#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gvl n LEU 16 N 0.00 3.12 0.00 3.14 7.99 -1.26 -1.95 117.00 128.04 1gvl n LEU 16 Ca 0.00 1.06 0.00 0.00 -0.01 0.00 0.00 56.01 57.06 1gvl n LEU 16 Cb 0.00 -1.41 0.00 0.00 -0.11 0.00 0.00 43.42 41.90 1gvl n LEU 16 CO 0.00 -0.26 0.00 0.52 -1.51 0.00 0.00 177.39 176.14 1gvl n VAL 17 N 3.76 0.00 0.00 4.08 0.31 -1.26 -4.66 118.33 120.57 1gvl n VAL 17 Ca 0.18 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.51 1gvl n VAL 17 Cb 0.29 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.22 1gvl n VAL 17 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 1gvl n HIS 18 N -0.11 0.00 -3.45 3.52 8.25 -0.82 -4.39 115.22 118.22 1gvl n HIS 18 Ca 0.00 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.36 1gvl n HIS 18 Cb 0.00 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.12 1gvl n HIS 18 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1gvl n GLY 19 N -0.55 2.60 0.00 -1.41 0.00 -1.26 -5.12 105.19 99.46 1gvl n GLY 19 Ca 0.00 -2.21 0.00 0.00 0.00 0.00 0.00 46.02 43.81 1gvl n GLY 19 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gvl n GLY 20 N 2.21 3.22 0.39 -0.02 0.00 -1.26 -5.03 105.19 104.70 1gvl n GLY 20 Ca 0.02 -1.39 0.17 0.00 0.00 0.00 0.00 46.02 44.82 1gvl n GLY 20 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1gvl h PRO 21 N 0.00 0.44 0.00 1.61 0.11 -1.98 0.41 132.00 132.58 1gvl h PRO 21 Ca 0.00 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.08 1gvl h PRO 21 Cb 0.00 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 31.01 1gvl h PRO 21 CO 0.00 0.29 0.00 0.00 -0.21 0.00 0.00 178.00 178.08 1gvl h ASP 23 N 0.00 0.00 -3.66 0.00 3.32 -1.31 -3.48 116.42 111.29 1gvl h ASP 23 Ca 0.00 -0.19 -0.54 0.00 0.02 0.00 0.00 57.03 56.31 1gvl h ASP 23 Cb 0.32 0.00 0.10 0.00 0.22 0.00 0.00 39.33 39.97 1gvl h ASP 23 CO 0.00 0.10 0.77 0.29 -1.72 0.00 0.00 179.24 178.67 1gvl n LYS 24 N -2.22 2.61 0.06 3.56 4.76 -0.69 -4.89 118.16 121.34 1gvl n LYS 24 Ca 0.02 0.92 -0.04 0.00 -2.87 0.00 0.00 58.31 56.34 1gvl n LYS 24 Cb 0.47 -2.64 -0.08 0.00 -1.84 0.00 0.00 35.03 30.93 1gvl n LYS 24 CO 0.00 0.00 0.00 1.15 -1.37 0.00 0.00 177.40 177.18 1gvl h THR 25 N 3.00 1.23 -4.17 -0.18 2.02 -1.91 -3.45 112.91 109.45 1gvl h THR 25 Ca -0.49 -2.85 -0.53 0.00 0.77 0.00 0.00 66.41 63.30 1gvl h THR 25 Cb 1.24 2.59 -0.26 0.00 -1.74 0.00 0.00 68.15 69.98 1gvl h THR 25 CO 0.68 0.70 -0.83 -0.55 0.37 0.00 0.00 175.52 175.90 1gvl s SER 26 N -6.45 2.13 -0.47 4.18 0.15 -1.26 -4.97 113.70 107.00 1gvl s SER 26 Ca 0.00 -0.45 0.03 0.00 0.70 0.00 0.00 55.95 56.24 1gvl s SER 26 Cb 0.09 -0.18 0.13 0.00 -1.71 0.00 0.00 66.02 64.35 1gvl s SER 26 CO 0.80 0.14 0.24 -1.00 1.20 0.00 0.00 173.24 174.62 1gvl s HIS 27 N -0.71 2.61 0.30 3.44 0.09 -1.26 -5.02 115.29 114.74 1gvl s HIS 27 Ca 0.06 -2.79 0.33 0.00 -0.00 0.00 0.00 55.06 52.65 1gvl s HIS 27 Cb -0.08 -2.37 1.80 0.00 -0.00 0.00 0.00 32.58 31.94 1gvl s HIS 27 CO 0.01 -0.77 2.01 -1.35 -0.00 0.00 0.00 174.74 174.64 1gvl h PRO 28 N 6.67 0.00 -0.02 8.40 0.11 -1.87 -2.07 132.00 143.21 1gvl h PRO 28 Ca -0.05 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.06 1gvl h PRO 28 Cb 0.91 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.02 1gvl h PRO 28 CO 0.58 0.00 -0.17 2.48 -0.21 0.00 0.00 178.00 180.68 1gvl n TYR 29 N -2.70 0.00 -2.79 0.65 4.11 -1.15 -1.75 117.16 113.52 1gvl n TYR 29 Ca -0.02 0.00 -0.42 0.00 -0.00 0.00 0.00 57.90 57.46 1gvl n TYR 29 Cb 0.09 0.00 -0.03 0.00 -0.00 0.00 0.00 39.34 39.40 1gvl n TYR 29 CO 0.00 0.00 0.00 -1.14 -0.00 0.00 0.00 176.86 175.72 1gvl s GLN 30 N -2.08 4.41 0.16 -3.48 2.00 -0.78 -1.18 119.66 118.72 1gvl s GLN 30 Ca 0.23 1.23 0.07 0.00 -2.00 0.00 0.00 55.36 54.89 1gvl s GLN 30 Cb 0.18 -3.52 -0.04 0.00 0.80 0.00 0.00 33.01 30.43 1gvl s GLN 30 CO 0.38 -0.22 0.00 0.00 -0.50 0.00 0.00 175.29 174.95 1gvl s ALA 31 N 1.71 3.21 -0.10 1.58 0.00 -0.28 -4.28 121.76 123.60 1gvl s ALA 31 Ca 0.45 -1.34 0.02 0.00 0.00 0.00 0.00 51.96 51.09 1gvl s ALA 31 Cb -0.18 -1.02 -0.01 0.00 0.00 0.00 0.00 23.12 21.91 1gvl s ALA 31 CO 0.18 0.51 -0.17 0.00 0.00 0.00 0.00 175.76 176.28 1gvl s ALA 32 N -1.68 2.48 -0.20 0.00 0.00 -0.47 -1.92 121.76 119.98 1gvl s ALA 32 Ca 0.27 -0.94 -0.05 0.00 0.00 0.00 0.00 51.96 51.24 1gvl s ALA 32 Cb -0.10 -1.02 -0.02 0.00 0.00 0.00 0.00 23.12 21.98 1gvl s ALA 32 CO 0.19 0.33 -0.00 -0.51 0.00 0.00 0.00 175.76 175.76 1gvl s LEU 33 N 0.10 3.26 0.06 0.00 1.02 -0.33 -1.17 118.68 121.62 1gvl s LEU 33 Ca -0.08 -0.19 0.07 0.00 0.02 0.00 0.00 54.13 53.95 1gvl s LEU 33 Cb -0.15 -1.82 -0.03 0.00 0.02 0.00 0.00 46.19 44.20 1gvl s LEU 33 CO 0.05 0.07 -0.17 -0.31 0.02 0.00 0.00 176.35 176.01 1gvl s TYR 34 N 0.95 2.58 -0.02 0.29 1.51 0.45 -0.59 117.35 122.52 1gvl s TYR 34 Ca 0.01 -0.24 0.00 0.00 -1.01 0.00 0.00 57.07 55.83 1gvl s TYR 34 Cb -0.14 -1.44 0.02 0.00 -0.11 0.00 0.00 41.96 40.29 1gvl s TYR 34 CO 0.02 0.30 0.01 -0.08 -1.11 0.00 0.00 175.55 174.69 1gvl s THR 35 N -1.00 0.07 -1.69 -0.71 -1.32 -0.59 -0.73 115.64 109.67 1gvl s THR 35 Ca 0.16 0.09 -0.16 0.00 -1.21 0.00 0.00 61.69 60.58 1gvl s THR 35 Cb -0.11 -0.16 0.14 0.00 -1.51 0.00 0.00 72.50 70.87 1gvl s THR 35 CO 0.07 0.09 0.62 -1.20 -2.21 0.00 0.00 174.62 172.00 1gvl n SER 36 N 3.85 -2.19 0.00 8.08 7.64 -1.26 -1.43 113.62 128.32 1gvl n SER 36 Ca -0.23 -1.09 0.00 0.00 1.01 0.00 0.00 58.87 58.56 1gvl n SER 36 Cb 0.53 -2.43 0.00 0.00 -1.01 0.00 0.00 64.21 61.29 1gvl n SER 36 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1gvl n GLY 38 N -1.51 1.01 3.34 0.23 0.00 -1.26 -4.93 105.19 102.07 1gvl n GLY 38 Ca -0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 1gvl n GLY 38 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1gvl s HIS 39 N -3.52 2.54 -0.44 1.61 3.76 -0.51 0.55 115.29 119.27 1gvl s HIS 39 Ca 0.00 -0.52 -0.28 0.00 -0.15 0.00 0.00 55.06 54.10 1gvl s HIS 39 Cb 0.00 -1.62 0.00 0.00 1.11 0.00 0.00 32.58 32.07 1gvl s HIS 39 CO 0.00 -0.08 1.50 -1.17 -0.85 0.00 0.00 174.74 174.14 1gvl s LEU 40 N -0.32 3.52 -0.13 0.89 0.20 -1.26 -1.54 118.68 120.04 1gvl s LEU 40 Ca 0.02 0.79 0.11 0.00 0.69 0.00 0.00 54.13 55.73 1gvl s LEU 40 Cb -0.13 -3.40 -0.23 0.00 -0.43 0.00 0.00 46.19 42.00 1gvl s LEU 40 CO 0.02 -1.58 0.32 -0.11 -0.29 0.00 0.00 176.35 174.71 1gvl n LEU 41 N 9.43 1.04 -3.62 -0.68 7.94 0.25 -5.00 117.00 126.35 1gvl n LEU 41 Ca 0.17 0.19 -0.07 0.00 -1.11 0.00 0.00 56.01 55.19 1gvl n LEU 41 Cb 0.48 -0.01 -0.02 0.00 0.53 0.00 0.00 43.42 44.41 1gvl n LEU 41 CO 0.70 0.55 0.62 0.00 -1.11 0.00 0.00 177.39 178.15 1gvl n GLY 43 N -0.38 1.35 3.86 0.00 0.00 0.27 -1.18 105.19 109.11 1gvl n GLY 43 Ca -0.09 -2.11 -0.01 0.00 0.00 0.00 0.00 46.02 43.81 1gvl n GLY 43 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1gvl s GLY 44 N -4.03 -0.05 -0.05 -0.02 0.00 -0.81 -3.97 107.32 98.40 1gvl s GLY 44 Ca 0.44 -0.06 0.01 0.00 0.00 0.00 0.00 44.72 45.11 1gvl s GLY 44 CO 0.28 2.60 -0.05 0.14 0.00 0.00 0.00 173.10 176.08 1gvl s VAL 45 N -2.30 0.56 -0.13 1.40 1.01 0.36 -1.13 120.40 120.16 1gvl s VAL 45 Ca 0.21 -0.13 -0.29 0.00 0.00 0.00 0.00 61.98 61.77 1gvl s VAL 45 Cb -0.01 -0.59 -0.02 0.00 