#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1git s GLU 33 N 0.00 3.43 -0.11 5.56 2.12 -1.26 -1.45 118.70 126.99 1git s GLU 33 Ca 0.00 -0.21 0.02 0.00 0.36 0.00 0.00 54.97 55.14 1git s GLU 33 Cb 0.00 -3.14 0.01 0.00 0.26 0.00 0.00 34.13 31.26 1git s GLU 33 CO 0.00 0.74 -0.16 0.08 -0.54 0.00 0.00 175.26 175.38 1git s VAL 34 N -1.15 1.54 -0.11 3.70 1.01 0.21 -4.91 120.40 120.69 1git s VAL 34 Ca 0.20 -0.67 -0.12 0.00 0.00 0.00 0.00 61.98 61.39 1git s VAL 34 Cb -0.12 -1.40 -0.05 0.00 0.00 0.00 0.00 36.38 34.81 1git s VAL 34 CO 0.10 0.45 0.26 -0.54 0.00 0.00 0.00 175.10 175.37 1git s LYS 35 N 0.90 3.93 -0.06 2.72 -0.14 -1.26 0.06 119.74 125.90 1git s LYS 35 Ca -0.08 0.08 0.01 0.00 -1.36 0.00 0.00 55.97 54.62 1git s LYS 35 Cb -0.15 -3.31 0.02 0.00 -1.68 0.00 0.00 37.83 32.71 1git s LYS 35 CO -0.00 0.51 -0.08 -0.51 -0.76 0.00 0.00 175.35 174.50 1git s LEU 36 N -0.35 1.45 -0.25 3.17 1.43 0.11 -3.15 118.68 121.10 1git s LEU 36 Ca 0.17 -0.22 -0.07 0.00 -1.03 0.00 0.00 54.13 52.97 1git s LEU 36 Cb -0.13 -0.66 -0.03 0.00 0.03 0.00 0.00 46.19 45.39 1git s LEU 36 CO 0.06 -0.02 0.07 -0.22 0.23 0.00 0.00 176.35 176.47 1git s LEU 37 N 0.89 3.47 -0.32 1.79 2.96 -0.88 0.16 118.68 126.75 1git s LEU 37 Ca -0.11 -0.18 -0.18 0.00 -0.22 0.00 0.00 54.13 53.43 1git s LEU 37 Cb -0.15 -1.93 -0.01 0.00 0.50 0.00 0.00 46.19 44.60 1git s LEU 37 CO 0.01 -0.02 0.53 -0.76 -1.32 0.00 0.00 176.35 174.79 1git s LEU 38 N 1.54 4.23 0.40 -0.68 1.43 -0.05 0.52 118.68 126.07 1git s LEU 38 Ca 0.06 0.17 0.08 0.00 -1.03 0.00 0.00 54.13 53.41 1git s LEU 38 Cb -0.15 -2.64 -0.07 0.00 0.03 0.00 0.00 46.19 43.36 1git s LEU 38 CO 0.04 -0.44 0.05 -0.76 0.23 0.00 0.00 176.35 175.47 1git s LEU 39 N 2.42 2.95 0.00 1.79 1.43 0.86 -4.16 118.68 123.96 1git s LEU 39 Ca 0.20 -1.23 0.00 0.00 -1.03 0.00 0.00 54.13 52.08 1git s LEU 39 Cb -0.15 -1.11 0.00 0.00 0.03 0.00 0.00 46.19 44.95 1git s LEU 39 CO 0.12 -0.43 0.00 0.61 0.23 0.00 0.00 176.35 176.88 1git n GLY 40 N -1.03 4.56 3.43 -3.19 0.00 -1.26 -1.14 105.19 106.56 1git n GLY 40 Ca -0.04 -1.33 -0.29 0.00 0.00 0.00 0.00 46.02 44.36 1git n GLY 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1git s ALA 41 N -2.00 -0.40 0.22 4.61 0.00 -1.26 -4.05 121.76 118.88 1git s ALA 41 Ca 0.00 -0.58 -0.30 0.00 0.00 0.00 0.00 51.96 51.08 1git s ALA 41 Cb 0.00 -3.05 -0.09 0.00 0.00 0.00 0.00 23.12 19.98 1git s ALA 41 CO 0.00 -4.11 1.27 0.20 0.00 0.00 0.00 175.76 173.12 1git s GLY 42 N -3.05 2.63 -0.62 0.00 0.00 -1.26 -3.28 107.32 101.74 1git s GLY 42 Ca 0.69 1.08 0.00 0.00 0.00 0.00 0.00 44.72 46.49 1git s GLY 42 CO 0.60 1.96 0.00 1.18 0.00 0.00 0.00 173.10 176.84 1git n GLU 43 N 2.20 -0.50 0.11 2.90 1.02 -1.26 -4.94 120.64 120.16 1git n GLU 43 Ca 0.04 0.48 0.08 0.00 -0.02 0.00 0.00 57.16 57.74 1git n GLU 43 Cb 0.43 -4.32 0.01 0.00 -0.02 0.00 0.00 31.44 27.54 1git n GLU 43 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1git h SER 44 N 0.00 0.00 0.00 1.62 4.64 -1.90 -3.46 113.55 114.45 1git h SER 44 Ca -0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.17 1git h SER 44 Cb 0.85 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.94 1git h SER 44 CO 0.19 0.20 0.00 0.61 -0.87 0.00 0.00 176.83 176.96 1git n GLY 45 N 1.23 0.38 0.18 -0.77 0.00 -1.26 -4.48 105.19 100.46 1git n GLY 45 Ca -0.02 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.96 1git n GLY 45 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1git h LYS 46 N 0.00 -0.01 0.00 1.61 1.57 -1.92 -0.59 116.57 117.23 1git h LYS 46 Ca 0.00 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.77 1git h LYS 46 Cb 0.00 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.31 1git h LYS 46 CO 0.00 -0.00 -0.07 0.66 -0.57 0.00 0.00 179.45 179.46 1git h SER 47 N -0.01 0.00 -0.17 0.86 4.64 -1.97 -2.76 113.55 114.14 1git h SER 47 Ca 0.20 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.32 1git h SER 47 Cb 0.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.41 1git h SER 47 CO -0.44 0.07 -0.66 0.74 -0.87 0.00 0.00 176.83 175.67 1git h THR 48 N 0.00 1.28 -0.63 2.95 2.02 -1.56 -2.44 112.91 114.54 1git h THR 48 Ca -0.00 -1.86 -0.04 0.00 0.77 0.00 0.00 66.41 65.28 1git h THR 48 Cb 0.79 1.81 -0.03 0.00 -1.74 0.00 0.00 68.15 68.98 1git h THR 48 CO 0.01 0.60 0.23 0.40 0.37 0.00 0.00 175.52 177.12 1git h ILE 49 N 0.58 1.24 -0.37 3.11 2.04 -0.98 -1.16 117.51 121.97 1git h ILE 49 Ca -0.02 -0.79 0.05 0.00 1.00 0.00 0.00 64.86 65.10 1git h ILE 49 Cb 1.27 0.57 -0.04 0.00 -0.74 0.00 0.00 36.82 37.87 1git h ILE 49 CO 0.14 0.31 0.11 0.58 0.00 0.00 0.00 178.15 179.28 1git h VAL 50 N 0.89 0.86 -0.79 1.67 2.07 -1.39 -1.76 116.25 117.81 1git h VAL 50 Ca 0.21 -0.09 0.04 0.00 0.82 0.00 0.00 66.70 67.68 1git h VAL 50 Cb 0.25 0.59 -0.05 0.00 -1.52 0.00 0.00 31.29 30.56 1git h VAL 50 CO -0.01 0.05 0.50 0.11 0.02 0.00 0.00 177.57 178.23 1git h LYS 51 N 0.25 0.93 0.00 1.57 1.57 -1.04 -0.40 116.57 119.45 1git h LYS 51 Ca 0.17 -0.06 -0.00 0.00 -1.87 0.00 0.00 60.65 58.89 1git h LYS 51 Cb 0.17 -0.21 -0.00 0.00 0.08 0.00 0.00 32.23 32.27 1git h LYS 51 CO -0.19 0.62 -0.00 1.96 -0.57 0.00 0.00 179.45 181.26 1git h GLN 52 N 0.96 0.00 -0.09 3.15 1.08 -0.42 -1.94 115.11 117.85 1git h GLN 52 Ca 0.32 0.00 -0.23 0.00 -1.45 0.00 0.00 58.65 57.29 1git h GLN 52 Cb 0.04 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 