56Å; V398-I460 HydrophobicContact CG2-CD1 3.89Å; V398-I460 HydrophobicContact CG2-CG1 4.23Å; G456-I460 PolarHBondContact O-N 3.35Å; V457-I460 WeakPolarHBondContact O-CB 3.39Å; V457-I460 PolarHBondContact O-N 3.4Å; V457-I460 VanDerWaalsContact O-N 3.14Å; A458-I460 VanDerWaalsContact C-N 3.35Å; A458-I460 PolarHBondContact O-N 3.32Å; I460-T462 PolarHBondContact O-N 2.86Å; I460-G463 PolarHBondContact O-N 3.38Å |
| 461 | C | 91.8 | Very high | 89 | Confident | 60 Ų | 60 | 53.8 Ų | 53.8 | 41% | 0.405 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -63 | -24.8 | -178.7 | -70.7 | 0 | 0 | 0 | 0 | 113 | V457 A458 I459 G463 I464 P465 | V457-C461 PolarHBondContact O-N 3.25Å; V457-C461 PolarHBondContact O-SG 2.88Å; V457-C461 VanDerWaalsContact O-SG 3.39Å; A458-C461 WeakPolarHBondContact O-CB 3.27Å; A458-C461 PolarHBondContact O-N 3.25Å; A458-C461 VanDerWaalsContact O-N 3.13Å; I459-C461 VanDerWaalsContact C-N 3.33Å; I459-C461 PolarHBondContact O-N 3.3Å; C461-G463 PolarHBondContact O-N 3Å; C461-G463 VanDerWaalsContact O-N 3.11Å; C461-I464 HydrophobicContact CB-CD1 4.26Å; C461-I464 WeakPolarHBondContact O-CB 3.19Å; C461-I464 PolarHBondContact O-N 3.06Å; C461-P465 WeakPolarHBondContact O-CD 3.49Å |
| 462 | T | 92.8 | Very high | 88.8 | Confident | 71 Ų | 71 | 51.8 Ų | 51.8 | 44% | 0.436 | 31% | 0.306 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60.8 | -18.5 | 170.9 | 69.8 | 0 | 0 | 0 | 0 | 113.2 | W131 A458 I459 I460 I464 P465 | W131-T462 PolarHBondContact NE1-OG1 3.22Å; A458-T462 WeakPolarHBondContact O-CG2 3.45Å; A458-T462 PolarHBondContact O-N 2.9Å; I459-T462 PolarHBondContact O-N 3.42Å; I459-T462 PolarHBondContact O-OG1 3.14Å; I460-T462 PolarHBondContact O-N 2.86Å; T462-I464 VanDerWaalsContact C-N 3.32Å; T462-P465 WeakPolarHBondContact O-CD 3.41Å |
| 463 | G | 92.6 | Very high | 88.9 | Confident | 0 Ų | 0 | 54.3 Ų | 54.3 | 0% | 0 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -72.9 | -20.9 | 172.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | F127 W131 I460 C461 V466 Y467 | F127-G463 WeakPolarHBondContact CE1-O 3.47Å; W131-G463 VanDerWaalsContact CG-CA 3.48Å; W131-G463 VanDerWaalsContact NE1-N 3.18Å; I460-G463 PolarHBondContact O-N 3.38Å; C461-G463 PolarHBondContact O-N 3Å; C461-G463 VanDerWaalsContact O-N 3.11Å; G463-V466 PolarHBondContact O-N 3.37Å; G463-Y467 WeakPolarHBondContact O-CB 3.45Å; G463-Y467 PolarHBondContact O-N 3.28Å |
| 464 | I | 94.6 | Very high | 88.8 | Confident | 55 Ų | 55 | 62.6 Ų | 62.6 | 28% | 0.282 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -65.1 | -51.6 | -177.3 | -60.8 | 169.3 | 0 | 0 | 0 | 111.4 | F124 L128 C461 T462 V466 Y467 I468 | F124-I464 HydrophobicContact CE2-CG1 4.24Å; F124-I464 HydrophobicContact CE2-CG2 4.48Å; F124-I464 HydrophobicContact CZ-CD1 4.46Å; F124-I464 HydrophobicContact CZ-CG1 4.11Å; L128-I464 HydrophobicContact CD2-CG1 3.8Å; C461-I464 HydrophobicContact CB-CD1 4.26Å; C461-I464 WeakPolarHBondContact O-CB 3.19Å; C461-I464 PolarHBondContact O-N 3.06Å; T462-I464 VanDerWaalsContact C-N 3.32Å; I464-V466 VanDerWaalsContact C-N 3.25Å; I464-V466 PolarHBondContact O-N 3.05Å; I464-Y467 WeakPolarHBondContact O-CB 3.34Å; I464-Y467 PolarHBondContact O-N 3.06Å; I464-I468 HydrophobicContact CG2-CD1 3.86Å; I464-I468 HydrophobicContact CG2-CG1 4.5Å; I464-I468 WeakPolarHBondContact O-CG1 3.41Å; I464-I468 PolarHBondContact O-N 3.34Å |