0.00 0.00 0.00 36.38 35.77 1gvl s VAL 45 CO 0.02 0.23 1.17 -0.22 0.00 0.00 0.00 175.10 176.30 1gvl s LEU 46 N 0.95 4.21 0.00 3.92 2.96 -0.32 -0.18 118.68 130.21 1gvl s LEU 46 Ca -0.11 1.65 0.00 0.00 -0.22 0.00 0.00 54.13 55.46 1gvl s LEU 46 Cb -0.14 -3.55 0.00 0.00 0.50 0.00 0.00 46.19 43.00 1gvl s LEU 46 CO 0.00 -0.64 0.22 2.30 -1.32 0.00 0.00 176.35 176.90 1gvl n ILE 47 N 5.01 0.00 -3.56 6.68 -5.35 -0.78 -1.21 119.36 120.14 1gvl n ILE 47 Ca 0.12 -0.48 -0.15 0.00 -0.27 0.00 0.00 62.75 61.97 1gvl n ILE 47 Cb 0.46 1.02 -0.06 0.00 -1.74 0.00 0.00 39.64 39.32 1gvl n ILE 47 CO 0.00 0.00 0.00 -2.28 -1.76 0.00 0.00 176.55 172.51 1gvl s HIS 48 N -0.52 -0.61 0.60 4.28 5.04 -1.16 -4.73 115.29 118.19 1gvl s HIS 48 Ca 0.00 1.19 0.29 0.00 -1.54 0.00 0.00 55.06 54.99 1gvl s HIS 48 Cb 0.00 0.39 1.44 0.00 0.04 0.00 0.00 32.58 34.44 1gvl s HIS 48 CO 0.00 -0.48 1.85 -1.35 -2.34 0.00 0.00 174.74 172.42 1gvl h PRO 49 N 3.41 0.00 -0.12 2.88 0.11 -1.96 -1.58 132.00 134.74 1gvl h PRO 49 Ca -0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 1gvl h PRO 49 Cb 1.15 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1gvl h PRO 49 CO 0.28 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 179.35 1gvl n LEU 50 N -3.61 2.60 -3.84 2.35 4.77 -1.26 -0.23 117.00 117.77 1gvl n LEU 50 Ca 0.09 -1.19 -0.13 0.00 -0.03 0.00 0.00 56.01 54.75 1gvl n LEU 50 Cb 0.72 -0.07 -0.14 0.00 -2.33 0.00 0.00 43.42 41.60 1gvl n LEU 50 CO 0.26 0.51 -0.33 0.26 -1.33 0.00 0.00 177.39 176.76 1gvl s TRP 51 N -1.33 -0.02 -0.07 -1.77 0.52 -0.60 -1.09 118.94 114.58 1gvl s TRP 51 Ca 0.23 0.09 0.03 0.00 0.02 0.00 0.00 56.10 56.47 1gvl s TRP 51 Cb 0.15 -0.04 -0.02 0.00 -1.15 0.00 0.00 33.47 32.41 1gvl s TRP 51 CO 0.22 -0.03 -0.15 0.08 0.02 0.00 0.00 176.95 177.08 1gvl s VAL 52 N 0.25 2.96 -0.12 4.03 1.01 -0.51 -1.87 120.40 126.15 1gvl s VAL 52 Ca -0.02 -0.74 -0.04 0.00 0.00 0.00 0.00 61.98 61.18 1gvl s VAL 52 Cb -0.03 -2.17 -0.03 0.00 0.00 0.00 0.00 36.38 34.15 1gvl s VAL 52 CO -0.01 0.57 0.01 -0.22 0.00 0.00 0.00 175.10 175.46 1gvl s LEU 53 N -0.42 3.60 0.00 3.92 2.96 0.75 -0.30 118.68 129.20 1gvl s LEU 53 Ca 0.05 0.09 -0.02 0.00 -0.22 0.00 0.00 54.13 54.02 1gvl s LEU 53 Cb -0.12 -1.86 0.01 0.00 0.50 0.00 0.00 46.19 44.72 1gvl s LEU 53 CO 0.02 0.29 0.39 1.07 -1.32 0.00 0.00 176.35 176.80 1gvl n THR 54 N 2.73 0.00 -2.90 3.68 5.66 -0.47 -0.49 114.28 122.49 1gvl n THR 54 Ca -0.18 -1.24 -0.36 0.00 -3.05 0.00 0.00 64.05 59.22 1gvl n THR 54 Cb 0.53 0.80 -0.06 0.00 -1.55 0.00 0.00 70.33 70.04 1gvl n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1gvl s ALA 55 N -2.38 3.27 0.44 1.79 0.00 -1.26 -0.88 121.76 122.74 1gvl s ALA 55 Ca 0.20 0.39 0.12 0.00 0.00 0.00 0.00 51.96 52.66 1gvl s ALA 55 Cb -0.01 -3.05 0.98 0.00 0.00 0.00 0.00 23.12 21.03 1gvl s ALA 55 CO 0.15 0.23 2.03 0.00 0.00 0.00 0.00 175.76 178.16 1gvl h ALA 56 N 3.15 1.73 0.00 0.00 0.00 -1.71 -0.80 119.26 121.63 1gvl h ALA 56 Ca -0.47 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.34 1gvl h ALA 56 Cb 1.19 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1gvl h ALA 56 CO 0.65 0.21 0.00 -2.39 0.00 0.00 0.00 179.25 177.72 1gvl n HIS 57 N -4.41 0.00 1.43 0.00 1.44 -1.26 -1.72 115.22 110.71 1gvl n HIS 57 Ca -0.01 0.00 0.14 0.00 -2.01 0.00 0.00 57.72 55.84 1gvl n HIS 57 Cb 0.16 -0.32 0.47 0.00 0.12 0.00 0.00 29.99 30.43 1gvl n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1gvl s LYS 59 N -2.03 4.19 0.11 0.00 2.47 -0.70 -4.98 119.74 118.79 1gvl s LYS 59 Ca 0.36 2.40 -0.10 0.00 -1.56 0.00 0.00 55.97 57.07 1gvl s LYS 59 Cb 0.21 -3.44 0.00 0.00 -1.46 0.00 0.00 37.83 33.14 1gvl s LYS 59 CO 0.34 -0.72 0.24 0.21 0.16 0.00 0.00 175.35 175.59 1gvl s LYS 60 N 2.15 0.93 0.72 4.03 2.47 -1.26 -5.16 119.74 123.63 1gvl s LYS 60 Ca 0.74 -0.95 -0.15 0.00 -1.56 0.00 0.00 55.97 54.06 1gvl s LYS 60 Cb -0.42 0.37 0.04 0.00 -1.46 0.00 0.00 37.83 36.35 1gvl s LYS 60 CO 0.33 -0.32 1.17 -2.14 0.16 0.00 0.00 175.35 174.55 1gvl s PRO 61 N -3.87 2.26 -1.56 4.03 0.02 -1.26 -4.13 135.00 130.50 1gvl s PRO 61 Ca 0.06 1.62 -0.02 0.00 0.02 0.00 0.00 61.00 62.68 1gvl s PRO 61 Cb 0.04 -1.86 0.02 0.00 0.02 0.00 0.00 34.50 32.72 1gvl s PRO 61 CO -0.10 -1.71 0.13 0.09 -0.33 0.00 0.00 177.00 175.08 1gvl n ASN 63 N -2.75 0.46 -4.76 2.53 3.02 -1.26 -4.77 115.26 107.72 1gvl n ASN 63 Ca 0.12 -1.23 -0.40 0.00 -0.03 0.00 0.00 54.58 53.05 1gvl n ASN 63 Cb 0.51 -1.85 0.03 0.00 -0.61 0.00 0.00 39.78 37.86 1gvl n ASN 63 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1gvl n LEU 64 N -4.52 5.30 -4.23 3.41 4.77 -1.26 -4.70 117.00 115.77 1gvl n LEU 64 Ca -0.28 1.09 -0.26 0.00 -0.03 0.00 0.00 56.01 56.52 1gvl n LEU 64 Cb 0.67 -1.60 -0.15 0.00 -2.33 0.00 0.00 43.42 40.01 1gvl n LEU 64 CO 0.84 -0.23 -0.52 -1.10 -1.33 0.00 0.00 177.39 175.05 1gvl s GLN 65 N -2.57 1.50 -0.03 3.23 -1.52 0.09 -2.40 119.66 117.96 1gvl s GLN 65 Ca 0.64 -0.83 0.07 0.00 -1.95 0.00 0.00 55.36 53.29 1gvl s GLN 65 Cb -0.44 -1.54 -0.02 0.00 -0.22 0.00 0.00 33.01 30.80 1gvl s GLN 65 CO 0.55 0.41 -0.24 0.08 -0.25 0.00 0.00 175.29 175.84 1gvl s VAL 66 N -0.64 2.21 -0.12 1.09 1.01 -0.09 -0.41 120.40 123.45 1gvl s VAL 66 Ca 0.08 -1.04 0.02 0.00 0.00 0.00 0.00 61.98 61.03 1gvl s VAL 66 Cb -0.08 -1.78 -0.00 0.00 0.00 0.00 0.00 36.38 34.51 1gvl s VAL 66 CO 0.01 0.58 -0.20 -0.36 0.00 0.00 0.00 175.10 175.13 1gvl s PHE 67 N -0.54 2.67 0.18 5.22 0.40 -0.32 -0.83 117.98 124.76 1gvl s PHE 67 Ca 0.08 -0.99 0.10 0.00 -0.60 0.00 0.00 56.93 55.52 1gvl s PHE 67 Cb -0.11 -1.79 -0.04 0.00 0.51 0.00 0.00 43.02 41.59 1gvl s PHE 67 CO 0.00 -0.40 -0.17 -0.51 0.70 0.00 0.00 175.22 174.83 1gvl s LEU 68 N 0.48 2.68 -1.64 -0.37 1.43 -1.26 -1.36 118.68 118.64 1gvl s LEU 68 Ca -0.13 -0.72 0.00 0.00 -1.03 0.00 0.00 54.13 52.25 1gvl s LEU 68 Cb -0.17 -1.40 0.00 0.00 0.03 0.00 0.00 46.19 44.65 1gvl s LEU 68 CO 0.05 0.12 0.00 0.61 0.23 0.00 0.00 176.35 177.36 1gvl n GLY 69 N 0.21 0.02 3.94 -3.19 0.00 -1.26 -4.99 105.19 99.91 1gvl n GLY 69 Ca -0.12 -0.12 -0.28 0.00 0.00 0.00 0.00 46.02 45.51 1gvl n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gvl s LYS 70 N -4.66 3.44 -0.00 1.61 -0.14 -1.26 -4.98 119.74 113.75 1gvl s LYS 70 Ca 0.00 -0.54 0.00 0.00 -1.36 0.00 0.00 55.97 54.07 1gvl s LYS 70 Cb 0.00 -2.98 -0.00 0.00 -1.68 0.00 0.00 37.83 33.17 1gvl s LYS 70 CO 0.00 0.54 -0.00 1.58 -0.76 0.00 0.00 175.35 176.71 1gvl n HIS 71 N -0.31 0.00 -3.76 3.18 -0.00 -1.26 -4.84 115.22 108.22 1gvl n HIS 71 Ca -0.06 0.00 -0.13 0.00 -0.00 0.00 0.00 57.72 57.52 1gvl n HIS 71 Cb 0.53 -0.01 -0.14 0.00 -0.00 0.00 0.00 29.99 30.37 1gvl n HIS 71 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.34 176.88 1gvl s ASN 72 N -3.45 -0.13 0.03 0.26 2.20 -1.26 -3.76 114.94 108.84 1gvl s ASN 72 Ca -0.00 0.31 0.02 0.00 -0.94 0.00 0.00 52.86 52.25 1gvl s ASN 72 Cb 0.00 0.23 -0.02 0.00 -2.00 0.00 0.00 41.25 39.46 1gvl s ASN 72 CO 0.01 -0.13 -0.08 -0.76 -2.94 0.00 0.00 177.10 173.20 1gvl s LEU 73 N 0.95 2.21 0.30 3.54 1.43 0.39 -4.95 118.68 122.54 1gvl s LEU 73 Ca -0.07 -0.47 0.10 0.00 -1.03 0.00 0.00 54.13 52.65 1gvl s LEU 73 Cb -0.09 -0.21 -0.06 0.00 0.03 0.00 0.00 