27.49 1git h GLN 52 CO -0.12 0.00 -0.87 0.52 -0.95 0.00 0.00 178.83 177.41 1git h MET 53 N 0.00 0.69 -0.24 1.46 2.86 -0.25 -0.27 114.93 119.19 1git h MET 53 Ca -0.00 -0.63 -0.06 0.00 -2.06 0.00 0.00 59.70 56.95 1git h MET 53 Cb 0.38 0.15 -0.01 0.00 0.06 0.00 0.00 31.60 32.18 1git h MET 53 CO 0.00 1.24 -0.09 -0.22 1.06 0.00 0.00 176.91 178.90 1git h LYS 54 N 0.44 0.48 -0.03 1.72 3.64 -1.24 0.15 116.57 121.73 1git h LYS 54 Ca -0.08 -0.20 -0.00 0.00 -1.27 0.00 0.00 60.65 59.10 1git h LYS 54 Cb 1.50 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 33.30 1git h LYS 54 CO 0.17 0.73 0.01 0.82 -2.27 0.00 0.00 179.45 178.91 1git h ILE 55 N 0.21 1.17 0.19 2.00 2.04 -1.39 -0.93 117.51 120.80 1git h ILE 55 Ca 0.06 -0.50 -0.01 0.00 1.00 0.00 0.00 64.86 65.41 1git h ILE 55 Cb 0.57 1.44 0.00 0.00 -0.74 0.00 0.00 36.82 38.09 1git h ILE 55 CO 0.03 0.13 -0.09 0.40 0.00 0.00 0.00 178.15 178.62 1git h ILE 56 N -0.14 0.73 -0.00 -0.67 2.04 -1.06 -3.40 117.51 115.00 1git h ILE 56 Ca 0.01 -1.06 0.00 0.00 1.00 0.00 0.00 64.86 64.81 1git h ILE 56 Cb 0.21 1.22 0.00 0.00 -0.74 0.00 0.00 36.82 37.51 1git h ILE 56 CO -0.00 0.19 -0.58 1.41 0.00 0.00 0.00 178.15 179.17 1git n HIS 57 N -4.95 0.00 -0.93 1.37 8.25 0.51 -4.99 115.22 114.48 1git n HIS 57 Ca -0.07 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.39 1git n HIS 57 Cb 0.25 -0.10 0.00 0.00 1.12 0.00 0.00 29.99 31.26 1git n HIS 57 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1git n GLU 58 N -1.00 2.65 0.28 -0.41 1.02 -0.38 -4.75 120.64 118.04 1git n GLU 58 Ca 0.07 0.00 -0.11 0.00 -0.02 0.00 0.00 57.16 57.10 1git n GLU 58 Cb 0.36 0.00 -0.05 0.00 -0.02 0.00 0.00 31.44 31.73 1git n GLU 58 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1git h ALA 59 N 1.00 -0.89 0.00 0.62 0.00 -1.87 -3.45 119.26 114.67 1git h ALA 59 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1git h ALA 59 Cb 0.00 0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1git h ALA 59 CO 0.00 -0.84 0.00 0.41 0.00 0.00 0.00 179.25 178.82 1git n GLY 60 N -0.50 1.09 3.62 0.00 0.00 -1.06 -4.85 105.19 103.49 1git n GLY 60 Ca -0.09 -2.22 -0.41 0.00 0.00 0.00 0.00 46.02 43.29 1git n GLY 60 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1git s TYR 61 N -1.25 3.24 0.93 1.61 1.51 -1.26 -4.90 117.35 117.23 1git s TYR 61 Ca 0.00 0.81 -0.15 0.00 -1.01 0.00 0.00 57.07 56.72 1git s TYR 61 Cb 0.00 -3.04 0.18 0.00 -0.11 0.00 0.00 41.96 38.98 1git s TYR 61 CO 0.00 -0.46 1.29 -1.54 -1.11 0.00 0.00 175.55 173.73 1git s SER 62 N 1.54 3.40 0.38 2.29 1.04 -1.26 -4.81 113.70 116.29 1git s SER 62 Ca 0.30 0.35 0.10 0.00 0.48 0.00 0.00 55.95 57.17 1git s SER 62 Cb -0.15 -0.48 0.78 0.00 0.10 0.00 0.00 66.02 66.27 1git s SER 62 CO 0.10 -2.56 1.91 -0.33 0.98 0.00 0.00 173.24 173.34 1git h GLU 63 N -1.51 0.22 -0.01 4.02 5.08 -1.96 0.33 114.58 120.75 1git h GLU 63 Ca -0.44 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 57.86 1git h GLU 63 Cb 1.25 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.47 1git h GLU 63 CO 0.43 0.38 -0.44 0.39 -1.00 0.00 0.00 179.01 178.77 1git n GLU 64 N -4.26 0.89 -0.03 2.33 -0.58 -1.26 -2.91 120.64 114.83 1git n GLU 64 Ca -0.01 -0.66 -0.21 0.00 -0.42 0.00 0.00 57.16 55.87 1git n GLU 64 Cb 0.28 -1.49 -0.13 0.00 -0.57 0.00 0.00 31.44 29.53 1git n GLU 64 CO 0.00 0.00 0.00 1.49 -0.48 0.00 0.00 177.13 178.14 1git h GLU 65 N 1.60 0.16 -0.49 3.49 4.81 -1.67 -3.34 114.58 119.15 1git h GLU 65 Ca 0.00 -0.28 -0.07 0.00 -0.13 0.00 0.00 59.36 58.88 1git h GLU 65 Cb 0.62 0.10 -0.02 0.00 0.63 0.00 0.00 28.75 30.08 1git h GLU 65 CO 0.00 1.13 0.02 0.00 -0.73 0.00 0.00 179.01 179.43 1git h LYS 67 N 0.75 0.00 0.00 0.00 1.57 -1.66 0.24 116.57 117.47 1git h LYS 67 Ca 0.15 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.87 1git h LYS 67 Cb 0.43 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.74 1git h LYS 67 CO 0.02 0.00 -0.27 1.96 -0.57 0.00 0.00 179.45 180.59 1git h GLN 68 N 0.00 0.00 -0.01 3.15 4.20 -1.54 -2.90 115.11 118.01 1git h GLN 68 Ca 0.25 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.96 1git h GLN 68 Cb 1.05 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.83 1git h GLN 68 CO -0.00 0.27 -0.26 0.66 -0.67 0.00 0.00 178.83 178.82 1git n TYR 69 N -3.33 0.00 -0.36 2.96 4.02 0.82 -4.16 117.16 117.10 1git n TYR 69 Ca 0.01 0.00 0.07 0.00 -0.01 0.00 0.00 57.90 57.97 1git n TYR 69 Cb 0.50 -0.12 0.24 0.00 -0.02 0.00 0.00 39.34 39.94 1git n TYR 69 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 176.86 175.63 1git h LYS 70 N 1.23 0.97 -0.44 -0.72 3.64 -1.27 -0.77 116.57 119.21 1git h LYS 70 Ca 0.00 -0.06 -0.10 0.00 -1.27 0.00 0.00 60.65 59.22 1git h LYS 70 Cb 0.51 -0.22 -0.02 0.00 -0.41 0.00 0.00 32.23 32.10 1git h LYS 70 CO 0.00 0.64 -0.12 0.00 -2.27 0.00 0.00 179.45 177.70 1git h ALA 71 N 1.54 0.95 -0.48 5.00 0.00 -1.78 -2.65 119.26 121.84 1git h ALA 71 Ca 0.50 -0.33 -0.11 0.00 0.00 0.00 0.00 54.91 54.97 1git h ALA 71 Cb 0.48 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1git h ALA 71 CO -0.26 0.61 -0.13 0.28 0.00 0.00 0.00 179.25 179.76 1git h VAL 72 N 0.73 1.26 -0.68 0.00 2.07 -1.44 0.38 116.25 118.58 1git h VAL 72 Ca 0.12 -1.24 0.02 0.00 0.82 0.00 0.00 66.70 66.42 1git h VAL 72 Cb 0.62 1.03 -0.04 0.00 -1.52 0.00 0.00 31.29 31.38 1git h VAL 72 CO 0.04 0.43 0.44 0.58 0.02 0.00 