| 465 | P | 93.4 | Very high | 88.5 | Confident | 71 Ų | 71 | 64.2 Ų | 64.2 | 46% | 0.461 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -56.1 | -40.9 | 174.2 | -25.6 | 33.6 | 0 | 0 | 0 | 112.8 | C461 T462 I468 I469 | C461-P465 WeakPolarHBondContact O-CD 3.49Å; T462-P465 WeakPolarHBondContact O-CD 3.41Å; P465-I468 PolarHBondContact O-N 3.36Å; P465-I469 WeakPolarHBondContact O-CB 3.42Å; P465-I469 VanDerWaalsContact O-CG1 3.31Å; P465-I469 WeakPolarHBondContact O-CG1 3.47Å; P465-I469 PolarHBondContact O-N 2.86Å |
| 466 | V | 92 | Very high | 88.4 | Confident | 56 Ų | 56 | 63.7 Ų | 63.7 | 34% | 0.339 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -68.3 | -37.5 | -179.6 | -173.3 | 0 | 0 | 0 | 0 | 111.3 | F127 W131 G463 I464 G470 | F127-V466 HydrophobicContact CE1-CB 4.32Å; F127-V466 HydrophobicContact CE1-CG1 4.45Å; F127-V466 HydrophobicContact CZ-CB 4.29Å; F127-V466 HydrophobicContact CZ-CG1 3.93Å; W131-V466 HydrophobicContact CE3-CB 4.38Å; W131-V466 HydrophobicContact CE3-CG1 4.21Å; W131-V466 HydrophobicContact CH2-CB 4.33Å; W131-V466 HydrophobicContact CH2-CG1 4.3Å; W131-V466 HydrophobicContact CH2-CG2 3.67Å; W131-V466 HydrophobicContact CZ2-CG2 4.04Å; W131-V466 HydrophobicContact CZ3-CB 4.1Å; W131-V466 HydrophobicContact CZ3-CG1 3.75Å; W131-V466 HydrophobicContact CZ3-CG2 3.95Å; G463-V466 PolarHBondContact O-N 3.37Å; I464-V466 VanDerWaalsContact C-N 3.25Å; I464-V466 PolarHBondContact O-N 3.05Å; V466-G470 VanDerWaalsContact O-CA 3.25Å; V466-G470 WeakPolarHBondContact O-CA 3.38Å; V466-G470 PolarHBondContact O-N 2.94Å |
| 467 | Y | 92.7 | Very high | 88.2 | Confident | 38 Ų | 38 | 67.1 Ų | 67.1 | 15% | 0.149 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -62.4 | -46.2 | 172.9 | 177.9 | -104.2 | 0 | 0 | 0 | 111.6 | F124 F127 G463 I464 C471 A472 | F124-Y467 HydrophobicContact CB-CE1 4.25Å; F124-Y467 AromaticContact CD2-CD1 3.59Å; F124-Y467 HydrophobicContact CD2-CD1 3.59Å; F124-Y467 AromaticContact CD2-CE1 3.64Å; F124-Y467 HydrophobicContact CD2-CE1 3.64Å; F124-Y467 HydrophobicContact CD2-CG 4.14Å; F124-Y467 HydrophobicContact CE2-CD1 4.14Å; F124-Y467 HydrophobicContact CG-CE1 4.42Å; F127-Y467 HydrophobicContact CB-CD2 3.46Å; F127-Y467 VanDerWaalsContact CB-CD2 3.46Å; F127-Y467 HydrophobicContact CB-CE2 3.93Å; F127-Y467 HydrophobicContact CB-CG 4.38Å; F127-Y467 AromaticContact CD1-CD2 3.83Å; F127-Y467 HydrophobicContact CD1-CD2 3.83Å; F127-Y467 HydrophobicContact CD1-CG 4.11Å; F127-Y467 AromaticContact CD2-CD2 3.97Å; F127-Y467 HydrophobicContact CD2-CD2 3.97Å; F127-Y467 AromaticContact CG-CD2 3.46Å; F127-Y467 HydrophobicContact CG-CD2 3.46Å; F127-Y467 VanDerWaalsContact CG-CD2 3.46Å; F127-Y467 HydrophobicContact CG-CE2 4.35Å; F127-Y467 HydrophobicContact CG-CG 4.21Å; G463-Y467 WeakPolarHBondContact O-CB 3.45Å; G463-Y467 PolarHBondContact O-N 3.28Å; I464-Y467 WeakPolarHBondContact O-CB 3.34Å; I464-Y467 PolarHBondContact O-N 3.06Å; Y467-C471 HydrophobicContact CD2-CB 3.63Å; Y467-C471 HydrophobicContact CE2-CB 3.72Å; Y467-C471 HydrophobicContact CG-CB 4.42Å; Y467-C471 WeakPolarHBondContact O-CA 3.2Å; Y467-C471 WeakPolarHBondContact O-CB 3.36Å; Y467-C471 PolarHBondContact O-N 2.81Å; Y467-A472 HydrophobicContact CD1-CB 4.42Å; Y467-A472 HydrophobicContact CE1-CB 4.11Å; Y467-A472 PolarHBondContact O-N 3.29Å |