46.19 45.87 1gvl s LEU 73 CO -0.05 -0.15 -0.13 -0.13 0.23 0.00 0.00 176.35 176.13 1gvl s ARG 74 N -1.32 1.68 0.43 1.70 0.52 -1.26 -0.56 118.95 120.14 1gvl s ARG 74 Ca -0.07 -1.82 -0.25 0.00 -0.52 0.00 0.00 55.73 53.06 1gvl s ARG 74 Cb -0.09 -1.57 -0.08 0.00 0.52 0.00 0.00 34.95 33.74 1gvl s ARG 74 CO 0.00 0.19 1.29 -0.65 0.02 0.00 0.00 175.30 176.15 1gvl s GLN 75 N -3.60 3.85 -1.73 3.54 -1.52 -1.26 -1.11 119.66 117.82 1gvl s GLN 75 Ca 0.30 2.11 -0.00 0.00 -1.95 0.00 0.00 55.36 55.82 1gvl s GLN 75 Cb -0.00 -2.65 0.00 0.00 -0.22 0.00 0.00 33.01 30.14 1gvl s GLN 75 CO 0.14 -0.58 0.02 1.04 -0.25 0.00 0.00 175.29 175.66 1gvl n GLN 76 N -0.09 -1.81 -1.64 2.91 1.13 0.19 -4.78 117.38 113.29 1gvl n GLN 76 Ca 0.05 0.98 -0.64 0.00 -1.94 0.00 0.00 57.00 55.45 1gvl n GLN 76 Cb 0.44 -5.65 -0.09 0.00 0.11 0.00 0.00 30.24 25.05 1gvl n GLN 76 CO 0.00 0.00 0.00 -1.91 -1.44 0.00 0.00 177.06 173.71 1gvl n GLU 77 N -3.03 0.00 0.01 -1.09 4.07 -0.27 -4.84 120.64 115.49 1gvl n GLU 77 Ca -0.24 0.00 -0.22 0.00 -0.06 0.00 0.00 57.16 56.65 1gvl n GLU 77 Cb 0.68 -1.47 -0.14 0.00 -0.06 0.00 0.00 31.44 30.45 1gvl n GLU 77 CO 0.00 0.00 0.00 0.77 -0.06 0.00 0.00 177.13 177.84 1gvl h SER 78 N 4.32 0.42 -0.91 4.31 0.02 -1.86 -3.45 113.55 116.41 1gvl h SER 78 Ca -0.45 -0.95 -0.44 0.00 -0.84 0.00 0.00 61.79 59.11 1gvl h SER 78 Cb 1.36 -0.14 -0.03 0.00 0.14 0.00 0.00 62.40 63.73 1gvl h SER 78 CO 0.87 1.85 1.60 -0.24 -1.14 0.00 0.00 176.83 179.76 1gvl n SER 79 N -3.52 1.44 0.00 3.07 2.88 -1.26 -4.86 113.62 111.37 1gvl n SER 79 Ca -0.31 -0.34 0.00 0.00 -1.33 0.00 0.00 58.87 56.89 1gvl n SER 79 Cb 1.04 -1.32 0.00 0.00 -0.75 0.00 0.00 64.21 63.18 1gvl n SER 79 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1gvl n GLN 80 N 8.69 1.92 -3.44 -1.46 3.00 -1.26 -4.72 117.38 120.11 1gvl n GLN 80 Ca 0.49 0.00 -0.17 0.00 -0.01 0.00 0.00 57.00 57.31 1gvl n GLN 80 Cb 0.35 0.00 0.08 0.00 0.00 0.00 0.00 30.24 30.67 1gvl n GLN 80 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.06 175.15 1gvl n GLU 81 N 0.00 -6.15 -4.19 -1.09 2.13 -1.26 -5.01 120.64 105.07 1gvl n GLU 81 Ca 0.00 0.83 -0.24 0.00 0.66 0.00 0.00 57.16 58.42 1gvl n GLU 81 Cb 0.00 -5.81 -0.07 0.00 0.27 0.00 0.00 31.44 25.83 1gvl n GLU 81 CO 0.00 0.00 0.00 1.14 -0.41 0.00 0.00 177.13 177.86 1gvl s GLN 82 N -5.33 2.26 -0.05 5.31 -2.07 -1.26 -4.51 119.66 114.01 1gvl s GLN 82 Ca 0.04 -1.63 -0.00 0.00 -1.82 0.00 0.00 55.36 51.94 1gvl s GLN 82 Cb -0.01 -2.08 0.03 0.00 -1.09 0.00 0.00 33.01 29.86 1gvl s GLN 82 CO 0.74 0.11 -0.02 0.45 -1.32 0.00 0.00 175.29 175.25 1gvl s SER 83 N -3.80 1.10 0.40 12.60 0.15 -0.01 -4.98 113.70 119.16 1gvl s SER 83 Ca 0.37 -0.09 -0.24 0.00 0.70 0.00 0.00 55.95 56.69 1gvl s SER 83 Cb -0.01 -0.40 -0.09 0.00 -1.71 0.00 0.00 66.02 63.80 1gvl s SER 83 CO 0.21 -0.12 1.04 -0.44 1.20 0.00 0.00 173.24 175.13 1gvl s SER 84 N 1.35 6.78 -0.10 5.45 0.01 -1.26 -0.91 113.70 125.01 1gvl s SER 84 Ca -0.05 2.00 -0.24 0.00 1.31 0.00 0.00 55.95 58.97 1gvl s SER 84 Cb -0.13 -2.58 -0.03 0.00 0.21 0.00 0.00 66.02 63.49 1gvl s SER 84 CO -0.02 -0.48 0.76 -0.69 0.41 0.00 0.00 173.24 173.22 1gvl s VAL 85 N -1.70 4.98 -0.92 3.43 1.01 -1.01 -1.19 120.40 125.00 1gvl s VAL 85 Ca 0.58 1.53 0.18 0.00 0.00 0.00 0.00 61.98 64.27 1gvl s VAL 85 Cb -0.21 -4.09 -0.18 0.00 0.00 0.00 0.00 36.38 31.90 1gvl s VAL 85 CO 0.26 0.17 0.78 1.33 0.00 0.00 0.00 175.10 177.64 1gvl n VAL 86 N 4.14 0.00 -3.67 2.92 0.24 0.09 -4.82 118.33 117.23 1gvl n VAL 86 Ca 0.01 -0.09 -0.10 0.00 -2.04 0.00 0.00 64.34 62.13 1gvl n VAL 86 Cb 0.50 1.02 -0.09 0.00 -1.47 0.00 0.00 33.84 33.80 1gvl n VAL 86 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 1gvl s ARG 87 N -2.68 0.59 -0.13 7.34 3.52 -1.23 -5.00 118.95 121.37 1gvl s ARG 87 Ca 0.07 0.98 0.03 0.00 -0.13 0.00 0.00 55.73 56.68 1gvl s ARG 87 Cb 0.14 0.13 0.01 0.00 -1.56 0.00 0.00 34.95 33.67 1gvl s ARG 87 CO 0.73 -0.14 -0.21 0.00 -0.81 0.00 0.00 175.30 174.87 1gvl s ALA 88 N 1.23 2.18 -0.32 6.12 0.00 -1.26 -0.27 121.76 129.43 1gvl s ALA 88 Ca -0.07 -1.05 0.04 0.00 0.00 0.00 0.00 51.96 50.88 1gvl s ALA 88 Cb -0.06 -0.96 0.09 0.00 0.00 0.00 0.00 23.12 22.19 1gvl s ALA 88 CO -0.12 -0.01 0.01 0.08 0.00 0.00 0.00 175.76 175.72 1gvl s VAL 89 N 0.80 2.26 0.30 0.00 1.01 0.14 -5.00 120.40 119.91 1gvl s VAL 89 Ca -0.08 -2.18 -0.20 0.00 0.00 0.00 0.00 61.98 59.52 1gvl s VAL 89 Cb -0.16 -2.59 -0.09 0.00 0.00 0.00 0.00 36.38 33.54 1gvl s VAL 89 CO -0.01 -0.46 0.81 -0.63 0.00 0.00 0.00 175.10 174.81 1gvl s ILE 90 N 0.95 4.48 0.19 2.22 -1.09 -1.26 -1.37 121.20 125.32 1gvl s ILE 90 Ca 0.06 1.37 -0.32 0.00 -2.23 0.00 0.00 60.65 59.53 1gvl s ILE 90 Cb -0.19 -3.81 -0.12 0.00 -1.58 0.00 0.00 42.46 36.76 1gvl s ILE 90 CO -0.07 0.04 1.71 1.57 -1.23 0.00 0.00 174.94 176.95 1gvl n HIS 91 N 0.27 2.64 0.32 3.97 -0.00 -0.85 -4.84 115.22 116.73 1gvl n HIS 91 Ca 0.01 0.06 0.20 0.00 0.46 0.00 0.00 57.72 58.45 1gvl n HIS 91 Cb 0.52 -2.65 1.06 0.00 -0.12 0.00 0.00 29.99 28.79 1gvl n HIS 91 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 1gvl h PRO 92 N 6.83 0.00 -0.59 1.57 0.14 -1.93 -1.68 132.00 136.34 1gvl h PRO 92 Ca -0.44 0.00 0.00 0.00 0.14 0.00 0.00 66.00 65.70 1gvl h PRO 92 Cb 1.22 0.00 0.00 0.00 0.14 0.00 0.00 31.00 32.36 1gvl h PRO 92 CO 0.94 0.01 0.00 -0.25 0.14 0.00 0.00 178.00 178.84 1gvl n ASP 93 N -3.30 5.10 -4.73 1.44 8.00 -1.26 -4.98 116.55 116.82 1gvl n ASP 93 Ca -0.03 -2.69 -0.42 0.00 0.71 0.00 0.00 54.79 52.37 1gvl n ASP 93 Cb 0.11 -0.62 -0.02 0.00 -0.02 0.00 0.00 41.12 40.57 1gvl n ASP 93 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 1gvl s TYR 94 N -2.29 2.87 -0.26 1.24 5.04 -0.63 -4.74 117.35 118.57 1gvl s TYR 94 Ca 0.52 0.62 0.02 0.00 -2.44 0.00 0.00 57.07 55.79 1gvl s TYR 94 Cb 0.36 -4.05 0.07 0.00 0.35 0.00 0.00 41.96 38.69 1gvl s TYR 94 CO 0.20 -3.75 -0.05 0.34 -1.34 0.00 0.00 175.55 170.95 1gvl s ASP 95 N 0.82 4.20 0.30 4.32 2.15 -0.62 -5.01 116.67 122.84 1gvl s ASP 95 Ca 0.68 -1.43 -0.02 0.00 0.43 0.00 0.00 52.55 52.22 1gvl s ASP 95 Cb -0.47 -1.36 0.45 0.00 -0.30 0.00 0.00 42.92 41.24 1gvl s ASP 95 CO 0.39 -0.25 1.94 0.00 -0.17 0.00 0.00 175.17 177.08 1gvl h ALA 96 N 7.85 1.38 -0.55 3.66 0.00 -1.94 0.44 119.26 130.10 1gvl h ALA 96 Ca -0.16 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.66 1gvl h ALA 96 Cb 1.05 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.51 1gvl h ALA 96 CO 0.45 0.53 0.33 0.00 0.00 0.00 0.00 179.25 180.56 1gvl h ALA 97 N 1.46 0.70 0.00 0.00 0.00 -1.98 -3.08 119.26 116.37 1gvl h ALA 97 Ca 0.27 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1gvl h ALA 97 Cb -0.04 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.53 1gvl h ALA 97 CO -0.05 0.20 -1.18 -1.13 0.00 0.00 0.00 179.25 177.08 1gvl n SER 98 N -4.64 0.57 -1.44 0.00 3.41 -1.08 -4.95 113.62 105.48 1gvl n SER 98 Ca 0.03 -0.21 -0.17 0.00 -0.26 0.00 0.00 58.87 58.26 1gvl n SER 98 Cb 0.06 0.99 -0.06 0.00 -0.26 0.00 0.00 64.21 64.94 1gvl n SER 98 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1gvl n HIS 99 N -2.02 -0.19 -2.24 7.33 8.25 0.15 -4.98 115.22 121.52 1gvl n HIS 99 Ca 0.01 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.05 