0.00 177.57 179.08 1git h VAL 73 N 0.80 1.13 0.12 2.57 2.07 -1.02 0.64 116.25 122.56 1git h VAL 73 Ca 0.13 -0.30 -0.01 0.00 0.82 0.00 0.00 66.70 67.34 1git h VAL 73 Cb 0.65 0.18 0.00 0.00 -1.52 0.00 0.00 31.29 30.60 1git h VAL 73 CO 0.05 0.16 -0.06 1.88 0.02 0.00 0.00 177.57 179.62 1git h TYR 74 N 0.88 -0.15 -0.29 1.57 0.05 -1.11 -0.20 116.97 117.72 1git h TYR 74 Ca 0.26 -0.00 0.04 0.00 0.05 0.00 0.00 58.73 59.08 1git h TYR 74 Cb -0.05 0.05 -0.04 0.00 1.01 0.00 0.00 36.73 37.71 1git h TYR 74 CO -0.03 0.18 0.06 1.03 -1.05 0.00 0.00 178.16 178.35 1git h SER 75 N -0.50 0.02 -0.46 3.88 0.87 -0.70 0.15 113.55 116.82 1git h SER 75 Ca -0.02 0.05 0.09 0.00 -1.23 0.00 0.00 61.79 60.68 1git h SER 75 Cb 0.40 0.06 -0.08 0.00 -0.44 0.00 0.00 62.40 62.34 1git h SER 75 CO 0.03 0.05 -0.02 0.78 -0.53 0.00 0.00 176.83 177.13 1git h ASN 76 N 0.17 -0.24 -0.29 6.23 -0.26 0.44 -0.97 115.58 120.66 1git h ASN 76 Ca 0.14 0.11 -0.15 0.00 -0.56 0.00 0.00 56.30 55.84 1git h ASN 76 Cb 0.14 0.21 -0.00 0.00 -1.06 0.00 0.00 38.32 37.61 1git h ASN 76 CO -0.18 -0.08 -0.38 0.74 -1.06 0.00 0.00 177.43 176.47 1git h THR 77 N 0.09 1.29 -0.15 2.81 2.02 -0.62 -2.61 112.91 115.74 1git h THR 77 Ca 0.23 -1.57 -0.00 0.00 0.77 0.00 0.00 66.41 65.84 1git h THR 77 Cb 0.34 1.60 -0.01 0.00 -1.74 0.00 0.00 68.15 68.35 1git h THR 77 CO -0.40 0.51 0.08 0.40 0.37 0.00 0.00 175.52 176.48 1git h ILE 78 N 0.54 1.10 -0.93 3.11 2.04 -0.37 -2.80 117.51 120.19 1git h ILE 78 Ca 0.04 -0.28 0.01 0.00 1.00 0.00 0.00 64.86 65.62 1git h ILE 78 Cb 0.97 1.02 -0.05 0.00 -0.74 0.00 0.00 36.82 38.03 1git h ILE 78 CO 0.09 0.09 0.62 1.56 0.00 0.00 0.00 178.15 180.51 1git h GLN 79 N 0.13 1.22 0.75 2.37 4.20 -1.21 -2.27 115.11 120.30 1git h GLN 79 Ca 0.05 -0.07 -0.03 0.00 0.06 0.00 0.00 58.65 58.66 1git h GLN 79 Cb 0.08 -0.28 0.00 0.00 0.30 0.00 0.00 27.48 27.59 1git h GLN 79 CO -0.01 0.81 -0.41 0.77 -0.67 0.00 0.00 178.83 179.32 1git h SER 80 N 1.26 -1.02 -0.83 1.46 0.02 -1.27 -1.29 113.55 111.87 1git h SER 80 Ca 0.34 0.05 0.07 0.00 -0.84 0.00 0.00 61.79 61.42 1git h SER 80 Cb -0.14 0.29 -0.06 0.00 0.14 0.00 0.00 62.40 62.63 1git h SER 80 CO -0.08 -0.67 0.50 -0.29 -1.14 0.00 0.00 176.83 175.16 1git h ILE 81 N -1.08 0.99 -0.83 3.27 6.09 -1.41 -1.63 117.51 122.91 1git h ILE 81 Ca -0.10 -0.30 0.03 0.00 -1.37 0.00 0.00 64.86 63.12 1git h ILE 81 Cb 0.85 0.03 -0.05 0.00 0.47 0.00 0.00 36.82 38.12 1git h ILE 81 CO 0.13 0.16 0.53 0.40 -3.07 0.00 0.00 178.15 176.30 1git h ILE 82 N 0.89 1.13 -0.61 2.19 2.04 -1.28 0.11 117.51 121.97 1git h ILE 82 Ca 0.38 -0.36 -0.03 0.00 1.00 0.00 0.00 64.86 65.85 1git h ILE 82 Cb 0.24 -0.00 -0.03 0.00 -0.74 0.00 0.00 36.82 36.29 1git h ILE 82 CO -0.20 0.19 0.27 0.00 0.00 0.00 0.00 178.15 178.41 1git h ALA 83 N 1.35 0.79 0.46 1.87 0.00 -0.28 0.23 119.26 123.68 1git h ALA 83 Ca 0.33 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 1git h ALA 83 Cb 0.01 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.56 1git h ALA 83 CO -0.11 0.38 -0.22 0.82 0.00 0.00 0.00 179.25 180.12 1git h ILE 84 N 0.85 0.45 -1.00 0.00 2.04 -1.05 0.19 117.51 118.99 1git h ILE 84 Ca 0.21 -0.42 0.21 0.00 1.00 0.00 0.00 64.86 65.86 1git h ILE 84 Cb 0.16 0.61 -0.10 0.00 -0.74 0.00 0.00 36.82 36.75 1git h ILE 84 CO -0.02 0.06 0.62 0.40 0.00 0.00 0.00 178.15 179.21 1git h ILE 85 N -0.90 0.65 0.00 -0.67 1.08 -0.66 -0.01 117.51 117.00 1git h ILE 85 Ca -0.06 -0.22 -0.21 0.00 -0.39 0.00 0.00 64.86 63.98 1git h ILE 85 Cb 0.58 -0.06 -0.01 0.00 -3.07 0.00 0.00 36.82 34.27 1git h ILE 85 CO 0.10 0.12 -0.90 0.03 -0.69 0.00 0.00 178.15 176.81 1git h ARG 86 N 0.64 0.29 -0.46 2.37 3.08 -0.35 -3.27 114.38 116.68 1git h ARG 86 Ca 0.58 -0.31 -0.07 0.00 0.07 0.00 0.00 59.98 60.25 1git h ARG 86 Cb 1.07 0.09 -0.02 0.00 0.08 0.00 0.00 29.97 31.19 1git h ARG 86 CO -0.37 1.02 -0.01 0.00 -1.07 0.00 0.00 179.97 179.54 1git h ALA 87 N 0.88 1.13 -0.77 0.04 0.00 0.13 -2.77 119.26 117.89 1git h ALA 87 Ca -0.06 -0.26 0.18 0.00 0.00 0.00 0.00 54.91 54.77 1git h ALA 87 Cb 1.53 -0.19 -0.13 0.00 0.00 0.00 0.00 17.79 19.01 1git h ALA 87 CO 0.15 0.56 0.11 0.52 0.00 0.00 0.00 179.25 180.59 1git h MET 88 N 0.71 0.18 0.24 0.00 2.86 -1.39 0.53 114.93 118.06 1git h MET 88 Ca 0.14 -0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.76 1git h MET 88 Cb 0.44 -0.04 -0.00 0.00 0.06 0.00 0.00 31.60 32.06 1git h MET 88 CO 0.02 0.12 -0.18 0.78 1.06 0.00 0.00 176.91 178.70 1git h GLY 89 N 0.18 -0.78 -0.85 8.32 0.00 -1.62 0.66 103.07 108.97 1git h GLY 89 Ca 0.44 0.34 0.37 0.00 0.00 0.00 0.00 47.33 48.49 1git h GLY 89 CO -0.61 -0.27 0.50 -0.09 0.00 0.00 0.00 176.54 176.07 1git h ARG 90 N -0.41 0.09 -0.10 4.80 2.43 -1.08 1.15 114.38 121.26 1git h ARG 90 Ca -0.03 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 1git h ARG 90 Cb 0.34 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.87 1git h ARG 90 CO 0.01 0.06 0.00 1.28 -1.51 0.00 0.00 179.97 179.81 1git n LEU 91 N -5.22 2.63 -3.63 3.80 4.77 0.17 -4.97 117.00 114.55 1git n LEU 91 Ca 0.35 -0.94 -0.22 0.00 -0.03 0.00 0.00 56.01 55.16 1git n LEU 91 Cb 1.14 -0.05 0.04 0.00 -2.33 0.00 0.00 43.42 42.22 1git n LEU 91 CO 0.03 0.47 -0.05 0.29 -1.33 0.00 0.00 177.39 176.80 1git n LYS 92 N 1.02 -4.05 -4.37 3.23 4.76 0.40 -4.99 118.16 114.15 1git n LYS 92 Ca 0.16 0.63 -0.35 0.00 -2.87 0.00 0.00 58.31 55.89 