| 468 | I | 91.4 | Very high | 88 | Confident | 94 Ų | 94 | 72.4 Ų | 72.4 | 48% | 0.482 | 39% | 0.392 | S | S | . | . | I | π-helix | trans | -62.7 | -49.8 | -177.8 | -66.8 | 167.4 | 0 | 0 | 0 | 110.1 | I464 P465 W473 | I464-I468 HydrophobicContact CG2-CD1 3.86Å; I464-I468 HydrophobicContact CG2-CG1 4.5Å; I464-I468 WeakPolarHBondContact O-CG1 3.41Å; I464-I468 PolarHBondContact O-N 3.34Å; P465-I468 PolarHBondContact O-N 3.36Å; I468-W473 WeakPolarHBondContact O-CB 3.29Å; I468-W473 PolarHBondContact O-N 2.78Å |
| 469 | I | 88.6 | Confident | 87.9 | Confident | 107 Ų | 107 | 73.7 Ų | 73.7 | 55% | 0.549 | 40% | 0.398 | S | S | . | . | I | π-helix | trans | -73 | -40.6 | -177.9 | -63.1 | 167.6 | 0 | 0 | 0 | 111.5 | P465 W473 | P465-I469 WeakPolarHBondContact O-CB 3.42Å; P465-I469 VanDerWaalsContact O-CG1 3.31Å; P465-I469 WeakPolarHBondContact O-CG1 3.47Å; P465-I469 PolarHBondContact O-N 2.86Å; I469-W473 HydrophobicContact CG2-CE3 4.45Å |
| 470 | G | 85.1 | Confident | 87.7 | Confident | 31 Ų | 31 | 77.6 Ų | 77.6 | 32% | 0.32 | 41% | 0.414 | S | S | . | . | I | π-helix | trans | -84.7 | -46.6 | -171.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | V466 K476 | V466-G470 VanDerWaalsContact O-CA 3.25Å; V466-G470 WeakPolarHBondContact O-CA 3.38Å; V466-G470 PolarHBondContact O-N 2.94Å; G470-K476 WeakPolarHBondContact O-CE 3.44Å; G470-K476 PolarHBondContact O-NZ 3.01Å |
| 471 | C | 83.9 | Confident | 87.5 | Confident | 30 Ų | 30 | 80.4 Ų | 80.4 | 20% | 0.203 | 43% | 0.427 | C | S | . | . | I | π-helix | trans | -109.9 | -45.8 | -169.1 | -60.1 | 0 | 0 | 0 | 0 | 113 | F127 Y467 | F127-C471 VanDerWaalsContact CD2-SG 3.53Å; F127-C471 WeakPolarHBondContact CE2-SG 3.17Å; Y467-C471 HydrophobicContact CD2-CB 3.63Å; Y467-C471 HydrophobicContact CE2-CB 3.72Å; Y467-C471 HydrophobicContact CG-CB 4.42Å; Y467-C471 WeakPolarHBondContact O-CA 3.2Å; Y467-C471 WeakPolarHBondContact O-CB 3.36Å; Y467-C471 PolarHBondContact O-N 2.81Å |
| 472 | A | 83.1 | Confident | 87.2 | Confident | 52 Ų | 52 | 85.8 Ų | 85.8 | 43% | 0.43 | 44% | 0.439 | S | S | . | . | I | π-helix | trans | -74.5 | -37.2 | -176.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | Y467 K474 | Y467-A472 HydrophobicContact CD1-CB 4.42Å; Y467-A472 HydrophobicContact CE1-CB 4.11Å; Y467-A472 PolarHBondContact O-N 3.29Å; A472-K474 PolarHBondContact O-N 3.46Å |
| 473 | W | 84.3 | Confident | 87 | Confident | 129 Ų | 129 | 89.5 Ų | 89.5 | 49% | 0.489 | 45% | 0.449 | S | S | . | . | trans | -76.7 | 92.4 | 177.8 | -173.5 | 29.8 | 0 | 0 | 0 | 112.1 | I468 I469 N475 K476 P477 | I468-W473 WeakPolarHBondContact O-CB 3.29Å; I468-W473 PolarHBondContact O-N 2.78Å; I469-W473 HydrophobicContact CG2-CE3 4.45Å; W473-N475 PolarHBondContact NE1-O 3.02Å; W473-K476 WeakPolarHBondContact O-CE 3.49Å; W473-P477 HydrophobicContact CH2-CG 4.49Å | ||
| 474 | K | 79 | Confident | 86.6 | Confident | 177 Ų | 177 | 92.7 Ų | 92.7 | 77% | 0.77 | 46% | 0.463 | S | S | * | . | trans | -73.6 | -35.3 | 179.6 | -63.3 | -175.7 | -179.3 | -179.1 | 0 | 113.4 | A472 K476 | A472-K474 PolarHBondContact O-N 3.46Å; K474-K476 VanDerWaalsContact C-N 3.27Å; K474-K476 PolarHBondContact O-N 3.42Å | ||