1gvl n HIS 99 Cb 0.46 -3.03 -0.03 0.00 1.12 0.00 0.00 29.99 28.51 1gvl n HIS 99 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1gvl s ASP 100 N -2.68 6.91 -0.85 0.41 2.15 -1.11 -3.29 116.67 118.21 1gvl s ASP 100 Ca 0.00 2.30 -0.01 0.00 0.43 0.00 0.00 52.55 55.27 1gvl s ASP 100 Cb 0.00 -2.60 0.00 0.00 -0.30 0.00 0.00 42.92 40.02 1gvl s ASP 100 CO 0.00 -0.55 0.71 0.00 -0.17 0.00 0.00 175.17 175.16 1gvl n GLN 101 N 3.31 -4.74 -2.25 4.34 6.02 -1.26 -1.59 117.38 121.21 1gvl n GLN 101 Ca 0.08 0.59 -0.43 0.00 -0.01 0.00 0.00 57.00 57.24 1gvl n GLN 101 Cb 0.43 -4.85 0.00 0.00 1.02 0.00 0.00 30.24 26.84 1gvl n GLN 101 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 1gvl n ASP 102 N -2.38 4.54 -3.76 1.08 2.03 -1.21 -4.34 116.55 112.51 1gvl n ASP 102 Ca -0.18 -2.90 -0.13 0.00 0.52 0.00 0.00 54.79 52.10 1gvl n ASP 102 Cb 0.61 -1.69 -0.09 0.00 -0.72 0.00 0.00 41.12 39.23 1gvl n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1gvl s ILE 103 N 3.44 0.05 -0.20 5.18 2.07 -1.26 -3.67 121.20 126.80 1gvl s ILE 103 Ca 0.50 -0.39 -0.18 0.00 -1.41 0.00 0.00 60.65 59.17 1gvl s ILE 103 Cb 0.08 -0.59 0.05 0.00 0.13 0.00 0.00 42.46 42.14 1gvl s ILE 103 CO 0.00 -0.21 0.54 -0.32 -1.91 0.00 0.00 174.94 173.03 1gvl s MET 104 N -1.05 0.61 -0.16 3.50 -2.45 -0.06 -2.00 119.30 117.68 1gvl s MET 104 Ca -0.11 0.78 -0.07 0.00 -1.25 0.00 0.00 55.69 55.04 1gvl s MET 104 Cb -0.05 0.26 -0.04 0.00 1.25 0.00 0.00 34.83 36.26 1gvl s MET 104 CO 0.04 -0.09 0.08 -0.51 1.05 0.00 0.00 175.02 175.58 1gvl s LEU 105 N 0.48 3.94 -0.19 4.11 1.43 -0.47 -1.37 118.68 126.61 1gvl s LEU 105 Ca -0.02 0.18 -0.01 0.00 -1.03 0.00 0.00 54.13 53.25 1gvl s LEU 105 Cb -0.04 -1.98 0.00 0.00 0.03 0.00 0.00 46.19 44.20 1gvl s LEU 105 CO -0.02 0.24 -0.13 -0.76 0.23 0.00 0.00 176.35 175.91 1gvl s LEU 106 N -0.03 2.49 -0.21 1.79 1.43 0.59 -0.68 118.68 124.06 1gvl s LEU 106 Ca 0.07 -0.51 -0.21 0.00 -1.03 0.00 0.00 54.13 52.45 1gvl s LEU 106 Cb -0.12 -1.60 -0.02 0.00 0.03 0.00 0.00 46.19 44.48 1gvl s LEU 106 CO 0.01 0.01 0.65 -0.60 0.23 0.00 0.00 176.35 176.64 1gvl s ARG 107 N 1.27 4.19 0.60 1.70 3.52 0.62 -1.43 118.95 129.42 1gvl s ARG 107 Ca 0.03 0.63 -0.15 0.00 -0.13 0.00 0.00 55.73 56.11 1gvl s ARG 107 Cb -0.14 -3.60 -0.04 0.00 -1.56 0.00 0.00 34.95 29.62 1gvl s ARG 107 CO -0.07 -0.29 1.05 -0.51 -0.81 0.00 0.00 175.30 174.67 1gvl s LEU 108 N 2.10 3.46 0.42 -0.88 1.43 -0.25 -0.73 118.68 124.23 1gvl s LEU 108 Ca 0.29 1.75 0.20 0.00 -1.03 0.00 0.00 54.13 55.33 1gvl s LEU 108 Cb -0.16 -4.52 0.94 0.00 0.03 0.00 0.00 46.19 42.48 1gvl s LEU 108 CO 0.10 -1.13 1.87 0.00 0.23 0.00 0.00 176.35 177.42 1gvl h ALA 109 N 0.32 1.22 -2.67 4.21 0.00 -1.47 -3.43 119.26 117.44 1gvl h ALA 109 Ca -0.46 -0.26 -0.13 0.00 0.00 0.00 0.00 54.91 54.05 1gvl h ALA 109 Cb 1.21 -0.05 -0.19 0.00 0.00 0.00 0.00 17.79 18.77 1gvl h ALA 109 CO 0.58 0.36 -0.51 1.03 0.00 0.00 0.00 179.25 180.70 1gvl s ARG 110 N -3.99 0.54 0.37 0.00 0.52 -1.26 -5.05 118.95 110.07 1gvl s ARG 110 Ca -0.02 -0.61 -0.28 0.00 -0.52 0.00 0.00 55.73 54.31 1gvl s ARG 110 Cb 0.13 0.22 -0.10 0.00 0.52 0.00 0.00 34.95 35.72 1gvl s ARG 110 CO 0.67 -0.13 1.34 -1.25 0.02 0.00 0.00 175.30 175.94 1gvl s PRO 111 N -2.10 4.16 0.32 3.54 0.04 -1.26 -4.83 135.00 134.87 1gvl s PRO 111 Ca -0.09 2.25 -0.29 0.00 0.04 0.00 0.00 61.00 62.91 1gvl s PRO 111 Cb -0.04 -2.93 -0.10 0.00 0.04 0.00 0.00 34.50 31.47 1gvl s PRO 111 CO -0.02 -0.37 1.31 0.00 0.04 0.00 0.00 177.00 177.96 1gvl s ALA 112 N -1.18 3.50 -0.46 8.56 0.00 0.67 -4.97 121.76 127.88 1gvl s ALA 112 Ca 0.53 1.25 -0.20 0.00 0.00 0.00 0.00 51.96 53.54 1gvl s ALA 112 Cb -0.40 -3.48 0.04 0.00 0.00 0.00 0.00 23.12 19.27 1gvl s ALA 112 CO 0.53 -0.63 0.63 0.21 0.00 0.00 0.00 175.76 176.50 1gvl s LYS 113 N -1.63 3.21 0.40 0.00 2.47 -1.26 -4.86 119.74 118.07 1gvl s LYS 113 Ca 0.50 -0.57 -0.26 0.00 -1.56 0.00 0.00 55.97 54.08 1gvl s LYS 113 Cb -0.40 -4.00 -0.08 0.00 -1.46 0.00 0.00 37.83 31.88 1gvl s LYS 113 CO 0.51 -1.09 1.21 -0.51 0.16 0.00 0.00 175.35 175.64 1gvl s LEU 114 N 2.75 4.21 0.00 5.43 1.43 -1.26 -4.79 118.68 126.44 1gvl s LEU 114 Ca 0.19 2.45 0.00 0.00 -1.03 0.00 0.00 54.13 55.75 1gvl s LEU 114 Cb -0.16 -3.97 0.00 0.00 0.03 0.00 0.00 46.19 42.09 1gvl s LEU 114 CO 0.16 -0.73 0.00 -1.54 0.23 0.00 0.00 176.35 174.47 1gvl n SER 115 N 0.12 0.00 0.19 2.29 3.41 -0.28 -4.94 113.62 114.41 1gvl n SER 115 Ca 0.04 -0.69 0.04 0.00 -0.26 0.00 0.00 58.87 58.00 1gvl n SER 115 Cb 0.45 0.00 0.42 0.00 -0.26 0.00 0.00 64.21 64.83 1gvl n SER 115 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1gvl h GLU 116 N 0.00 0.06 0.00 4.33 3.07 -2.02 -3.08 114.58 116.94 1gvl h GLU 116 Ca 0.00 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.84 1gvl h GLU 116 Cb 0.00 -0.01 0.00 0.00 -0.84 0.00 0.00 28.75 27.90 1gvl h GLU 116 CO 0.00 0.29 -1.20 1.28 -1.40 0.00 0.00 179.01 177.99 1gvl n LEU 117 N -4.23 0.58 -3.76 1.33 4.77 -1.26 -4.83 117.00 109.60 1gvl n LEU 117 Ca -0.02 -0.11 -0.25 0.00 -0.03 0.00 0.00 56.01 55.61 1gvl n LEU 117 Cb 0.31 -0.06 -0.17 0.00 -2.33 0.00 0.00 43.42 41.17 1gvl n LEU 117 CO 0.38 0.07 -0.38 -0.63 -1.33 0.00 0.00 177.39 175.50 1gvl s ILE 118 N -3.22 0.44 -0.09 -0.08 1.01 -1.16 -4.14 121.20 113.97 1gvl s ILE 118 Ca 0.02 -0.10 -0.08 0.00 0.00 0.00 0.00 60.65 60.49 1gvl s ILE 118 Cb 0.15 -0.71 0.02 0.00 0.01 0.00 0.00 42.46 41.93 1gvl s ILE 118 CO 0.83 0.12 0.23 -1.10 0.00 0.00 0.00 174.94 175.02 1gvl s GLN 119 N 1.93 0.26 0.61 2.79 -1.52 -0.72 -1.12 119.66 121.88 1gvl s GLN 119 Ca 0.03 0.34 -0.15 0.00 -1.95 0.00 0.00 55.36 53.63 1gvl s GLN 119 Cb -0.14 0.10 -0.03 0.00 -0.22 0.00 0.00 33.01 32.72 1gvl s GLN 119 CO -0.06 -0.05 1.06 -1.25 -0.25 0.00 0.00 175.29 174.74 1gvl s PRO 120 N 0.25 3.25 -0.21 2.91 0.04 -1.26 -2.96 135.00 137.02 1gvl s PRO 120 Ca -0.01 1.20 -0.07 0.00 0.04 0.00 0.00 61.00 62.16 1gvl s PRO 120 Cb -0.03 -2.02 -0.03 0.00 0.04 0.00 0.00 34.50 32.46 1gvl s PRO 120 CO -0.01 -0.87 0.05 -1.17 0.04 0.00 0.00 177.00 175.05 1gvl s LEU 121 N -4.61 3.56 0.53 -3.56 2.96 -0.35 -4.93 118.68 112.28 1gvl s LEU 121 Ca 0.63 -0.08 -0.21 0.00 -0.22 0.00 0.00 54.13 54.25 1gvl s LEU 121 Cb -0.16 -1.92 -0.05 0.00 0.50 0.00 0.00 46.19 44.56 1gvl s LEU 121 CO 0.39 0.08 1.24 -2.16 -1.32 0.00 0.00 176.35 174.58 1gvl s PRO 122 N 0.92 3.33 0.32 0.98 0.05 -1.26 -4.66 135.00 134.68 1gvl s PRO 122 Ca 0.03 1.94 -0.18 0.00 0.05 0.00 0.00 61.00 62.84 1gvl s PRO 122 Cb -0.14 -2.22 -0.09 0.00 0.05 0.00 0.00 34.50 32.10 1gvl s PRO 122 CO 0.03 -0.95 0.79 -0.51 0.05 0.00 0.00 177.00 176.41 1gvl s LEU 123 N -3.49 4.14 -0.22 -3.56 1.43 -1.26 -0.70 118.68 115.01 1gvl s LEU 123 Ca 0.70 1.44 -0.29 0.00 -1.03 0.00 0.00 54.13 54.95 1gvl s LEU 123 Cb -0.33 -4.03 -0.00 0.00 0.03 0.00 0.00 46.19 41.86 1gvl s LEU 123 CO 0.38 -0.16 1.20 -0.70 0.23 0.00 0.00 176.35 177.31 1gvl s GLU 124 N -2.68 4.16 0.00 1.70 2.56 -0.81 -4.75 118.70 118.89 1gvl s GLU 124 Ca 0.52 1.46 0.23 0.00 0.00 0.00 0.00 54.97 57.19 1gvl s GLU 124 Cb -0.12 -3.76 0.18 0.00 2.00 0.00 0.00 34.13 32.43 1gvl s GLU 124 CO 0.18 -0.79 1.19 0.54 -0.56 0.00 0.00 175.26 