1git n LYS 92 Cb 0.52 -5.12 -0.10 0.00 -1.84 0.00 0.00 35.03 28.49 1git n LYS 92 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1git s ILE 93 N -3.59 4.21 0.11 -0.18 1.01 0.07 -5.02 121.20 117.81 1git s ILE 93 Ca 0.13 -0.27 0.03 0.00 0.00 0.00 0.00 60.65 60.54 1git s ILE 93 Cb -0.04 -2.79 -0.04 0.00 0.01 0.00 0.00 42.46 39.60 1git s ILE 93 CO 0.81 0.57 0.16 -1.81 0.00 0.00 0.00 174.94 174.67 1git s ASP 94 N -0.53 5.89 0.88 3.58 1.01 -1.26 -4.57 116.67 121.67 1git s ASP 94 Ca 0.09 0.07 -0.12 0.00 0.71 0.00 0.00 52.55 53.30 1git s ASP 94 Cb -0.12 -1.68 0.09 0.00 1.01 0.00 0.00 42.92 42.22 1git s ASP 94 CO 0.02 0.13 0.95 0.49 0.21 0.00 0.00 175.17 176.96 1git n PHE 95 N 0.05 0.32 0.01 4.23 3.72 -1.26 -3.98 117.46 120.55 1git n PHE 95 Ca -0.07 0.36 -0.01 0.00 -0.05 0.00 0.00 57.45 57.68 1git n PHE 95 Cb 0.53 -1.98 -0.00 0.00 -0.94 0.00 0.00 39.48 37.09 1git n PHE 95 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 1git h GLY 96 N -1.40 -0.04 -5.11 1.37 0.00 -1.90 -3.42 103.07 92.56 1git h GLY 96 Ca -0.44 0.02 -0.59 0.00 0.00 0.00 0.00 47.33 46.31 1git h GLY 96 CO 0.41 -0.02 -0.14 -0.35 0.00 0.00 0.00 176.54 176.44 1git s ASP 97 N -2.77 6.82 0.00 0.19 -1.08 -1.26 -4.96 116.67 113.61 1git s ASP 97 Ca -0.01 0.97 0.18 0.00 -0.52 0.00 0.00 52.55 53.18 1git s ASP 97 Cb 0.00 -2.29 0.78 0.00 -1.46 0.00 0.00 42.92 39.95 1git s ASP 97 CO 0.02 0.20 1.57 0.00 0.52 0.00 0.00 175.17 177.47 1git n ALA 98 N 2.46 1.83 0.29 3.66 0.00 -1.26 -2.08 120.51 125.41 1git n ALA 98 Ca -0.11 -0.06 0.17 0.00 0.00 0.00 0.00 53.44 53.44 1git n ALA 98 Cb 0.52 -1.29 0.69 0.00 0.00 0.00 0.00 19.45 19.37 1git n ALA 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1git h ALA 99 N 2.64 1.00 -0.00 0.00 0.00 -1.99 -2.70 119.26 118.21 1git h ALA 99 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 1git h ALA 99 Cb 0.29 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1git h ALA 99 CO 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 179.25 178.85 1git h ARG 100 N 0.00 0.01 -0.94 0.00 2.47 -1.83 -2.87 114.38 111.22 1git h ARG 100 Ca 0.00 -0.00 0.15 0.00 -1.26 0.00 0.00 59.98 58.87 1git h ARG 100 Cb 0.48 -0.00 -0.08 0.00 -1.65 0.00 0.00 29.97 28.72 1git h ARG 100 CO 0.00 0.40 0.60 0.00 0.56 0.00 0.00 179.97 181.53 1git h ALA 101 N 1.60 1.77 -0.26 0.04 0.00 -1.68 0.51 119.26 121.24 1git h ALA 101 Ca -0.00 0.03 -0.16 0.00 0.00 0.00 0.00 54.91 54.78 1git h ALA 101 Cb 0.70 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 1git h ALA 101 CO 0.05 -0.04 -0.48 -0.44 0.00 0.00 0.00 179.25 178.34 1git h ASP 102 N 0.75 0.74 -0.47 0.00 3.32 -1.68 -2.11 116.42 116.96 1git h ASP 102 Ca 0.49 -0.37 -0.10 0.00 0.02 0.00 0.00 57.03 57.07 1git h ASP 102 Cb 0.75 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 40.07 1git h ASP 102 CO -0.25 1.10 -0.09 0.44 -1.72 0.00 0.00 179.24 178.72 1git h ASP 103 N 0.54 0.93 -0.72 6.45 3.32 -0.49 -1.35 116.42 125.10 1git h ASP 103 Ca 0.03 -0.29 0.01 0.00 0.02 0.00 0.00 57.03 56.80 1git h ASP 103 Cb 1.03 -0.25 -0.04 0.00 0.22 0.00 0.00 39.33 40.29 1git h ASP 103 CO 0.10 1.04 0.47 0.00 -1.72 0.00 0.00 179.24 179.13 1git h ALA 104 N 1.05 0.92 -0.51 3.45 0.00 0.13 0.79 119.26 125.09 1git h ALA 104 Ca 0.14 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.93 1git h ALA 104 Cb 0.62 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1git h ALA 104 CO 0.04 0.31 0.02 -0.09 0.00 0.00 0.00 179.25 179.53 1git h ARG 105 N 0.95 0.88 -0.05 0.00 2.43 -1.03 -2.55 114.38 115.01 1git h ARG 105 Ca 0.27 -0.27 -0.03 0.00 -0.81 0.00 0.00 59.98 59.13 1git h ARG 105 Cb -0.08 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.38 1git h ARG 105 CO -0.07 0.90 -0.13 0.37 -1.51 0.00 0.00 179.97 179.53 1git h GLN 106 N 0.75 0.08 -0.53 0.20 5.75 -0.45 -2.12 115.11 118.78 1git h GLN 106 Ca 0.15 -0.01 -0.03 0.00 -0.15 0.00 0.00 58.65 58.61 1git h GLN 106 Cb 0.49 -0.01 -0.02 0.00 1.07 0.00 0.00 27.48 29.01 1git h GLN 106 CO 0.02 0.21 0.23 1.25 -2.65 0.00 0.00 178.83 177.90 1git h LEU 107 N 0.08 0.72 -0.83 -2.39 5.85 -0.44 -2.22 115.31 116.06 1git h LEU 107 Ca 0.02 -0.15 -0.10 0.00 0.84 0.00 0.00 57.88 58.49 1git h LEU 107 Cb 0.28 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.11 1git h LEU 107 CO 0.02 0.67 -0.46 -0.26 -0.34 0.00 0.00 178.44 178.07 1git h PHE 108 N 0.72 0.00 -0.15 1.25 0.04 -1.27 -0.10 116.94 117.43 1git h PHE 108 Ca 0.18 0.00 -0.19 0.00 2.80 0.00 0.00 57.97 60.76 1git h PHE 108 Cb 0.16 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.31 1git h PHE 108 CO 0.00 0.46 -0.68 0.28 -0.60 0.00 0.00 178.31 177.77 1git h VAL 109 N 0.00 1.32 0.18 -0.55 2.07 -1.20 0.52 116.25 118.59 1git h VAL 109 Ca -0.00 -1.96 -0.24 0.00 0.82 0.00 0.00 66.70 65.31 1git h VAL 109 Cb 0.99 1.93 0.03 0.00 -1.52 0.00 0.00 31.29 32.72 1git h VAL 109 CO 0.06 0.61 -1.09 -0.07 0.02 0.00 0.00 177.57 177.10 1git h LEU 110 N 0.44 0.58 -0.10 2.57 3.38 -1.34 -3.26 115.31 117.59 1git h LEU 110 Ca -0.02 -0.94 -0.17 0.00 0.09 0.00 0.00 57.88 56.84 1git h LEU 110 Cb 1.27 -0.19 0.01 0.00 0.09 0.00 0.00 40.66 41.84 1git h LEU 110 CO 0.13 1.52 -0.59 0.00 0.09 0.00 0.00 178.44 179.59 1git h ALA 111 N 0.09 0.21 0.00 1.53 0.00 -1.08 -2.76 119.26 117.26 1git h ALA 111 Ca -0.20 -0.54 0.00 0.00 0.00 0.00 0.00 54.91 54.18 1git h ALA 111 Cb 1.83 