| 475 | N | 82 | Confident | 86.2 | Confident | 143 Ų | 143 | 94.2 Ų | 94.2 | 77% | 0.765 | 47% | 0.469 | S | S | * | . | trans | -85.9 | 58.9 | -173.3 | -68.2 | -11.1 | 0 | 0 | 0 | 112.6 | W473 | W473-N475 PolarHBondContact NE1-O 3.02Š| ||
| 476 | K | 84.2 | Confident | 85.9 | Confident | 62 Ų | 62 | 94.8 Ų | 94.8 | 27% | 0.27 | 47% | 0.474 | S | S | . | . | trans | -68.8 | 150 | 177.3 | -62.9 | -179.5 | -175.4 | 174.8 | 0 | 111 | G470 W473 K474 K478 F480 Q481 | G470-K476 WeakPolarHBondContact O-CE 3.44Å; G470-K476 PolarHBondContact O-NZ 3.01Å; W473-K476 WeakPolarHBondContact O-CE 3.49Å; K474-K476 VanDerWaalsContact C-N 3.27Å; K474-K476 PolarHBondContact O-N 3.42Å; K476-K478 PolarHBondContact O-N 3.23Å; K476-F480 HydrophobicContact CB-CD1 4.47Å; K476-F480 HydrophobicContact CD-CD1 4.32Å; K476-F480 HydrophobicContact CD-CE1 4.23Å; K476-Q481 HydrophobicContact CB-CG 4.38Å | ||
| 477 | P | 84.5 | Confident | 85.7 | Confident | 72 Ų | 72 | 97.8 Ų | 97.8 | 47% | 0.468 | 48% | 0.483 | S | S | . | . | trans | -54.5 | 133.6 | 178.7 | -25.6 | 33.6 | 0 | 0 | 0 | 112.6 | W473 S479 F480 Q481 | W473-P477 HydrophobicContact CH2-CG 4.49Å; P477-S479 PolarHBondContact O-N 3.36Å; P477-S479 VanDerWaalsContact O-N 3.12Å; P477-F480 HydrophobicContact CB-CB 4.49Å; P477-F480 WeakPolarHBondContact O-CB 3.29Å; P477-F480 PolarHBondContact O-N 3.44Å; P477-Q481 PolarHBondContact O-N 3Å | ||
| 478 | K | 84 | Confident | 85.4 | Confident | 161 Ų | 161 | 96.7 Ų | 96.7 | 70% | 0.7 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -55.7 | -33.1 | -179.2 | -68.8 | -173.7 | 178.7 | -178.9 | 0 | 113.2 | K476 Q481 R482 | K476-K478 PolarHBondContact O-N 3.23Å; K478-Q481 PolarHBondContact O-N 3.21Å; K478-R482 WeakPolarHBondContact O-CG 3.46Å; K478-R482 PolarHBondContact O-N 3.04Å |
| 479 | S | 86.7 | Confident | 85.1 | Confident | 77 Ų | 77 | 94.4 Ų | 94.4 | 54% | 0.538 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -62.1 | -42.4 | 175.6 | -177.5 | 0 | 0 | 0 | 0 | 112.2 | P477 K483 | P477-S479 PolarHBondContact O-N 3.36Å; P477-S479 VanDerWaalsContact O-N 3.12Å; S479-K483 WeakPolarHBondContact O-CG 3.39Å; S479-K483 PolarHBondContact O-N 2.9Å; S479-K483 VanDerWaalsContact O-N 3.07Å |
| 480 | F | 85.7 | Confident | 85.1 | Confident | 112 Ų | 112 | 91.1 Ų | 91.1 | 49% | 0.491 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -65.9 | -45.6 | 176.9 | 178.1 | -96.9 | 0 | 0 | 0 | 111.3 | K476 P477 R482 K483 F484 | K476-F480 HydrophobicContact CB-CD1 4.47Å; K476-F480 HydrophobicContact CD-CD1 4.32Å; K476-F480 HydrophobicContact CD-CE1 4.23Å; P477-F480 HydrophobicContact CB-CB 4.49Å; P477-F480 WeakPolarHBondContact O-CB 3.29Å; P477-F480 PolarHBondContact O-N 3.44Å; F480-R482 PolarHBondContact O-N 3.45Å; F480-K483 PolarHBondContact O-N 3.42Å; F480-F484 WeakPolarHBondContact O-CB 3.14Å; F480-F484 PolarHBondContact O-N 3.27Å |
| 481 | Q | 84.7 | Confident | 85.1 | Confident | 91 Ų | 91 | 90.5 Ų | 90.5 | 43% | 0.425 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -57.8 | -46.8 | 177.3 | -67.6 | 178.1 | -13.7 | 0 | 0 | 111.6 | K476 P477 K478 K483 F484 E485 | K476-Q481 HydrophobicContact CB-CG 4.38Å; P477-Q481 PolarHBondContact O-N 3Å; K478-Q481 PolarHBondContact O-N 3.21Å; Q481-K483 PolarHBondContact O-N 3.1Å; Q481-F484 PolarHBondContact O-N 2.74Å; Q481-E485 VanDerWaalsContact O-CB 3.28Å; Q481-E485 WeakPolarHBondContact O-CB 3.46Å; Q481-E485 PolarHBondContact O-N 3.02Å |