175.82 1gvl n ARG 125 N 6.70 0.28 -3.85 4.30 1.74 -1.26 -4.11 116.66 120.47 1gvl n ARG 125 Ca 0.13 -0.21 -0.36 0.00 -0.77 0.00 0.00 57.85 56.65 1gvl n ARG 125 Cb 0.46 -1.50 -0.13 0.00 -1.02 0.00 0.00 32.46 30.27 1gvl n ARG 125 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1gvl s ASP 128 N -2.86 5.05 0.49 0.55 -1.08 -1.26 -4.95 116.67 112.62 1gvl s ASP 128 Ca 0.13 -1.35 0.33 0.00 -0.52 0.00 0.00 52.55 51.14 1gvl s ASP 128 Cb 0.17 -1.77 1.64 0.00 -1.46 0.00 0.00 42.92 41.51 1gvl s ASP 128 CO 0.73 -0.32 2.00 0.00 0.52 0.00 0.00 175.17 178.10 1gvl n SER 130 N -2.74 3.72 -4.57 0.00 7.64 -1.26 -4.98 113.62 111.43 1gvl n SER 130 Ca -0.01 -2.14 -0.43 0.00 1.01 0.00 0.00 58.87 57.31 1gvl n SER 130 Cb 0.14 -0.47 -0.00 0.00 -1.01 0.00 0.00 64.21 62.87 1gvl n SER 130 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1gvl n ALA 131 N 1.24 -0.34 0.09 -0.43 0.00 -0.29 -4.90 120.51 115.88 1gvl n ALA 131 Ca 0.22 0.29 0.11 0.00 0.00 0.00 0.00 53.44 54.06 1gvl n ALA 131 Cb 0.63 -1.99 -0.02 0.00 0.00 0.00 0.00 19.45 18.07 1gvl n ALA 131 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1gvl n GLN 132 N 0.47 0.61 -2.03 0.00 0.00 -1.26 -4.91 117.38 110.27 1gvl n GLN 132 Ca 0.10 0.08 -0.42 0.00 0.00 0.00 0.00 57.00 56.76 1gvl n GLN 132 Cb 0.36 -1.79 -0.03 0.00 0.00 0.00 0.00 30.24 28.78 1gvl n GLN 132 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.06 178.05 1gvl s THR 133 N -3.38 3.08 -0.15 -0.39 2.01 -1.26 -4.88 115.64 110.67 1gvl s THR 133 Ca -0.01 0.67 0.02 0.00 0.31 0.00 0.00 61.69 62.67 1gvl s THR 133 Cb 0.10 -3.43 -0.01 0.00 0.01 0.00 0.00 72.50 69.17 1gvl s THR 133 CO 0.81 0.03 0.22 0.35 -0.69 0.00 0.00 174.62 175.33 1gvl n THR 134 N 4.32 0.00 -2.98 -0.82 -2.24 -1.26 -4.85 114.28 106.46 1gvl n THR 134 Ca 0.14 -0.47 -0.41 0.00 -2.27 0.00 0.00 64.05 61.05 1gvl n THR 134 Cb 0.41 1.01 -0.05 0.00 -2.10 0.00 0.00 70.33 69.60 1gvl n THR 134 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1gvl s SER 135 N -0.92 6.89 0.30 3.42 0.15 -1.26 -1.21 113.70 121.07 1gvl s SER 135 Ca 0.01 1.09 0.05 0.00 0.70 0.00 0.00 55.95 57.80 1gvl s SER 135 Cb 0.02 -2.42 -0.03 0.00 -1.71 0.00 0.00 66.02 61.87 1gvl s SER 135 CO 0.07 -0.31 0.23 0.00 1.20 0.00 0.00 173.24 174.43 1gvl s HIS 137 N -3.61 0.55 0.17 0.00 -3.43 -0.30 -1.63 115.29 107.04 1gvl s HIS 137 Ca 0.40 -0.81 0.10 0.00 -0.80 0.00 0.00 55.06 53.94 1gvl s HIS 137 Cb 0.04 -0.37 -0.04 0.00 -1.43 0.00 0.00 32.58 30.78 1gvl s HIS 137 CO 0.23 -0.24 -0.20 0.96 -2.00 0.00 0.00 174.74 173.49 1gvl s ILE 138 N -2.85 2.01 0.02 -5.38 -0.00 -0.18 -0.61 121.20 114.20 1gvl s ILE 138 Ca -0.00 -1.94 0.07 0.00 -0.00 0.00 0.00 60.65 58.77 1gvl s ILE 138 Cb 0.00 -1.93 -0.02 0.00 -0.00 0.00 0.00 42.46 40.51 1gvl s ILE 138 CO -0.05 -0.23 -0.21 -0.76 -0.00 0.00 0.00 174.94 173.69 1gvl s LEU 139 N -2.63 2.11 0.02 0.37 1.43 -1.01 -2.18 118.68 116.79 1gvl s LEU 139 Ca 0.17 -0.46 -0.25 0.00 -1.03 0.00 0.00 54.13 52.56 1gvl s LEU 139 Cb -0.07 -1.02 0.06 0.00 0.03 0.00 0.00 46.19 45.19 1gvl s LEU 139 CO 0.08 0.20 0.57 -0.83 0.23 0.00 0.00 176.35 176.60 1gvl s GLY 140 N -0.88 -0.48 -0.04 -3.19 0.00 -0.12 -4.06 107.32 98.55 1gvl s GLY 140 Ca 0.08 0.82 -0.24 0.00 0.00 0.00 0.00 44.72 45.38 1gvl s GLY 140 CO 0.01 0.50 0.71 -0.98 0.00 0.00 0.00 173.10 173.34 1gvl s TRP 141 N -2.07 3.62 0.02 1.90 0.52 -1.26 0.72 118.94 122.39 1gvl s TRP 141 Ca -0.07 1.30 -0.29 0.00 0.02 0.00 0.00 56.10 57.06 1gvl s TRP 141 Cb -0.01 -2.80 0.11 0.00 -1.15 0.00 0.00 33.47 29.62 1gvl s TRP 141 CO 0.02 0.14 1.22 0.20 0.02 0.00 0.00 176.95 178.55 1gvl s GLY 142 N 0.56 -0.34 -0.30 0.98 0.00 -0.45 -1.83 107.32 105.95 1gvl s GLY 142 Ca 0.38 0.50 -0.14 0.00 0.00 0.00 0.00 44.72 45.46 1gvl s GLY 142 CO 0.19 0.64 0.30 0.54 0.00 0.00 0.00 173.10 174.77 1gvl s LYS 143 N -2.53 3.85 0.45 2.90 1.02 -1.26 -1.06 119.74 123.10 1gvl s LYS 143 Ca 0.15 -0.24 0.25 0.00 0.02 0.00 0.00 55.97 56.16 1gvl s LYS 143 Cb 0.03 -3.70 1.27 0.00 -0.52 0.00 0.00 37.83 34.90 1gvl s LYS 143 CO -0.02 -0.32 1.78 1.15 -0.92 0.00 0.00 175.35 177.01 1gvl h THR 144 N 5.43 0.47 -2.38 2.17 2.02 -1.92 -3.43 112.91 115.26 1gvl h THR 144 Ca -0.32 -0.09 -0.04 0.00 0.77 0.00 0.00 66.41 66.73 1gvl h THR 144 Cb 1.17 0.20 -0.16 0.00 -1.74 0.00 0.00 68.15 67.61 1gvl h THR 144 CO 0.63 0.05 0.21 0.00 0.37 0.00 0.00 175.52 176.77 1gvl s ALA 145 N -5.30 -1.71 -0.36 6.16 0.00 -1.26 -4.99 121.76 114.30 1gvl s ALA 145 Ca -0.07 1.00 -0.42 0.00 0.00 0.00 0.00 51.96 52.47 1gvl s ALA 145 Cb 0.25 0.33 -0.17 0.00 0.00 0.00 0.00 23.12 23.53 1gvl s ALA 145 CO 0.80 -0.53 1.71 -0.40 0.00 0.00 0.00 175.76 177.35 1gvl n ASP 148 N 0.40 1.99 0.00 0.00 5.75 -1.26 -4.57 116.55 118.86 1gvl n ASP 148 Ca -0.18 1.10 0.00 0.00 -0.01 0.00 0.00 54.79 55.70 1gvl n ASP 148 Cb 0.60 -1.05 0.00 0.00 -1.03 0.00 0.00 41.12 39.64 1gvl n ASP 148 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1gvl n GLY 149 N 4.22 -0.56 0.12 6.12 0.00 -1.26 -5.01 105.19 108.83 1gvl n GLY 149 Ca 0.29 0.54 0.00 0.00 0.00 0.00 0.00 46.02 46.85 1gvl n GLY 149 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1gvl n ASP 150 N 0.00 0.00 -4.61 1.61 5.75 -1.26 -5.14 116.55 112.89 1gvl n ASP 150 Ca 0.00 -0.38 -0.29 0.00 -0.01 0.00 0.00 54.79 54.11 1gvl n ASP 150 Cb 0.00 0.00 0.20 0.00 -1.03 0.00 0.00 41.12 40.29 1gvl n ASP 150 CO 0.00 0.00 0.00 0.72 -0.11 0.00 0.00 177.20 177.81 1gvl s PHE 151 N 0.00 1.82 1.03 2.11 -0.71 -1.26 -4.96 117.98 116.00 1gvl s PHE 151 Ca 0.00 1.20 -0.12 0.00 -1.04 0.00 0.00 56.93 56.97 1gvl s PHE 151 Cb 0.00 -3.18 0.21 0.00 -1.21 0.00 0.00 43.02 38.83 1gvl s PHE 151 CO 0.00 -3.15 1.08 -1.25 -1.34 0.00 0.00 175.22 170.56 1gvl s PRO 152 N -4.74 0.17 0.25 1.99 0.05 -1.26 -4.89 135.00 126.57 1gvl s PRO 152 Ca 0.66 1.05 -0.29 0.00 0.05 0.00 0.00 61.00 62.48 1gvl s PRO 152 Cb -0.21 -1.67 -0.09 0.00 0.05 0.00 0.00 34.50 32.58 1gvl s PRO 152 CO 0.60 -3.05 0.92 -0.51 0.05 0.00 0.00 177.00 175.01 1gvl s ASP 153 N -2.78 7.55 0.30 6.66 1.01 0.28 -4.58 116.67 125.11 1gvl s ASP 153 Ca 0.67 1.88 0.03 0.00 0.71 0.00 0.00 52.55 55.84 1gvl s ASP 153 Cb -0.23 -2.59 -0.04 0.00 1.01 0.00 0.00 42.92 41.08 1gvl s ASP 153 CO 0.61 0.12 0.15 0.42 0.21 0.00 0.00 175.17 176.68 1gvl s THR 154 N -1.26 0.34 -0.29 -1.27 -4.23 -0.22 -0.46 115.64 108.24 1gvl s THR 154 Ca 0.42 -2.00 -0.26 0.00 -1.18 0.00 0.00 61.69 58.67 1gvl s THR 154 Cb -0.24 -2.52 0.01 0.00 1.34 0.00 0.00 72.50 71.08 1gvl s THR 154 CO 0.30 0.00 0.91 -0.63 -0.54 0.00 0.00 174.62 174.66 1gvl s ILE 155 N -3.64 4.70 -0.18 2.99 1.01 -1.25 -1.34 121.20 123.50 1gvl s ILE 155 Ca 0.36 1.51 -0.15 0.00 0.00 0.00 0.00 60.65 62.37 1gvl s ILE 155 Cb 0.05 -4.24 -0.04 0.00 0.01 0.00 0.00 42.46 38.24 1gvl s ILE 155 CO 0.17 -0.28 0.35 -1.10 0.00 0.00 0.00 174.94 174.07 1gvl s GLN 156 N 3.18 4.21 0.02 2.79 -1.52 0.22 -4.93 119.66 123.64 1gvl s GLN 156 Ca 0.38 0.15 0.08 0.00 -1.95 0.00 0.00 55.36 54.01 1gvl s GLN 156 Cb -0.14 -3.49 -0.02 0.00 -0.22 0.00 0.00 33.01 29.14 1gvl s GLN 156 CO 0.12 0.09 -0.23 0.00 -0.25 0.00 0.00 175.29 175.02 1gvl s ALA 158 N -0.72 -0.76 -0.09 0.00 0.00 -0.93 -4.84 121.76 114.43 1gvl s ALA 158 