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.61 1git h ALA 111 CO 0.18 0.46 0.00 0.41 0.00 0.00 0.00 179.25 180.31 1git n GLY 112 N 0.75 1.59 1.32 0.00 0.00 0.18 -3.63 105.19 105.40 1git n GLY 112 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.94 1git n GLY 112 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1git n ALA 113 N 0.26 3.00 -1.05 4.61 0.00 -1.16 -4.93 120.51 121.24 1git n ALA 113 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.12 1git n ALA 113 Cb 0.33 0.23 0.12 0.00 0.00 0.00 0.00 19.45 20.14 1git n ALA 113 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1git s ALA 114 N -2.00 1.86 -0.11 0.00 0.00 -1.05 -4.95 121.76 115.52 1git s ALA 114 Ca 0.00 0.64 0.12 0.00 0.00 0.00 0.00 51.96 52.72 1git s ALA 114 Cb 0.00 -3.43 -0.18 0.00 0.00 0.00 0.00 23.12 19.52 1git s ALA 114 CO 0.00 -2.24 0.30 0.39 0.00 0.00 0.00 175.76 174.21 1git n GLU 115 N -3.52 0.84 -4.18 0.00 4.71 -1.26 -4.93 120.64 112.30 1git n GLU 115 Ca 0.12 -0.09 -0.16 0.00 -0.01 0.00 0.00 57.16 57.01 1git n GLU 115 Cb 0.52 -1.24 -0.11 0.00 -1.01 0.00 0.00 31.44 29.59 1git n GLU 115 CO 0.00 0.00 0.00 -2.00 0.09 0.00 0.00 177.13 175.22 1git s GLU 116 N -2.70 0.85 -0.30 3.49 2.12 -1.26 -5.09 118.70 115.81 1git s GLU 116 Ca -0.03 -1.07 -0.30 0.00 0.36 0.00 0.00 54.97 53.93 1git s GLU 116 Cb 0.08 -0.70 -0.07 0.00 0.26 0.00 0.00 34.13 33.69 1git s GLU 116 CO 0.49 0.14 2.24 0.41 -0.54 0.00 0.00 175.26 178.00 1git n GLY 117 N 0.90 0.75 0.12 -1.50 0.00 -1.26 -4.92 105.19 99.28 1git n GLY 117 Ca -0.18 0.82 -0.01 0.00 0.00 0.00 0.00 46.02 46.65 1git n GLY 117 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1git n PHE 118 N 11.59 0.02 -3.64 1.61 -1.74 -1.26 -4.61 117.46 119.43 1git n PHE 118 Ca 0.35 -0.09 -0.07 0.00 -0.56 0.00 0.00 57.45 57.08 1git n PHE 118 Cb 0.39 -0.01 -0.07 0.00 1.52 0.00 0.00 39.48 41.31 1git n PHE 118 CO 0.00 0.00 0.00 1.41 -0.56 0.00 0.00 176.76 177.61 1git s MET 119 N -2.06 0.53 0.40 3.97 1.75 -1.26 -4.76 119.30 117.88 1git s MET 119 Ca 0.00 0.79 0.04 0.00 -1.25 0.00 0.00 55.69 55.27 1git s MET 119 Cb 0.00 0.17 -0.03 0.00 2.84 0.00 0.00 34.83 37.82 1git s MET 119 CO 0.00 -0.09 0.12 0.95 -0.65 0.00 0.00 175.02 175.35 1git s THR 120 N 0.97 0.65 -0.01 10.11 -4.23 -1.26 -5.03 115.64 116.83 1git s THR 120 Ca -0.05 -2.00 0.22 0.00 -1.18 0.00 0.00 61.69 58.69 1git s THR 120 Cb -0.04 -2.38 0.22 0.00 1.34 0.00 0.00 72.50 71.64 1git s THR 120 CO -0.12 0.00 1.72 0.00 -0.54 0.00 0.00 174.62 175.68 1git h ALA 121 N 1.80 0.93 0.15 3.99 0.00 -1.99 -1.57 119.26 122.58 1git h ALA 121 Ca -0.36 -0.22 -0.29 0.00 0.00 0.00 0.00 54.91 54.04 1git h ALA 121 Cb 1.27 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 19.03 1git h ALA 121 CO 0.58 0.31 -1.40 1.49 0.00 0.00 0.00 179.25 180.23 1git h GLU 122 N 0.00 0.32 -0.64 0.00 4.81 -2.00 -2.97 114.58 114.10 1git h GLU 122 Ca -0.00 -0.55 -0.03 0.00 -0.13 0.00 0.00 59.36 58.64 1git h GLU 122 Cb 0.91 0.21 -0.03 0.00 0.63 0.00 0.00 28.75 30.47 1git h GLU 122 CO 0.03 1.27 0.27 1.25 -0.73 0.00 0.00 179.01 181.10 1git h LEU 123 N -0.17 0.85 -0.82 1.64 5.85 -1.95 -2.19 115.31 118.52 1git h LEU 123 Ca -0.28 -0.11 -0.03 0.00 0.84 0.00 0.00 57.88 58.30 1git h LEU 123 Cb 1.87 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 42.64 1git h LEU 123 CO 0.13 0.75 0.40 0.00 -0.34 0.00 0.00 178.44 179.39 1git h ALA 124 N 1.37 1.05 -0.30 1.25 0.00 -1.36 -1.87 119.26 119.40 1git h ALA 124 Ca 0.22 -0.15 -0.11 0.00 0.00 0.00 0.00 54.91 54.87 1git h ALA 124 Cb 0.16 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1git h ALA 124 CO -0.02 0.60 -0.24 0.78 0.00 0.00 0.00 179.25 180.37 1git h GLY 125 N 1.15 0.76 0.99 0.00 0.00 -1.28 -0.50 103.07 104.19 1git h GLY 125 Ca 0.28 -0.75 0.00 0.00 0.00 0.00 0.00 47.33 46.87 1git h GLY 125 CO -0.04 0.67 0.03 -2.08 0.00 0.00 0.00 176.54 175.13 1git h VAL 126 N 0.45 1.02 -0.02 4.60 2.07 -1.28 -0.86 116.25 122.22 1git h VAL 126 Ca 0.05 -0.04 -0.00 0.00 0.82 0.00 0.00 66.70 67.54 1git h VAL 126 Cb 0.80 0.96 -0.00 0.00 -1.52 0.00 0.00 31.29 31.53 1git h VAL 126 CO 0.06 0.01 0.01 0.40 0.02 0.00 0.00 177.57 178.08 1git h ILE 127 N 0.05 1.04 0.06 4.57 2.04 -1.34 -1.25 117.51 122.69 1git h ILE 127 Ca 0.02 -0.10 0.02 0.00 1.00 0.00 0.00 64.86 65.80 1git h ILE 127 Cb -0.00 1.07 -0.04 0.00 -0.74 0.00 0.00 36.82 37.11 1git h ILE 127 CO -0.00 0.03 -0.26 0.50 0.00 0.00 0.00 178.15 178.42 1git h LYS 128 N -0.01 -0.41 -0.66 2.37 3.64 -0.95 0.27 116.57 120.82 1git h LYS 128 Ca 0.01 0.03 0.05 0.00 -1.27 0.00 0.00 60.65 59.47 1git h LYS 128 Cb 0.04 0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 31.91 1git h LYS 128 CO -0.00 -0.28 0.43 0.00 -2.27 0.00 0.00 179.45 177.34 1git h ARG 129 N -0.43 0.68 0.15 1.90 3.08 -1.06 0.80 114.38 119.51 1git h ARG 129 Ca 0.04 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.05 1git h ARG 129 Cb 0.48 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 30.38 1git h ARG 129 CO -0.18 0.45 -0.07 -0.07 -1.07 0.00 0.00 179.97 179.03 1git h LEU 130 N 0.70 -0.17 -0.52 3.04 3.38 -0.34 -2.87 115.31 118.53 1git h LEU 130 Ca 0.28 -0.32 0.09 0.00 0.09 0.00 0.00 57.88 58.02 1git h LEU 130 Cb 0.20 0.05 -0.07 0.00 0.09 0.00 0.00 40.66 40.92 1git h LEU 130 CO -0.08 0.26 0.11 -0.25 0.09 0.00 0.00 178.44 178.57 1git h TRP 131 N -0.65 0.18 0.00 1.13 -0.00 0.18 0.30 115.95 117.08 1git h