| 482 | R | 86 | Confident | 85.2 | Confident | 173 Ų | 173 | 90.8 Ų | 90.8 | 65% | 0.653 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -62.9 | -40.1 | 177.5 | -74.1 | 177.9 | 179 | 177.5 | -1.3 | 113.7 | K478 F480 S486 | K478-R482 WeakPolarHBondContact O-CG 3.46Å; K478-R482 PolarHBondContact O-N 3.04Å; F480-R482 PolarHBondContact O-N 3.45Å; R482-S486 WeakPolarHBondContact O-CB 3.41Å; R482-S486 PolarHBondContact O-N 2.6Å; R482-S486 PolarHBondContact O-OG 3.11Å |
| 483 | K | 87.7 | Confident | 85.3 | Confident | 149 Ų | 149 | 95.5 Ų | 95.5 | 65% | 0.648 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -65.9 | -44.9 | 175.5 | -76 | -176.6 | 179.6 | -174.7 | 0 | 111 | S479 F480 Q481 E485 S486 F487 | S479-K483 WeakPolarHBondContact O-CG 3.39Å; S479-K483 PolarHBondContact O-N 2.9Å; S479-K483 VanDerWaalsContact O-N 3.07Å; F480-K483 PolarHBondContact O-N 3.42Å; Q481-K483 PolarHBondContact O-N 3.1Å; K483-E485 VanDerWaalsContact C-N 3.35Å; K483-S486 PolarHBondContact O-N 3.32Å; K483-F487 WeakPolarHBondContact O-CB 3.07Å; K483-F487 PolarHBondContact O-N 3.27Å |
| 484 | F | 85.1 | Confident | 85.3 | Confident | 66 Ų | 66 | 95.4 Ų | 95.4 | 29% | 0.289 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -65.7 | -38.4 | 179 | -172.9 | -97.2 | 0 | 0 | 0 | 112 | P355 F480 Q481 F487 T488 | P355-F484 HydrophobicContact CB-CE1 4.45Å; P355-F484 HydrophobicContact CB-CE2 4.07Å; P355-F484 HydrophobicContact CB-CZ 3.52Å; F480-F484 WeakPolarHBondContact O-CB 3.14Å; F480-F484 PolarHBondContact O-N 3.27Å; Q481-F484 PolarHBondContact O-N 2.74Å; F484-F487 PolarHBondContact O-N 3.39Å; F484-T488 WeakPolarHBondContact CE1-OG1 3.29Å; F484-T488 WeakPolarHBondContact O-CB 3.2Å; F484-T488 PolarHBondContact O-N 3Å; F484-T488 PolarHBondContact O-OG1 3.33Å |
| 485 | E | 86.3 | Confident | 85.6 | Confident | 88 Ų | 88 | 90.3 Ų | 90.3 | 41% | 0.411 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -65.7 | -47.4 | 174.1 | -175.8 | 173.7 | -159.6 | 0 | 0 | 111.7 | Q481 K483 F487 T488 I489 | Q481-E485 VanDerWaalsContact O-CB 3.28Å; Q481-E485 WeakPolarHBondContact O-CB 3.46Å; Q481-E485 PolarHBondContact O-N 3.02Å; K483-E485 VanDerWaalsContact C-N 3.35Å; E485-F487 VanDerWaalsContact C-N 3.29Å; E485-F487 PolarHBondContact O-N 2.63Å; E485-T488 WeakPolarHBondContact O-CB 3.43Å; E485-T488 PolarHBondContact O-N 2.8Å; E485-T488 VanDerWaalsContact O-N 3.12Å; E485-I489 HydrophobicContact CG-CD1 4Å; E485-I489 WeakPolarHBondContact O-CG1 3.26Å; E485-I489 PolarHBondContact O-N 3.28Å |
| 486 | S | 86.7 | Confident | 85.8 | Confident | 82 Ų | 82 | 89.4 Ų | 89.4 | 57% | 0.573 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -56.2 | -43.5 | 173.5 | -65.8 | 0 | 0 | 0 | 0 | 112.1 | R482 K483 I489 G490 | R482-S486 WeakPolarHBondContact O-CB 3.41Å; R482-S486 PolarHBondContact O-N 2.6Å; R482-S486 PolarHBondContact O-OG 3.11Å; K483-S486 PolarHBondContact O-N 3.32Å; S486-I489 PolarHBondContact O-N 3.18Å; S486-G490 PolarHBondContact O-N 2.82Å |