Ca 0.09 0.29 -0.13 0.00 0.00 0.00 0.00 51.96 52.21 1gvl s ALA 158 Cb -0.09 0.09 -0.05 0.00 0.00 0.00 0.00 23.12 23.07 1gvl s ALA 158 CO 0.01 -0.26 0.31 0.71 0.00 0.00 0.00 175.76 176.53 1gvl s TYR 159 N -1.39 3.59 0.20 0.00 2.02 -1.26 -1.01 117.35 119.50 1gvl s TYR 159 Ca -0.13 0.75 -0.10 0.00 -0.37 0.00 0.00 57.07 57.21 1gvl s TYR 159 Cb -0.05 -2.25 -0.01 0.00 -0.40 0.00 0.00 41.96 39.25 1gvl s TYR 159 CO 0.04 0.49 0.35 0.96 -1.57 0.00 0.00 175.55 175.81 1gvl s ILE 160 N -0.40 0.04 0.04 2.71 -4.36 -0.65 -4.43 121.20 114.15 1gvl s ILE 160 Ca 0.19 -1.41 0.09 0.00 -0.26 0.00 0.00 60.65 59.26 1gvl s ILE 160 Cb -0.14 -2.00 -0.03 0.00 1.25 0.00 0.00 42.46 41.54 1gvl s ILE 160 CO 0.08 -0.16 -0.25 -1.00 0.24 0.00 0.00 174.94 173.85 1gvl s HIS 161 N -4.00 2.18 0.53 1.37 3.76 -0.42 -0.51 115.29 118.20 1gvl s HIS 161 Ca 0.20 -0.40 -0.22 0.00 -0.15 0.00 0.00 55.06 54.49 1gvl s HIS 161 Cb 0.02 -1.31 -0.05 0.00 1.11 0.00 0.00 32.58 32.35 1gvl s HIS 161 CO 0.04 0.11 1.33 -0.51 -0.85 0.00 0.00 174.74 174.87 1gvl s LEU 162 N -1.21 3.88 -0.02 0.89 1.43 -0.35 -0.85 118.68 122.46 1gvl s LEU 162 Ca 0.11 2.71 0.06 0.00 -1.03 0.00 0.00 54.13 55.98 1gvl s LEU 162 Cb -0.10 -4.26 -0.02 0.00 0.03 0.00 0.00 46.19 41.84 1gvl s LEU 162 CO 0.02 -1.47 -0.20 -0.69 0.23 0.00 0.00 176.35 174.24 1gvl s VAL 163 N -1.33 2.56 0.68 -1.59 1.01 -0.39 -4.85 120.40 116.49 1gvl s VAL 163 Ca 0.70 -1.00 -0.17 0.00 0.00 0.00 0.00 61.98 61.51 1gvl s VAL 163 Cb -0.39 -1.98 -0.00 0.00 0.00 0.00 0.00 36.38 34.01 1gvl s VAL 163 CO 0.46 0.53 1.08 -1.54 0.00 0.00 0.00 175.10 175.63 1gvl n SER 164 N 2.19 1.03 -0.23 3.32 3.41 -1.26 -4.39 113.62 117.68 1gvl n SER 164 Ca -0.17 0.73 -0.04 0.00 -0.26 0.00 0.00 58.87 59.14 1gvl n SER 164 Cb 0.52 -1.45 0.07 0.00 -0.26 0.00 0.00 64.21 63.08 1gvl n SER 164 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1gvl h ARG 165 N 0.06 0.76 -0.71 4.33 2.43 -1.99 0.45 114.38 119.72 1gvl h ARG 165 Ca -0.49 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 58.64 1gvl h ARG 165 Cb 1.34 -0.17 -0.03 0.00 -0.42 0.00 0.00 29.97 30.68 1gvl h ARG 165 CO 0.49 0.50 0.45 1.05 -1.51 0.00 0.00 179.97 180.95 1gvl h GLU 166 N 0.78 0.95 -0.68 0.20 4.11 -1.99 0.36 114.58 118.32 1gvl h GLU 166 Ca 0.26 -0.07 -0.07 0.00 0.07 0.00 0.00 59.36 59.55 1gvl h GLU 166 Cb 0.03 -0.21 -0.03 0.00 0.50 0.00 0.00 28.75 29.05 1gvl h GLU 166 CO -0.11 0.65 0.15 0.93 0.07 0.00 0.00 179.01 180.70 1gvl h GLU 167 N 0.97 1.08 -0.11 1.06 5.08 -1.74 -2.04 114.58 118.89 1gvl h GLU 167 Ca 0.26 -0.26 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1gvl h GLU 167 Cb -0.07 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.03 1gvl h GLU 167 CO -0.05 0.97 0.07 0.00 -1.00 0.00 0.00 179.01 178.99 1gvl h GLU 169 N 0.13 0.23 -0.06 0.00 5.08 -0.84 -2.05 114.58 117.06 1gvl h GLU 169 Ca 0.04 -0.05 -0.15 0.00 -1.00 0.00 0.00 59.36 58.19 1gvl h GLU 169 Cb 0.01 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 1gvl h GLU 169 CO -0.01 0.37 -0.64 1.25 -1.00 0.00 0.00 179.01 178.98 1gvl h HIS 170 N 0.22 0.33 -0.00 4.33 2.76 -0.98 -2.34 115.15 119.46 1gvl h HIS 170 Ca 0.04 -0.13 -0.20 0.00 -2.20 0.00 0.00 60.37 57.88 1gvl h HIS 170 Cb 0.38 -0.06 -0.01 0.00 1.55 0.00 0.00 27.41 29.28 1gvl h HIS 170 CO 0.01 0.82 -0.87 0.00 -1.30 0.00 0.00 177.93 176.59 1gvl h ALA 171 N 1.14 0.51 -2.16 5.26 0.00 -1.02 -3.37 119.26 119.63 1gvl h ALA 171 Ca -0.01 -0.71 -0.58 0.00 0.00 0.00 0.00 54.91 53.61 1gvl h ALA 171 Cb 1.17 -0.06 -0.41 0.00 0.00 0.00 0.00 17.79 18.49 1gvl h ALA 171 CO 0.10 0.88 -0.80 0.66 0.00 0.00 0.00 179.25 180.09 1gvl n TYR 172 N -3.69 1.96 -1.67 0.00 4.01 -0.81 -5.03 117.16 111.92 1gvl n TYR 172 Ca -0.04 -3.91 -0.45 0.00 -0.16 0.00 0.00 57.90 53.33 1gvl n TYR 172 Cb 0.80 -0.46 -0.04 0.00 -0.31 0.00 0.00 39.34 39.33 1gvl n TYR 172 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 1gvl n PRO 173 N 1.16 2.22 -0.90 -0.72 -0.02 -0.89 -1.76 135.00 134.09 1gvl n PRO 173 Ca 0.26 0.80 0.00 0.00 -2.02 0.00 0.00 63.50 62.54 1gvl n PRO 173 Cb 0.46 -2.57 0.00 0.00 -0.02 0.00 0.00 33.50 31.36 1gvl n PRO 173 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1gvl n GLY 174 N 3.42 0.53 0.07 -1.23 0.00 -1.26 -4.85 105.19 101.86 1gvl n GLY 174 Ca 0.17 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.21 1gvl n GLY 174 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1gvl n GLN 175 N -1.86 3.67 -3.63 1.61 6.02 -0.72 -4.97 117.38 117.50 1gvl n GLN 175 Ca 0.00 -0.24 -0.38 0.00 -0.01 0.00 0.00 57.00 56.37 1gvl n GLN 175 Cb 0.07 -0.87 -0.11 0.00 1.02 0.00 0.00 30.24 30.35 1gvl n GLN 175 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1gvl s ILE 176 N -1.26 5.04 0.50 5.09 -1.09 -1.25 -5.01 121.20 123.22 1gvl s ILE 176 Ca 0.04 0.06 0.08 0.00 -2.23 0.00 0.00 60.65 58.60 1gvl s ILE 176 Cb 0.05 -3.40 0.04 0.00 -1.58 0.00 0.00 42.46 37.56 1gvl s ILE 176 CO 0.19 0.26 0.62 0.42 -1.23 0.00 0.00 174.94 175.20 1gvl s THR 177 N 1.72 2.44 -0.16 2.92 -4.23 -1.26 -4.99 115.64 112.08 1gvl s THR 177 Ca 0.07 -1.11 0.28 0.00 -1.18 0.00 0.00 61.69 59.76 1gvl s THR 177 Cb -0.16 -2.54 0.31 0.00 1.34 0.00 0.00 72.50 71.44 1gvl s THR 177 CO 0.09 0.00 1.85 -0.61 -0.54 0.00 0.00 174.62 175.41 1gvl h GLN 178 N 0.51 0.00 -0.47 3.99 5.75 -2.03 -2.23 115.11 120.63 1gvl h GLN 178 Ca -0.36 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.14 1gvl h GLN 178 Cb 1.28 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.83 1gvl h GLN 178 CO 0.46 0.00 0.00 0.09 -2.65 0.00 0.00 178.83 176.73 1gvl n ASN 179 N -2.57 2.04 -4.19 -0.69 3.02 -1.26 -4.84 115.26 106.77 1gvl n ASN 179 Ca 0.01 -2.12 -0.15 0.00 -0.03 0.00 0.00 54.58 52.28 1gvl n ASN 179 Cb 0.21 -0.32 -0.11 0.00 -0.61 0.00 0.00 39.78 38.95 1gvl n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1gvl s MET 180 N -1.64 0.88 0.08 3.52 -1.94 -0.84 -0.82 119.30 118.54 1gvl s MET 180 Ca 0.21 -1.16 -0.01 0.00 -1.71 0.00 0.00 55.69 53.02 1gvl s MET 180 Cb 0.13 -0.61 -0.04 0.00 2.01 0.00 0.00 34.83 36.31 1gvl s MET 180 CO 0.11 0.10 -0.01 -0.48 -0.01 0.00 0.00 175.02 174.74 1gvl s LEU 181 N -2.42 2.30 0.12 -0.03 0.05 0.20 -4.72 118.68 114.18 1gvl s LEU 181 Ca 0.06 -1.06 0.09 0.00 0.05 0.00 0.00 54.13 53.27 1gvl s LEU 181 Cb -0.04 0.21 -0.04 0.00 -2.05 0.00 0.00 46.19 44.27 1gvl s LEU 181 CO 0.01 -0.63 -0.20 0.00 -0.55 0.00 0.00 176.35 174.98 1gvl s ALA 183 N -1.16 -1.04 -0.02 0.00 0.00 -0.88 -1.26 121.76 117.41 1gvl s ALA 183 Ca 0.17 0.46 -0.06 0.00 0.00 0.00 0.00 51.96 52.54 1gvl s ALA 183 Cb -0.10 0.19 0.02 0.00 0.00 0.00 0.00 23.12 23.23 1gvl s ALA 183 CO 0.09 -0.37 0.25 0.41 0.00 0.00 0.00 175.76 176.14 1gvl n GLY 184 N 0.85 0.33 3.49 0.00 0.00 -0.03 -0.23 105.19 109.60 1gvl n GLY 184 Ca -0.20 -0.84 -0.13 0.00 0.00 0.00 0.00 46.02 44.85 1gvl n GLY 184 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1gvl s ASP 185 N -1.53 -0.62 0.64 1.61 -1.08 -0.38 -1.30 116.67 114.00 1gvl s ASP 185 Ca 0.06 1.18 0.36 0.00 -0.52 0.00 0.00 52.55 53.63 1gvl s ASP 185 Cb -0.00 1.19 2.00 0.00 -1.46 0.00 0.00 42.92 44.65 1gvl s ASP 185 CO -0.01 -0.20 2.20 1.05 0.52 0.00 0.00 175.17 178.73 1gvl h GLU 186 N 5.35 0.00 0.00 4.34 4.11 -1.87 0.39 114.58 126.90 1gvl h GLU 186 Ca -0.28 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.15 1gvl h GLU 186 Cb 1.