TRP 131 Ca -0.02 0.03 0.00 0.00 -0.00 0.00 0.00 58.89 58.90 1git h TRP 131 Cb 0.48 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 29.64 1git h TRP 131 CO 0.06 -0.01 0.00 1.63 -0.00 0.00 0.00 178.44 180.12 1git n LYS 132 N -5.11 0.09 -2.48 2.65 5.02 0.21 -4.45 118.16 114.09 1git n LYS 132 Ca 0.06 0.51 -0.37 0.00 -2.02 0.00 0.00 58.31 56.48 1git n LYS 132 Cb 0.26 -1.74 -0.04 0.00 -0.02 0.00 0.00 35.03 33.49 1git n LYS 132 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1git s ASP 133 N -3.62 6.79 0.08 4.39 -1.08 0.09 -4.94 116.67 118.38 1git s ASP 133 Ca 0.01 2.14 -0.30 0.00 -0.52 0.00 0.00 52.55 53.87 1git s ASP 133 Cb 0.05 -2.60 -0.16 0.00 -1.46 0.00 0.00 42.92 38.75 1git s ASP 133 CO 0.18 -0.48 1.64 -1.28 0.52 0.00 0.00 175.17 175.76 1git h SER 134 N 2.73 -0.67 -0.77 -0.34 0.87 -1.87 0.34 113.55 113.84 1git h SER 134 Ca -0.48 0.04 0.03 0.00 -1.23 0.00 0.00 61.79 60.15 1git h SER 134 Cb 1.22 0.20 -0.04 0.00 -0.44 0.00 0.00 62.40 63.33 1git h SER 134 CO 0.63 -0.43 0.51 1.23 -0.53 0.00 0.00 176.83 178.24 1git h GLY 135 N -0.69 1.08 0.89 5.77 0.00 -1.82 -0.12 103.07 108.18 1git h GLY 135 Ca -0.05 -0.38 -0.00 0.00 0.00 0.00 0.00 47.33 46.89 1git h GLY 135 CO 0.06 0.33 -0.03 -2.08 0.00 0.00 0.00 176.54 174.83 1git h VAL 136 N 0.96 1.01 -0.87 4.60 2.07 -1.73 -1.24 116.25 121.06 1git h VAL 136 Ca 0.30 -0.25 -0.02 0.00 0.82 0.00 0.00 66.70 67.56 1git h VAL 136 Cb 0.02 1.18 -0.04 0.00 -1.52 0.00 0.00 31.29 30.93 1git h VAL 136 CO -0.09 0.06 0.48 1.56 0.02 0.00 0.00 177.57 179.61 1git h GLN 137 N -0.20 1.21 -0.12 1.57 1.08 -0.45 0.12 115.11 118.33 1git h GLN 137 Ca -0.01 -0.14 0.03 0.00 -1.45 0.00 0.00 58.65 57.08 1git h GLN 137 Cb 0.17 -0.24 -0.03 0.00 -0.05 0.00 0.00 27.48 27.33 1git h GLN 137 CO 0.01 0.88 -0.06 0.00 -0.95 0.00 0.00 178.83 178.72 1git h ALA 138 N 1.31 0.05 -0.36 3.87 0.00 -0.73 0.40 119.26 123.79 1git h ALA 138 Ca 0.31 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.24 1git h ALA 138 Cb 0.02 0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1git h ALA 138 CO -0.05 -0.51 0.12 0.00 0.00 0.00 0.00 179.25 178.81 1git h PHE 140 N 0.51 0.23 0.00 0.00 3.57 0.49 -1.74 116.94 120.00 1git h PHE 140 Ca 0.12 -0.07 0.00 0.00 3.53 0.00 0.00 57.97 61.56 1git h PHE 140 Cb 0.15 -0.05 0.00 0.00 2.79 0.00 0.00 35.95 38.84 1git h PHE 140 CO 0.01 0.62 0.00 0.09 -2.23 0.00 0.00 178.31 176.79 1git n ASN 141 N -3.99 0.44 -1.13 0.41 5.03 0.13 -2.60 115.26 113.55 1git n ASN 141 Ca -0.02 0.58 0.08 0.00 0.87 0.00 0.00 54.58 56.10 1git n ASN 141 Cb 0.51 -0.69 0.29 0.00 -1.02 0.00 0.00 39.78 38.87 1git n ASN 141 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 1git n ARG 142 N -1.96 3.40 -0.39 3.52 1.74 -0.67 -4.75 116.66 117.55 1git n ARG 142 Ca 0.04 -2.85 0.38 0.00 -0.77 0.00 0.00 57.85 54.65 1git n ARG 142 Cb 0.27 -1.89 0.76 0.00 -1.02 0.00 0.00 32.46 30.58 1git n ARG 142 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1git h SER 143 N 2.44 0.00 0.09 0.55 4.64 -1.34 0.12 113.55 120.04 1git h SER 143 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1git h SER 143 Cb 1.50 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.59 1git h SER 143 CO 0.26 0.00 0.00 -2.11 -0.87 0.00 0.00 176.83 174.11 1git n ARG 144 N -4.10 0.28 0.00 4.77 1.85 -1.26 -1.51 116.66 116.69 1git n ARG 144 Ca 0.29 0.08 0.11 0.00 -1.00 0.00 0.00 57.85 57.32 1git n ARG 144 Cb 1.39 -1.50 0.02 0.00 -1.05 0.00 0.00 32.46 31.33 1git n ARG 144 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 177.63 178.01 1git n GLU 145 N -1.12 0.05 -1.82 2.89 1.02 0.42 -4.76 120.64 117.32 1git n GLU 145 Ca 0.07 -0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.21 1git n GLU 145 Cb 0.06 -1.51 0.00 0.00 -0.02 0.00 0.00 31.44 29.97 1git n GLU 145 CO 0.00 0.00 0.00 2.48 1.18 0.00 0.00 177.13 180.79 1git n TYR 146 N -1.57 0.00 -3.73 -0.32 4.11 -0.57 -5.13 117.16 109.96 1git n TYR 146 Ca 0.04 0.00 -0.37 0.00 -0.00 0.00 0.00 57.90 57.57 1git n TYR 146 Cb 0.35 0.00 -0.12 0.00 -0.00 0.00 0.00 39.34 39.57 1git n TYR 146 CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 176.86 176.21 1git s GLN 147 N -1.73 3.28 -0.00 -3.48 -1.52 -1.26 -4.96 119.66 109.99 1git s GLN 147 Ca 0.00 -0.74 0.02 0.00 -1.95 0.00 0.00 55.36 52.69 1git s GLN 147 Cb 0.00 -3.42 -0.01 0.00 -0.22 0.00 0.00 33.01 29.36 1git s GLN 147 CO 0.00 -0.38 -0.07 -1.17 -0.25 0.00 0.00 175.29 173.42 1git s LEU 148 N 1.56 2.03 0.24 2.90 2.96 -1.26 -4.94 118.68 122.16 1git s LEU 148 Ca 0.04 -0.14 -0.30 0.00 -0.22 0.00 0.00 54.13 53.51 1git s LEU 148 Cb -0.17 -0.32 -0.10 0.00 0.50 0.00 0.00 46.19 46.10 1git s LEU 148 CO 0.04 0.06 1.43 0.20 -1.32 0.00 0.00 176.35 176.76 1git s ASN 149 N -0.23 6.67 0.33 3.68 0.01 -1.26 -4.91 114.94 119.23 1git s ASN 149 Ca 0.02 2.64 0.07 0.00 -0.71 0.00 0.00 52.86 54.88 1git s ASN 149 Cb -0.03 -2.62 0.74 0.00 0.41 0.00 0.00 41.25 39.75 1git s ASN 149 CO -0.00 -0.69 1.84 0.44 -1.51 0.00 0.00 177.10 177.18 1git h ASP 150 N 5.08 0.75 0.00 -1.22 3.32 -1.99 -0.69 116.42 121.67 1git h ASP 150 Ca -0.46 0.06 0.00 0.00 0.02 0.00 0.00 57.03 56.65 1git h ASP 150 Cb 1.22 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.68 1git h ASP 150 CO 0.78 0.35 0.00 -1.20 -1.72 0.00 0.00 179.24 177.45 1git n SER 151 N -4.62 0.00 -0.02 6.45 7.64 -1.26 -4.27 113.62 117.54 1git n SER 151 Ca 0.19 -1.32 -0.09 0.00 1.01 0.00 0.00 58.87 58.67 1git n SER 151 Cb 0.48 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.65 1git n SER 151 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1git h ALA 152 N 3.16 0.02 -0.67 -0.43 0.00 -1.49 -2.85 119.26 117.00 1git h ALA 152 Ca 0.00 0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 1git h ALA 152 Cb 0.00 0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 1git h ALA 152 CO 0.00 -0.55 0.24 0.00 0.00 0.00 0.00 179.25 178.94 1git h ALA 153 N 1.01 0.87 -0.07 0.00 0.00 -1.83 -1.28 119.26 117.96 1git h ALA 153 Ca 0.10 -0.19 0.04 0.00 0.00 0.00 0.00 54.91 54.86 1git h ALA 153 Cb 0.26 -0.26 -0.05 0.00 0.00 0.00 0.00 17.79 17.73 1git h ALA 153 CO -0.23 0.51 -0.29 -0.92 0.00 0.00 0.00 179.25 178.32 1git h TYR 154 N 0.95 -0.78 -0.15 0.00 3.20 -1.81 0.50 116.97 118.89 1git h TYR 154 Ca 0.22 0.03 -0.10 0.00 3.14 0.00 0.00 58.73 62.02 1git h TYR 154 Cb 0.25 0.36 0.00 0.00 1.54 0.00 0.00 36.73 38.87 1git h TYR 154 CO 0.02 -0.37 -0.31 1.88 -1.64 0.00 0.00 178.16 177.73 1git h TYR 155 N -0.39 0.60 -0.77 -3.82 0.05 -1.52 -2.96 116.97 108.16 1git h TYR 155 Ca 0.08 -0.22 0.01 0.00 0.05 0.00 0.00 58.73 58.65 1git h TYR 155 Cb 0.51 -0.11 -0.04 0.00 1.01 0.00 0.00 36.73 38.11 1git h TYR 155 CO -0.35 0.94 0.51 -0.07 -1.05 0.00 0.00 178.16 178.14 1git h LEU 156 N 0.09 0.87 -0.49 3.88 3.38 -0.99 -0.31 115.31 121.75 1git h LEU 156 Ca 0.00 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1git h LEU 156 Cb 0.91 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.45 1git h LEU 156 CO 0.07 0.63 0.00 0.78 0.09 0.00 0.00 178.44 180.01 1git h ASN 157 N 1.03 0.00 -0.26 -0.43 2.35 -0.05 -3.03 115.58 115.19 1git h ASN 157 Ca 0.29 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 56.00 1git h ASN 157 Cb -0.09 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.25 1git h ASN 157 CO -0.07 0.00 -0.01 0.47 -1.65 0.00 0.00 177.43 176.18 1git n ASP 158 N -2.60 3.49 -0.18 5.81 9.92 -0.26 -4.70 116.55 128.01 1git n ASP 158 Ca 0.03 -3.18 0.14 0.00 -0.53 0.00 0.00 54.79 51.26 1git n ASP 158 Cb 0.37 -0.56 0.47 0.00 -0.64 0.00 0.00 41.12 40.77 1git n ASP 158 CO 0.00 0.00 0.00 0.25 0.13 0.00 0.00 177.20 177.58 1git h LEU 159 N 1.49 0.45 0.39 0.64 5.85 -1.06 -0.86 115.31 122.21 1git h LEU 159 Ca 0.05 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.79 1git h LEU 159 Cb 1.47 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 42.41 1git h LEU 159 CO 0.25 0.24 -0.33 0.44 -0.34 0.00 0.00 178.44 178.69 1git h ASP 160 N 0.48 -0.87 -0.54 1.25 3.32 -1.86 0.13 116.42 118.34 1git h ASP 160 Ca 0.38 0.07 -0.00 0.00 0.02 0.00 0.00 57.03 57.50 1git h ASP 160 Cb 0.79 0.28 -0.03 0.00 0.22 0.00 0.00 39.33 40.60 1git h ASP 160 CO -0.13 -0.48 0.34 -0.09 -1.72 0.00 0.00 179.24 177.15 1git h ARG 161 N -0.73 0.72 0.00 3.56 2.43 -1.61 -2.79 114.38 115.97 1git h ARG 161 Ca -0.03 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.08 1git h ARG 161 Cb 0.64 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 30.03 1git h ARG 161 CO -0.02 0.51 0.00 0.44 -1.51 0.00 0.00 179.97 179.39 1git n ILE 162 N -4.68 0.56 0.46 1.20 -5.35 -0.45 -3.09 119.36 108.01 1git n ILE 162 Ca 0.03 -0.20 0.13 0.00 -0.27 0.00 0.00 62.75 62.44 1git n ILE 162 Cb 0.04 -0.64 0.34 0.00 -1.74 0.00 0.00 39.64 37.65 1git n ILE 162 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1git h ALA 163 N 2.55 1.00 -1.38 -1.28 0.00 -0.44 -3.45 119.26 116.25 1git h ALA 163 Ca 0.00 0.00 -0.64 0.00 0.00 0.00 0.00 54.91 54.27 1git h ALA 163 Cb 0.67 0.00 0.14 0.00 0.00 0.00 0.00 17.79 18.60 1git h ALA 163 CO 0.00 0.00 -0.74 0.94 0.00 0.00 0.00 179.25 179.45 1git n GLN 164 N -2.58 0.02 0.21 0.00 -0.06 -1.18 -4.84 117.38 108.95 1git n GLN 164 Ca 0.05 0.01 0.05 0.00 -2.00 0.00 0.00 57.00 55.10 1git n GLN 164 Cb 0.44 -1.01 0.49 0.00 -4.06 0.00 0.00 30.24 26.10 1git n GLN 164 CO 0.00 0.00 0.00 -1.00 -0.20 0.00 0.00 177.06 175.86 1git h PRO 165 N 0.65 0.03 -0.72 3.69 0.13 -1.92 -3.03 132.00 130.82 1git h PRO 165 Ca -0.33 -0.01 -0.50 0.00 -0.87 0.00 0.00 66.00 64.30 1git h PRO 165 Cb 1.44 -0.00 -0.42 0.00 0.13 0.00 0.00 31.00 32.14 1git h PRO 165 CO 0.52 0.20 -0.87 0.27 -0.23 0.00 0.00 178.00 177.88 1git n ASN 166 N -4.32 4.31 -4.77 1.44 0.23 -1.26 -5.06 115.26 105.83 1git n ASN 166 Ca -0.02 -3.44 -0.39 0.00 -0.53 0.00 0.00 54.58 50.20 1git n ASN 166 Cb 0.24 -0.37 -0.00 0.00 -2.08 0.00 0.00 39.78 37.57 1git n ASN 166 CO 0.00 0.00 0.00 -0.47 -0.93 0.00 0.00 177.26 175.86 1git s TYR 167 N -3.63 2.80 -0.08 -2.53 5.04 -1.15 -5.03 117.35 112.77 1git s TYR 167 Ca 0.47 1.42 0.00 0.00 -2.44 0.00 0.00 57.07 56.51 1git s TYR 167 Cb 0.39 -3.66 0.02 0.00 0.35 0.00 0.00 41.96 39.07 1git s TYR 167 CO 0.02 -2.09 -0.06 0.42 -1.34 0.00 0.00 175.55 172.50 1git s ILE 168 N -1.28 0.81 0.47 3.14 1.01 -1.26 -5.02 121.20 119.07 1git s ILE 168 Ca 0.58 -0.20 -0.24 0.00 0.00 0.00 0.00 60.65 60.78 1git s ILE 168 Cb -0.38 -0.84 -0.08 0.00 0.01 0.00 0.00 42.46 41.17 1git s ILE 168 CO 0.48 0.32 1.36 -2.65 0.00 0.00 0.00 174.94 174.45 1git n PRO 169 N 4.62 2.01 -2.21 2.79 -0.02 -1.26 -5.00 135.00 135.94 1git n PRO 169 Ca -0.15 0.72 -0.27 0.00 -2.02 0.00 0.00 63.50 61.78 1git n PRO 169 Cb 0.50 -2.54 0.13 0.00 -0.02 0.00 0.00 33.50 31.57 1git n PRO 169 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1git