| 487 | F | 87.3 | Confident | 85.8 | Confident | 120 Ų | 120 | 86.8 Ų | 86.8 | 53% | 0.526 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -62 | -47.6 | 174.9 | 176 | -102.6 | 0 | 0 | 0 | 111.4 | L357 K483 F484 E485 I489 G490 V491 | L357-F487 HydrophobicContact CD2-CD1 4.23Å; L357-F487 HydrophobicContact CD2-CE1 3.64Å; K483-F487 WeakPolarHBondContact O-CB 3.07Å; K483-F487 PolarHBondContact O-N 3.27Å; F484-F487 PolarHBondContact O-N 3.39Å; E485-F487 VanDerWaalsContact C-N 3.29Å; E485-F487 PolarHBondContact O-N 2.63Å; F487-I489 VanDerWaalsContact C-N 3.35Å; F487-I489 PolarHBondContact O-N 3.3Å; F487-G490 WeakPolarHBondContact O-CA 3.49Å; F487-G490 PolarHBondContact O-N 3.18Å; F487-G490 VanDerWaalsContact O-N 3.09Å; F487-V491 HydrophobicContact CD1-CG2 4.36Å; F487-V491 HydrophobicContact CD2-CG2 4.44Å; F487-V491 HydrophobicContact CE1-CG2 3.95Å; F487-V491 HydrophobicContact CE2-CG2 4.03Å; F487-V491 HydrophobicContact CZ-CG2 3.76Å; F487-V491 WeakPolarHBondContact O-CG2 3.28Å; F487-V491 PolarHBondContact O-N 3.02Å |
| 488 | T | 87 | Confident | 85.7 | Confident | 14 Ų | 14 | 85 Ų | 85 | 9% | 0.086 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -58.1 | -46.1 | 178.2 | -61.2 | 0 | 0 | 0 | 0 | 111.3 | L357 F360 F484 E485 G490 V491 Q492 | L357-T488 HydrophobicContact CB-CG2 4.41Å; L357-T488 HydrophobicContact CD1-CG2 4.15Å; F360-T488 HydrophobicContact CE2-CG2 3.48Å; F360-T488 VanDerWaalsContact CE2-CG2 3.48Å; F360-T488 HydrophobicContact CZ-CG2 3.96Å; F484-T488 WeakPolarHBondContact CE1-OG1 3.29Å; F484-T488 WeakPolarHBondContact O-CB 3.2Å; F484-T488 PolarHBondContact O-N 3Å; F484-T488 PolarHBondContact O-OG1 3.33Å; E485-T488 WeakPolarHBondContact O-CB 3.43Å; E485-T488 PolarHBondContact O-N 2.8Å; E485-T488 VanDerWaalsContact O-N 3.12Å; T488-G490 VanDerWaalsContact C-N 3.33Å; T488-G490 PolarHBondContact O-N 3.1Å; T488-V491 PolarHBondContact O-N 3.11Å; T488-Q492 WeakPolarHBondContact O-CB 3.47Å; T488-Q492 WeakPolarHBondContact O-CG 3.4Å; T488-Q492 PolarHBondContact O-N 3.5Å |
| 489 | I | 85.9 | Confident | 85.3 | Confident | 46 Ų | 46 | 79.9 Ų | 79.9 | 24% | 0.236 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -62.7 | -40 | 175.7 | -67 | 167.6 | 0 | 0 | 0 | 111 | E485 S486 F487 Q492 K493 | E485-I489 HydrophobicContact CG-CD1 4Å; E485-I489 WeakPolarHBondContact O-CG1 3.26Å; E485-I489 PolarHBondContact O-N 3.28Å; S486-I489 PolarHBondContact O-N 3.18Å; F487-I489 VanDerWaalsContact C-N 3.35Å; F487-I489 PolarHBondContact O-N 3.3Å; I489-Q492 PolarHBondContact O-N 3.31Å; I489-K493 HydrophobicContact CG2-CD 4.16Å; I489-K493 WeakPolarHBondContact O-CG 3.43Å; I489-K493 PolarHBondContact O-N 3.41Å |
| 490 | G | 87 | Confident | 84.4 | Confident | 38 Ų | 38 | 76.9 Ų | 76.9 | 39% | 0.392 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -58.7 | -47.9 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | S486 F487 T488 K493 L494 | S486-G490 PolarHBondContact O-N 2.82Å; F487-G490 WeakPolarHBondContact O-CA 3.49Å; F487-G490 PolarHBondContact O-N 3.18Å; F487-G490 VanDerWaalsContact O-N 3.09Å; T488-G490 VanDerWaalsContact C-N 3.33Å; T488-G490 PolarHBondContact O-N 3.1Å; G490-K493 PolarHBondContact O-N 3.25Å; G490-L494 WeakPolarHBondContact O-CB 3.47Å; G490-L494 PolarHBondContact O-N 3.45Å |