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.42 1gvl h GLU 186 CO 0.14 0.00 0.00 1.63 0.07 0.00 0.00 179.01 180.85 1gvl n LYS 187 N -3.34 0.18 -1.78 1.06 4.01 -1.26 -4.86 118.16 112.18 1gvl n LYS 187 Ca -0.02 0.33 0.00 0.00 -0.51 0.00 0.00 58.31 58.11 1gvl n LYS 187 Cb 0.20 -1.80 0.00 0.00 -0.51 0.00 0.00 35.03 32.92 1gvl n LYS 187 CO 0.00 0.00 0.00 0.66 -1.11 0.00 0.00 177.40 176.95 1gvl n TYR 188 N -2.13 0.00 0.00 2.13 0.53 0.14 -4.79 117.16 113.04 1gvl n TYR 188 Ca 0.03 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.91 1gvl n TYR 188 Cb 0.28 -0.76 0.00 0.00 -1.03 0.00 0.00 39.34 37.83 1gvl n TYR 188 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1gvl n GLY 188 N -0.58 1.34 2.67 2.72 0.00 -1.24 -4.77 105.19 105.33 1gvl n GLY 188 Ca 0.00 -0.92 -0.04 0.00 0.00 0.00 0.00 46.02 45.06 1gvl n GLY 188 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1gvl n LYS 188 N 0.00 0.23 -2.91 1.61 0.00 -1.26 -4.29 118.16 111.54 1gvl n LYS 188 Ca 0.00 -0.84 0.00 0.00 0.00 0.00 0.00 58.31 57.47 1gvl n LYS 188 Cb 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 35.03 34.74 1gvl n LYS 188 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 1gvl n ASP 189 N 0.78 0.00 0.00 3.14 -0.08 -1.26 -4.28 116.55 114.85 1gvl n ASP 189 Ca -0.03 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.25 1gvl n ASP 189 Cb 0.74 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.20 1gvl n ASP 189 CO 0.00 0.00 0.00 -0.24 0.12 0.00 0.00 177.20 177.08 1gvl n SER 190 N 0.67 0.00 -3.61 1.67 2.88 -1.26 -5.08 113.62 108.88 1gvl n SER 190 Ca 0.00 0.00 -0.35 0.00 -1.33 0.00 0.00 58.87 57.19 1gvl n SER 190 Cb 0.00 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.44 1gvl n SER 190 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1gvl s GLN 192 N -3.05 2.44 0.00 0.00 2.00 -1.26 -4.74 119.66 115.05 1gvl s GLN 192 Ca 0.38 -0.96 0.00 0.00 -2.00 0.00 0.00 55.36 52.77 1gvl s GLN 192 Cb 0.14 -2.52 0.00 0.00 0.80 0.00 0.00 33.01 31.43 1gvl s GLN 192 CO -0.00 -0.77 0.00 0.41 -0.50 0.00 0.00 175.29 174.43 1gvl n GLY 193 N -2.33 4.27 0.00 2.59 0.00 -1.26 -4.79 105.19 103.67 1gvl n GLY 193 Ca 0.10 -1.46 0.00 0.00 0.00 0.00 0.00 46.02 44.66 1gvl n GLY 193 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1gvl n ASP 194 N 0.00 0.00 -4.94 1.61 5.68 -0.76 -4.47 116.55 113.68 1gvl n ASP 194 Ca 0.00 -0.64 -0.25 0.00 -0.50 0.00 0.00 54.79 53.40 1gvl n ASP 194 Cb 0.00 0.00 0.01 0.00 -1.14 0.00 0.00 41.12 39.99 1gvl n ASP 194 CO 0.00 0.00 0.00 -0.94 -1.33 0.00 0.00 177.20 174.93 1gvl s SER 195 N -1.00 4.71 0.00 -1.12 1.04 -1.26 -4.65 113.70 111.42 1gvl s SER 195 Ca 0.00 -1.19 0.00 0.00 0.48 0.00 0.00 55.95 55.24 1gvl s SER 195 Cb 0.00 0.47 0.00 0.00 0.10 0.00 0.00 66.02 66.59 1gvl s SER 195 CO 0.00 -1.20 0.00 0.61 0.98 0.00 0.00 173.24 173.63 1gvl n GLY 196 N -1.89 2.33 3.97 7.32 0.00 -0.88 -0.57 105.19 115.47 1gvl n GLY 196 Ca 0.02 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.77 1gvl n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1gvl s GLY 197 N -1.91 1.78 0.35 -0.02 0.00 -1.25 -3.51 107.32 102.75 1gvl s GLY 197 Ca 0.00 -1.58 -0.17 0.00 0.00 0.00 0.00 44.72 42.97 1gvl s GLY 197 CO 0.00 -0.87 0.80 2.56 0.00 0.00 0.00 173.10 175.59 1gvl s PRO 198 N -5.55 4.09 -0.23 2.90 0.04 -1.26 -0.98 135.00 134.02 1gvl s PRO 198 Ca 0.72 0.82 -0.04 0.00 0.04 0.00 0.00 61.00 62.54 1gvl s PRO 198 Cb -0.03 -2.39 -0.01 0.00 0.04 0.00 0.00 34.50 32.11 1gvl s PRO 198 CO 0.49 0.12 -0.02 -1.17 0.04 0.00 0.00 177.00 176.46 1gvl s LEU 199 N -2.96 3.06 -0.16 -3.56 2.96 -0.36 -2.42 118.68 115.24 1gvl s LEU 199 Ca 0.56 -0.43 0.01 0.00 -0.22 0.00 0.00 54.13 54.04 1gvl s LEU 199 Cb -0.10 -1.77 0.01 0.00 0.50 0.00 0.00 46.19 44.83 1gvl s LEU 199 CO 0.16 -0.04 -0.18 -0.69 -1.32 0.00 0.00 176.35 174.28 1gvl s VAL 200 N 1.49 2.38 -0.06 1.68 1.01 0.22 -0.42 120.40 126.69 1gvl s VAL 200 Ca 0.05 -0.85 0.01 0.00 0.00 0.00 0.00 61.98 61.18 1gvl s VAL 200 Cb -0.15 -2.00 0.02 0.00 0.00 0.00 0.00 36.38 34.26 1gvl s VAL 200 CO -0.02 0.52 -0.06 0.00 0.00 0.00 0.00 175.10 175.54 1gvl n GLY 202 N 4.31 -0.51 2.44 0.00 0.00 -1.26 -1.84 105.19 108.33 1gvl n GLY 202 Ca -0.20 0.11 -0.16 0.00 0.00 0.00 0.00 46.02 45.77 1gvl n GLY 202 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1gvl n ASP 207 N -2.39 -4.86 -4.33 1.61 8.00 -1.26 -5.00 116.55 108.30 1gvl n ASP 207 Ca -0.10 0.36 -0.24 0.00 0.71 0.00 0.00 54.79 55.52 1gvl n ASP 207 Cb 0.61 -3.75 -0.12 0.00 -0.02 0.00 0.00 41.12 37.84 1gvl n ASP 207 CO 0.00 0.00 0.00 -1.00 -0.39 0.00 0.00 177.20 175.81 1gvl s HIS 208 N -2.59 1.93 -0.20 1.24 3.76 -0.76 -4.62 115.29 114.04 1gvl s HIS 208 Ca 0.00 -0.42 -0.29 0.00 -0.15 0.00 0.00 55.06 54.20 1gvl s HIS 208 Cb 0.00 -1.00 -0.04 0.00 1.11 0.00 0.00 32.58 32.65 1gvl s HIS 208 CO 0.00 0.31 1.77 -1.17 -0.85 0.00 0.00 174.74 174.79 1gvl s LEU 209 N -2.32 3.85 -0.13 0.89 2.96 0.12 -1.54 118.68 122.51 1gvl s LEU 209 Ca 0.13 1.76 0.15 0.00 -0.22 0.00 0.00 54.13 55.94 1gvl s LEU 209 Cb -0.08 -3.53 -0.21 0.00 0.50 0.00 0.00 46.19 42.87 1gvl s LEU 209 CO 0.06 -1.38 0.12 -1.14 -1.32 0.00 0.00 176.35 172.69 1gvl n ARG 210 N 7.89 1.25 -3.88 1.98 3.00 0.44 -1.92 116.66 125.41 1gvl n ARG 210 Ca 0.21 -0.04 -0.08 0.00 -0.00 0.00 0.00 57.85 57.94 1gvl n ARG 210 Cb 0.45 -1.40 -0.02 0.00 0.00 0.00 0.00 32.46 31.49 1gvl n ARG 210 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 1gvl s GLY 211 N -4.74 0.12 -0.00 5.14 0.00 -0.98 -2.91 107.32 103.96 1gvl s GLY 211 Ca -0.07 -0.50 0.06 0.00 0.00 0.00 0.00 44.72 44.20 1gvl s GLY 211 CO 0.66 -0.24 -0.18 1.08 0.00 0.00 0.00 173.10 174.42 1gvl s LEU 212 N -2.97 2.06 -0.03 0.66 1.43 -1.11 -1.22 118.68 117.49 1gvl s LEU 212 Ca 0.14 -0.35 -0.30 0.00 -1.03 0.00 0.00 54.13 52.59 1gvl s LEU 212 Cb -0.05 -0.92 -0.06 0.00 0.03 0.00 0.00 46.19 45.19 1gvl s LEU 212 CO 0.08 0.21 1.74 -0.69 0.23 0.00 0.00 176.35 177.92 1gvl s VAL 213 N -0.49 3.43 0.05 -1.59 1.01 -0.15 -1.32 120.40 121.34 1gvl s VAL 213 Ca 0.07 0.51 -0.01 0.00 0.00 0.00 0.00 61.98 62.55 1gvl s VAL 213 Cb -0.07 -3.33 -0.00 0.00 0.00 0.00 0.00 36.38 32.97 1gvl s VAL 213 CO -0.00 -0.05 -0.02 -0.24 0.00 0.00 0.00 175.10 174.79 1gvl n SER 214 N 7.30 0.72 -1.68 3.32 2.88 -0.17 -2.07 113.62 123.92 1gvl n SER 214 Ca 0.18 0.09 -0.04 0.00 -1.33 0.00 0.00 58.87 57.78 1gvl n SER 214 Cb 0.42 -0.24 0.01 0.00 -0.75 0.00 0.00 64.21 63.65 1gvl n SER 214 CO 0.00 0.00 0.00 -2.67 -1.23 0.00 0.00 175.04 171.14 1gvl n TRP 215 N -3.15 -1.37 -2.02 0.66 4.27 -0.71 -4.96 117.44 110.15 1gvl n TRP 215 Ca -0.01 -0.73 0.00 0.00 -3.89 0.00 0.00 57.50 52.87 1gvl n TRP 215 Cb 0.03 0.32 0.00 0.00 -1.36 0.00 0.00 31.31 30.29 1gvl n TRP 215 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1gvl n GLY 216 N -0.20 0.27 3.48 -1.67 0.00 -1.26 -0.09 105.19 105.71 1gvl n GLY 216 Ca -0.03 -1.37 -0.44 0.00 0.00 0.00 0.00 46.02 44.19 1gvl n GLY 216 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1gvl s ASN 217 N -4.00 