| 491 | V | 85.6 | Confident | 83 | Confident | 18 Ų | 18 | 79.7 Ų | 79.7 | 11% | 0.109 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -68.4 | -39.7 | 178.7 | -177.9 | 0 | 0 | 0 | 0 | 111.7 | L357 F487 T488 K493 L494 F495 L497 | L357-V491 HydrophobicContact CD1-CB 3.79Å; L357-V491 HydrophobicContact CD1-CG1 3.69Å; L357-V491 HydrophobicContact CD2-CB 4.12Å; L357-V491 HydrophobicContact CD2-CG1 4.07Å; L357-V491 HydrophobicContact CD2-CG2 4.03Å; L357-V491 HydrophobicContact CG-CG1 4.37Å; F487-V491 HydrophobicContact CD1-CG2 4.36Å; F487-V491 HydrophobicContact CD2-CG2 4.44Å; F487-V491 HydrophobicContact CE1-CG2 3.95Å; F487-V491 HydrophobicContact CE2-CG2 4.03Å; F487-V491 HydrophobicContact CZ-CG2 3.76Å; F487-V491 WeakPolarHBondContact O-CG2 3.28Å; F487-V491 PolarHBondContact O-N 3.02Å; T488-V491 PolarHBondContact O-N 3.11Å; V491-K493 VanDerWaalsContact C-N 3.31Å; V491-K493 PolarHBondContact O-N 3.35Å; V491-L494 PolarHBondContact O-N 2.86Å; V491-F495 HydrophobicContact CG1-CD2 3.58Å; V491-F495 HydrophobicContact CG1-CE2 3.98Å; V491-F495 PolarHBondContact O-N 3.08Å; V491-L497 HydrophobicContact CG1-CD1 4.04Å |
| 492 | Q | 85.5 | Confident | 82.9 | Confident | 37 Ų | 37 | 79.1 Ų | 79.1 | 17% | 0.173 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -56.6 | -44.7 | 173.3 | -79.4 | 178.2 | -41.7 | 0 | 0 | 111.8 | F360 T488 I489 K496 L497 | F360-Q492 HydrophobicContact CD2-CG 3.56Å; F360-Q492 VanDerWaalsContact CE2-CD 3.43Å; F360-Q492 HydrophobicContact CE2-CG 3.48Å; F360-Q492 VanDerWaalsContact CE2-CG 3.48Å; T488-Q492 WeakPolarHBondContact O-CB 3.47Å; T488-Q492 WeakPolarHBondContact O-CG 3.4Å; T488-Q492 PolarHBondContact O-N 3.5Å; I489-Q492 PolarHBondContact O-N 3.31Å; Q492-K496 CarbonylContact O-C 3.42Å; Q492-K496 WeakPolarHBondContact O-CA 3.17Å; Q492-K496 PolarHBondContact O-N 3.23Å; Q492-L497 HydrophobicContact CG-CB 4.38Å; Q492-L497 PolarHBondContact O-N 2.92Å |
| 493 | K | 85.9 | Confident | 82.7 | Confident | 151 Ų | 151 | 74.2 Ų | 74.2 | 66% | 0.657 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -68.2 | -41.7 | 177.9 | -72.2 | 174.5 | -178.8 | 177.7 | 0 | 111.9 | I489 G490 V491 | I489-K493 HydrophobicContact CG2-CD 4.16Å; I489-K493 WeakPolarHBondContact O-CG 3.43Å; I489-K493 PolarHBondContact O-N 3.41Å; G490-K493 PolarHBondContact O-N 3.25Å; V491-K493 VanDerWaalsContact C-N 3.31Å; V491-K493 PolarHBondContact O-N 3.35Å |
| 494 | L | 85.3 | Confident | 82.4 | Confident | 127 Ų | 127 | 70 Ų | 70 | 67% | 0.665 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -63.4 | -44.8 | -179.1 | -177 | 64.1 | 0 | 0 | 0 | 112.1 | G490 V491 | G490-L494 WeakPolarHBondContact O-CB 3.47Å; G490-L494 PolarHBondContact O-N 3.45Å; V491-L494 PolarHBondContact O-N 2.86Å |
| 495 | F | 84.4 | Confident | 82.3 | Confident | 70 Ų | 70 | 70.2 Ų | 70.2 | 31% | 0.307 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -107.7 | 9.6 | -174.3 | -62.9 | -52.2 | 0 | 0 | 0 | 114.4 | H362 I369 V491 L497 | H362-F495 PolarHBondContact CD2-O 2.86Å; I369-F495 HydrophobicContact CG2-CD1 4.38Å; I369-F495 HydrophobicContact CG2-CD2 4.46Å; I369-F495 HydrophobicContact CG2-CG 4.27Å; V491-F495 HydrophobicContact CG1-CD2 3.58Å; V491-F495 HydrophobicContact CG1-CE2 3.98Å; V491-F495 PolarHBondContact O-N 3.08Å; F495-L497 VanDerWaalsContact C-N 3.34Å; F495-L497 HydrophobicContact CB-CD1 3.97Å; F495-L497 HydrophobicContact CB-CD2 3.81Å; F495-L497 HydrophobicContact CB-CG 3.65Å; F495-L497 HydrophobicContact CD2-CD1 4.42Å; F495-L497 PolarHBondContact O-N 3.45Å |
| 496 | K | 85.5 | Confident | 82 | Confident | 123 Ų | 123 | 69.1 Ų | 69.1 | 54% | 0.535 | 37% | 0.366 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 49.1 | 52.9 | -177.3 | -59.8 | 179.2 | 178.7 | 179.2 | 0 | 112.5 | M363 Q492 | M363-K496 WeakPolarHBondContact CG-O 3.48Å; M363-K496 PolarHBondContact N-O 3.24Å; Q492-K496 CarbonylContact O-C 3.42Å; Q492-K496 WeakPolarHBondContact O-CA 3.17Å; Q492-K496 PolarHBondContact O-N 3.23Å |
| 497 | L | 84.8 | Confident | 81.7 | Confident | 8 Ų | 8 | 68.3 Ų | 68.3 | 4% | 0.042 | 35% | 0.353 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.2 | 144.1 | -176.1 | -51.5 | 174.2 | 0 | 0 | 0 | 111.8 | L357 F360 L361 H362 I369 V491 Q492 F495 | L357-L497 HydrophobicContact CD1-CD1 4.38Å; F360-L497 HydrophobicContact CB-CB 3.75Å; F360-L497 HydrophobicContact CB-CD1 4.31Å; F360-L497 HydrophobicContact CD2-CB 4.28Å; L361-L497 CarbonylContact O-C 3.02Å; L361-L497 WeakPolarHBondContact O-CA 3.26Å; H362-L497 HydrophobicContact CB-CD2 4.13Å; I369-L497 HydrophobicContact CB-CD2 4.26Å; V491-L497 HydrophobicContact CG1-CD1 4.04Å; Q492-L497 HydrophobicContact CG-CB 4.38Å; Q492-L497 PolarHBondContact O-N 2.92Å; F495-L497 VanDerWaalsContact C-N 3.34Å; F495-L497 HydrophobicContact CB-CD1 3.97Å; F495-L497 HydrophobicContact CB-CD2 3.81Å; F495-L497 HydrophobicContact CB-CG 3.65Å; F495-L497 HydrophobicContact CD2-CD1 4.42Å; F495-L497 PolarHBondContact O-N 3.45Å |
| 498 | V | 82.7 | Confident | 81.3 | Confident | 33 Ų | 33 | 64.6 Ų | 64.6 | 20% | 0.2 | 34% | 0.34 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.3 | 142.5 | 175.4 | 176.3 | 0 | 0 | 0 | 0 | 108.9 | V41 F360 L361 M363 S500 | V41-V498 HydrophobicContact CG2-CG1 4.47Å; F360-V498 CarbonylContact C-O 3.42Å; F360-V498 WeakPolarHBondContact CA-O 3.49Å; L361-V498 PolarHBondContact N-O 3.21Å; L361-V498 PolarHBondContact O-N 2.97Å; M363-V498 HydrophobicContact CG-CB 4.31Å; M363-V498 HydrophobicContact CG-CG2 3.34Å; M363-V498 HydrophobicContact SD-CG2 3.46Å; M363-V498 WeakPolarHBondContact SD-CG2 3.42Å; V498-S500 PolarHBondContact O-N 2.81Å |
| 499 | P | 75.3 | Confident | 80.9 | Confident | 55 Ų | 55 | 68.5 Ų | 68.5 | 36% | 0.357 | 36% | 0.36 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -56.6 | 136 | 174.1 | 21.4 | -32.6 | 0 | 0 | 0 | 112.2 | F360 | F360-P499 VanDerWaalsContact CD1-CA 3.48Å; F360-P499 HydrophobicContact CD1-CB 3.91Å; F360-P499 HydrophobicContact CE1-CB 3.73Å |
| 500 | S | 68 | Low | 80.5 | Confident | 13 Ų | 13 | 70.3 Ų | 70.3 | 9% | 0.091 | 37% | 0.37 | C | S | . | . | trans | -69.6 | 129.6 | 162 | 67.9 | 0 | 0 | 0 | 0 | 108.4 | Q350 C359 V498 | Q350-S500 PolarHBondContact NE2-OG 2.94Å; C359-S500 WeakPolarHBondContact O-CB 3.07Å; C359-S500 PolarHBondContact O-N 3.28Å; C359-S500 PolarHBondContact O-OG 2.8Å; C359-S500 VanDerWaalsContact O-OG 3.07Å; V498-S500 PolarHBondContact O-N 2.81Å | ||
| 501 | N | 55.6 | Low | 79.9 | Confident | 171 Ų | 171 | 73.3 Ų | 73.3 | 91% | 0.914 | 37% | 0.368 | S | S | * | . | trans | -52.8 | 0 | 177.1 | -86 | 0.2 | 0 | 0 | 0 | 112.8 | V40 | V40-N501 HydrophobicContact CG1-CB 4.03Š|
Retrieved 501 of 501 residues in 155.1 ms
(Link to these results)