7.04 0.29 1.61 2.47 -1.10 -4.89 114.94 116.36 1gvl s ASN 217 Ca 0.00 -2.92 0.11 0.00 0.42 0.00 0.00 52.86 50.47 1gvl s ASN 217 Cb 0.00 -2.43 -0.05 0.00 -1.45 0.00 0.00 41.25 37.32 1gvl s ASN 217 CO 0.00 -0.81 -0.14 0.27 -3.72 0.00 0.00 177.10 172.70 1gvl s ILE 218 N 1.95 2.64 -0.71 -5.21 -4.36 -1.26 -1.84 121.20 112.40 1gvl s ILE 218 Ca 0.44 -2.27 0.26 0.00 -0.26 0.00 0.00 60.65 58.82 1gvl s ILE 218 Cb -0.02 -2.47 0.27 0.00 1.25 0.00 0.00 42.46 41.50 1gvl s ILE 218 CO 0.01 -0.36 1.74 1.55 0.24 0.00 0.00 174.94 178.12 1gvl h PRO 219 N 2.15 0.00 -5.12 0.37 0.13 -1.85 -3.48 132.00 124.19 1gvl h PRO 219 Ca -0.41 0.00 -0.67 0.00 -0.87 0.00 0.00 66.00 64.05 1gvl h PRO 219 Cb 1.26 0.00 -0.32 0.00 0.13 0.00 0.00 31.00 32.07 1gvl h PRO 219 CO 0.62 0.00 -0.81 0.00 -0.23 0.00 0.00 178.00 177.57 1gvl s GLY 221 N 1.07 1.89 0.00 0.00 0.00 -0.77 -4.60 107.32 104.90 1gvl s GLY 221 Ca -0.01 -1.62 0.00 0.00 0.00 0.00 0.00 44.72 43.09 1gvl s GLY 221 CO -0.05 -1.37 0.00 -1.14 0.00 0.00 0.00 173.10 170.55 1gvl n SER 222 N -2.07 0.00 0.10 1.64 3.41 -0.84 -1.25 113.62 114.61 1gvl n SER 222 Ca 0.09 -0.79 -0.16 0.00 -0.26 0.00 0.00 58.87 57.75 1gvl n SER 222 Cb 0.60 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 64.42 1gvl n SER 222 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 1gvl h LYS 222 N 0.00 0.30 0.00 4.33 3.64 -1.87 -3.06 116.57 119.91 1gvl h LYS 222 Ca 0.00 -0.48 0.00 0.00 -1.27 0.00 0.00 60.65 58.90 1gvl h LYS 222 Cb 0.00 0.17 0.00 0.00 -0.41 0.00 0.00 32.23 31.99 1gvl h LYS 222 CO 0.00 1.21 -0.92 -0.85 -2.27 0.00 0.00 179.45 176.62 1gvl n GLU 223 N -3.57 0.09 -3.32 1.90 0.28 -1.26 -4.41 120.64 110.35 1gvl n GLU 223 Ca -0.08 -0.01 -0.25 0.00 -0.16 0.00 0.00 57.16 56.65 1gvl n GLU 223 Cb 1.00 -1.52 -0.08 0.00 1.43 0.00 0.00 31.44 32.26 1gvl n GLU 223 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 1gvl n LYS 224 N -1.63 1.06 -1.32 3.44 4.76 -1.25 -4.78 118.16 118.43 1gvl n LYS 224 Ca 0.04 -3.59 -0.29 0.00 -2.87 0.00 0.00 58.31 51.60 1gvl n LYS 224 Cb 0.36 -1.57 0.16 0.00 -1.84 0.00 0.00 35.03 32.14 1gvl n LYS 224 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 1gvl s PRO 225 N -1.24 0.78 0.47 1.97 0.04 -1.16 -1.99 135.00 133.88 1gvl s PRO 225 Ca 0.35 0.45 -0.16 0.00 0.04 0.00 0.00 61.00 61.69 1gvl s PRO 225 Cb 0.13 -1.78 -0.08 0.00 0.04 0.00 0.00 34.50 32.81 1gvl s PRO 225 CO -0.11 -2.48 0.93 0.20 0.04 0.00 0.00 177.00 175.58 1gvl s GLY 226 N -3.68 2.09 -0.11 0.56 0.00 0.68 -2.72 107.32 104.15 1gvl s GLY 226 Ca 0.64 0.12 0.00 0.00 0.00 0.00 0.00 44.72 45.49 1gvl s GLY 226 CO 0.56 0.38 -0.12 0.14 0.00 0.00 0.00 173.10 174.06 1gvl s VAL 227 N -2.49 3.22 0.02 1.40 1.01 0.87 -2.07 120.40 122.36 1gvl s VAL 227 Ca 0.57 -0.62 0.06 0.00 0.00 0.00 0.00 61.98 61.99 1gvl s VAL 227 Cb -0.10 -2.34 -0.02 0.00 0.00 0.00 0.00 36.38 33.92 1gvl s VAL 227 CO 0.29 0.54 -0.18 -0.31 0.00 0.00 0.00 175.10 175.44 1gvl s TYR 228 N -0.02 1.58 0.26 5.22 2.02 0.01 -1.00 117.35 125.42 1gvl s TYR 228 Ca -0.03 -0.34 -0.31 0.00 -0.37 0.00 0.00 57.07 56.03 1gvl s TYR 228 Cb -0.14 -0.96 -0.11 0.00 -0.40 0.00 0.00 41.96 40.34 1gvl s TYR 228 CO 0.04 0.04 1.62 0.99 -1.57 0.00 0.00 175.55 176.66 1gvl s THR 229 N -0.67 2.13 -1.11 -0.71 2.01 -0.43 -0.62 115.64 116.23 1gvl s THR 229 Ca 0.06 0.10 -0.20 0.00 0.31 0.00 0.00 61.69 61.96 1gvl s THR 229 Cb -0.08 -3.07 0.09 0.00 0.01 0.00 0.00 72.50 69.45 1gvl s THR 229 CO 0.01 0.01 1.47 0.21 -0.69 0.00 0.00 174.62 175.63 1gvl s ASN 230 N 0.72 6.70 0.44 3.53 2.47 0.00 -2.76 114.94 126.04 1gvl s ASN 230 Ca 0.67 -2.06 0.12 0.00 0.42 0.00 0.00 52.86 52.01 1gvl s ASN 230 Cb -0.48 -2.52 1.00 0.00 -1.45 0.00 0.00 41.25 37.81 1gvl s ASN 230 CO 0.42 -1.23 2.02 0.58 -3.72 0.00 0.00 177.10 175.17 1gvl h VAL 231 N 5.98 0.96 -0.02 -5.21 2.07 -1.85 -1.90 116.25 116.29 1gvl h VAL 231 Ca 0.28 -0.14 0.01 0.00 0.82 0.00 0.00 66.70 67.66 1gvl h VAL 231 Cb 0.95 0.51 -0.00 0.00 -1.52 0.00 0.00 31.29 31.24 1gvl h VAL 231 CO 1.35 0.08 0.02 0.00 0.02 0.00 0.00 177.57 179.04 1gvl h ARG 233 N 0.00 0.00 -0.30 0.00 2.47 -1.67 -3.31 114.38 111.57 1gvl h ARG 233 Ca 0.01 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.73 1gvl h ARG 233 Cb 0.06 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.38 1gvl h ARG 233 CO -0.00 0.00 0.00 0.66 0.56 0.00 0.00 179.97 181.19 1gvl n TYR 234 N -3.06 0.39 -0.15 3.04 4.01 -0.20 -4.63 117.16 116.55 1gvl n TYR 234 Ca 0.00 -0.26 -0.01 0.00 -0.16 0.00 0.00 57.90 57.47 1gvl n TYR 234 Cb 0.27 -0.01 0.22 0.00 -0.31 0.00 0.00 39.34 39.51 1gvl n TYR 234 CO 0.00 0.00 0.00 1.79 -0.46 0.00 0.00 176.86 178.19 1gvl h THR 235 N 3.34 1.21 -0.28 -0.72 1.35 -1.65 0.11 112.91 116.27 1gvl h THR 235 Ca 0.00 -0.63 -0.10 0.00 -0.55 0.00 0.00 66.41 65.13 1gvl h THR 235 Cb 0.81 0.47 -0.01 0.00 -1.73 0.00 0.00 68.15 67.69 1gvl h THR 235 CO 0.00 0.25 -0.21 0.78 -0.25 0.00 0.00 175.52 176.09 1gvl h ASN 236 N 0.86 0.67 -0.64 5.36 2.35 -1.89 -0.86 115.58 121.43 1gvl h ASN 236 Ca 0.21 -0.45 -0.07 0.00 -0.55 0.00 0.00 56.30 55.44 1gvl h ASN 236 Cb 0.14 -0.19 -0.03 0.00 0.05 0.00 0.00 38.32 38.29 1gvl h ASN 236 CO -0.02 0.97 0.14 -0.25 -1.65 0.00 0.00 177.43 176.62 1gvl h TRP 237 N 0.37 1.11 -0.27 1.19 7.01 -1.72 -0.32 115.95 123.31 1gvl h TRP 237 Ca 0.05 -0.13 -0.04 0.00 2.11 0.00 0.00 58.89 60.88 1gvl h TRP 237 Cb 0.76 -0.31 -0.01 0.00 -2.10 0.00 0.00 29.16 27.50 1gvl h TRP 237 CO 0.07 0.91 0.02 0.82 -2.79 0.00 0.00 178.44 177.47 1gvl h ILE 238 N 1.00 1.25 -0.32 2.65 2.04 -0.70 -1.41 117.51 122.02 1gvl h ILE 238 Ca 0.21 -0.87 0.00 0.00 1.00 0.00 0.00 64.86 65.20 1gvl h ILE 238 Cb 0.38 1.29 -0.02 0.00 -0.74 0.00 0.00 36.82 37.73 1gvl h ILE 238 CO 0.00 0.28 0.21 -0.61 0.00 0.00 0.00 178.15 178.03 1gvl h GLN 239 N 0.26 0.42 -0.64 2.37 5.75 -0.96 -0.43 115.11 121.88 1gvl h GLN 239 Ca 0.08 -0.03 0.06 0.00 -0.15 0.00 0.00 58.65 58.62 1gvl h GLN 239 Cb 0.39 -0.09 -0.06 0.00 1.07 0.00 0.00 27.48 28.79 1gvl h GLN 239 CO 0.01 0.28 0.34 -0.22 -2.65 0.00 0.00 178.83 176.59 1gvl h LYS 240 N 0.43 0.60 -0.25 1.69 3.64 -0.88 -0.10 116.57 121.70 1gvl h LYS 240 Ca 0.12 -0.04 -0.06 0.00 -1.27 0.00 0.00 60.65 59.40 1gvl h LYS 240 Cb -0.05 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 31.63 1gvl h LYS 240 CO -0.03 0.40 -0.07 1.15 -2.27 0.00 0.00 179.45 178.63 1gvl h THR 241 N 0.62 1.29 -0.45 1.00 2.02 -0.95 -1.42 112.91 115.01 1gvl h THR 241 Ca 0.29 -1.10 -0.14 0.00 0.77 0.00 0.00 66.41 66.23 1gvl h THR 241 Cb 0.20 1.48 -0.01 0.00 -1.74 0.00 0.00 68.15 68.09 1gvl h THR 241 CO -0.19 0.34 -0.26 0.40 0.37 0.00 0.00 175.52 176.18 1gvl h ILE 242 N 0.24 1.27 0.00 3.11 2.04 -0.88 -2.96 117.51 120.33 1gvl h ILE 242 Ca 0.06 -1.43 0.00 0.00 1.00 0.00 0.00 64.86 64.50 1gvl h ILE 242 Cb 0.55 1.19 0.00 0.00 -0.74 0.00 0.00 36.82 37.82 1gvl h ILE 242 CO 0.03 0.49 -0.13 0.00 0.00 0.00 0.00 178.15 178.53 1gvl n GLN 243 N -4.10 0.10 0.00 2.37 1.13 -0.07 -5.10 117.38 111.71 1gvl n GLN 243 Ca -0.00 0.06 0.00 0.00 -1.94 0.00 0.00 57.00 55.12 1gvl n GLN 243 Cb 0.48 -1.60 0.00 0.00 0.11 0.00 0.00 30.24 29.23 1gvl n GLN 243 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62