s THR 170 N -1.22 2.12 0.21 3.45 -4.23 -1.26 -4.75 115.64 109.95 1git s THR 170 Ca 0.64 -0.26 -0.08 0.00 -1.18 0.00 0.00 61.69 60.81 1git s THR 170 Cb -0.46 -2.86 0.15 0.00 1.34 0.00 0.00 72.50 70.68 1git s THR 170 CO 0.56 0.00 1.79 1.56 -0.54 0.00 0.00 174.62 177.98 1git h GLN 171 N -0.99 1.16 -0.25 3.99 4.20 -1.95 -2.06 115.11 119.21 1git h GLN 171 Ca -0.42 -0.19 -0.06 0.00 0.06 0.00 0.00 58.65 58.04 1git h GLN 171 Cb 1.27 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 28.84 1git h GLN 171 CO 0.46 0.92 -0.12 0.37 -0.67 0.00 0.00 178.83 179.79 1git h GLN 172 N 1.13 0.40 -0.35 1.46 5.75 -1.94 -1.31 115.11 120.25 1git h GLN 172 Ca 0.27 -0.11 -0.09 0.00 -0.15 0.00 0.00 58.65 58.57 1git h GLN 172 Cb 0.17 -0.05 -0.02 0.00 1.07 0.00 0.00 27.48 28.66 1git h GLN 172 CO -0.03 0.53 -0.14 -0.44 -2.65 0.00 0.00 178.83 176.10 1git h ASP 173 N 0.38 0.62 -0.30 -0.69 3.32 -1.75 -0.29 116.42 117.71 1git h ASP 173 Ca 0.07 -0.18 -0.09 0.00 0.02 0.00 0.00 57.03 56.85 1git h ASP 173 Cb 0.44 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.81 1git h ASP 173 CO 0.02 0.79 -0.18 0.58 -1.72 0.00 0.00 179.24 178.73 1git h VAL 174 N 0.57 1.30 -0.06 -1.35 2.07 -0.86 -2.76 116.25 115.16 1git h VAL 174 Ca 0.10 -1.30 -0.04 0.00 0.82 0.00 0.00 66.70 66.28 1git h VAL 174 Cb 0.57 1.49 -0.01 0.00 -1.52 0.00 0.00 31.29 31.82 1git h VAL 174 CO 0.04 0.42 -0.16 -0.07 0.02 0.00 0.00 177.57 177.81 1git h LEU 175 N 0.40 0.08 -0.02 2.57 3.38 -0.94 -1.74 115.31 119.05 1git h LEU 175 Ca 0.06 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1git h LEU 175 Cb 0.71 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.44 1git h LEU 175 CO 0.05 0.26 0.00 0.54 0.09 0.00 0.00 178.44 179.38 1git n ARG 176 N -4.30 0.12 -0.93 1.13 5.12 -0.15 -4.90 116.66 112.75 1git n ARG 176 Ca -0.02 0.11 -0.29 0.00 -1.93 0.00 0.00 57.85 55.72 1git n ARG 176 Cb 0.26 -1.64 0.18 0.00 -1.16 0.00 0.00 32.46 30.09 1git n ARG 176 CO 0.00 0.00 0.00 0.95 -1.93 0.00 0.00 177.63 176.65 1git s THR 177 N -3.05 2.30 -0.24 0.55 -4.23 -0.66 -4.71 115.64 105.60 1git s THR 177 Ca 0.12 0.10 -0.01 0.00 -1.18 0.00 0.00 61.69 60.71 1git s THR 177 Cb 0.16 -2.39 0.07 0.00 1.34 0.00 0.00 72.50 71.68 1git s THR 177 CO 0.55 -0.13 0.04 -0.60 -0.54 0.00 0.00 174.62 173.94 1git s ARG 178 N -4.75 0.86 -0.11 3.99 6.06 -1.26 -5.03 118.95 118.70 1git s ARG 178 Ca 0.66 -0.75 0.01 0.00 -2.50 0.00 0.00 55.73 53.15 1git s ARG 178 Cb -0.21 -2.17 0.02 0.00 0.06 0.00 0.00 34.95 32.65 1git s ARG 178 CO 0.59 -0.75 -0.13 0.08 -2.50 0.00 0.00 175.30 172.59 1git s VAL 179 N 1.69 1.38 0.20 7.11 1.01 -1.26 -4.98 120.40 125.55 1git s VAL 179 Ca 0.02 -0.56 -0.30 0.00 0.00 0.00 0.00 61.98 61.14 1git s VAL 179 Cb -0.17 -1.29 -0.08 0.00 0.00 0.00 0.00 36.38 34.84 1git s VAL 179 CO -0.13 0.42 1.01 -0.75 0.00 0.00 0.00 175.10 175.64 1git s LYS 180 N 1.16 4.73 -0.35 2.72 2.20 -1.26 -5.01 119.74 123.93 1git s LYS 180 Ca -0.03 1.58 -0.26 0.00 -0.36 0.00 0.00 55.97 56.89 1git s LYS 180 Cb -0.14 -3.29 0.01 0.00 -1.51 0.00 0.00 37.83 32.90 1git s LYS 180 CO -0.04 0.29 0.93 0.95 -0.36 0.00 0.00 175.35 177.13 1git s THR 181 N -0.66 4.60 -0.06 3.43 -4.23 -1.26 -4.93 115.64 112.53 1git s THR 181 Ca 0.45 1.30 -0.03 0.00 -1.18 0.00 0.00 61.69 62.23 1git s THR 181 Cb -0.27 -4.32 -0.01 0.00 1.34 0.00 0.00 72.50 69.24 1git s THR 181 CO 0.33 -0.48 -0.06 0.74 -0.54 0.00 0.00 174.62 174.61 1git h THR 182 N 5.77 0.00 -3.27 3.99 2.02 -1.96 -3.47 112.91 116.00 1git h THR 182 Ca -0.23 -0.48 -0.28 0.00 0.77 0.00 0.00 66.41 66.19 1git h THR 182 Cb 1.08 0.00 0.11 0.00 -1.74 0.00 0.00 68.15 67.60 1git h THR 182 CO 0.98 0.00 0.27 0.61 0.37 0.00 0.00 175.52 177.75 1git n GLY 183 N 1.75 -1.31 3.63 2.16 0.00 -1.26 -4.97 105.19 105.19 1git n GLY 183 Ca -0.02 -1.71 -0.40 0.00 0.00 0.00 0.00 46.02 43.89 1git n GLY 183 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1git s ILE 184 N -2.89 5.02 0.14 -0.61 1.01 -1.26 -4.73 121.20 117.88 1git s ILE 184 Ca 0.50 1.08 -0.08 0.00 0.00 0.00 0.00 60.65 62.15 1git s ILE 184 Cb -0.01 -3.91 -0.06 0.00 0.01 0.00 0.00 42.46 38.49 1git s ILE 184 CO 0.35 0.06 0.42 -0.69 0.00 0.00 0.00 174.94 175.09 1git s VAL 185 N 2.31 5.09 0.02 2.92 1.01 0.00 -4.92 120.40 126.83 1git s VAL 185 Ca 0.25 0.28 0.01 0.00 0.00 0.00 0.00 61.98 62.52 1git s VAL 185 Cb -0.16 -3.63 -0.02 0.00 0.00 0.00 0.00 36.38 32.58 1git s VAL 185 CO 0.09 0.10 -0.04 -1.61 0.00 0.00 0.00 175.10 173.64 1git s GLU 186 N -2.44 0.33 -0.04 2.72 2.02 -1.25 -0.27 118.70 119.76 1git s GLU 186 Ca 0.40 -0.53 -0.02 0.00 0.02 0.00 0.00 54.97 54.84 1git s GLU 186 Cb -0.13 -0.04 0.03 0.00 0.10 0.00 0.00 34.13 34.09 1git s GLU 186 CO 0.22 -0.01 0.09 0.99 0.02 0.00 0.00 175.26 176.57 1git s THR 187 N -1.14 -0.03 -0.13 3.63 2.01 0.41 -4.94 115.64 115.45 1git s THR 187 Ca -0.11 0.13 -0.02 0.00 0.31 0.00 0.00 61.69 62.00 1git s THR 187 Cb -0.08 -0.16 -0.02 0.00 0.01 0.00 0.00 72.50 72.25 1git s THR 187 CO -0.00 0.05 -0.07 -1.00 -0.69 0.00 0.00 174.62 172.90 1git s HIS 188 N 0.75 2.94 0.03 4.92 3.76 -1.25 0.09 115.29 126.52 1git s HIS 188 Ca -0.06 -0.37 -0.22 0.00 -0.15 0.00 0.00 55.06 54.26 1git s HIS 188 Cb -0.08 -1.88 0.05 0.00 1.11 0.00 0.00 32.58 31.78 1git s HIS 188 CO -0.03 -0.05 0.51 -0.59 -0.85 0.00 0.00 174.74 173.73 1git s PHE 189 N 0.19 -0.41 0.06 1.40 -0.71 -0.80 -4.99 117.98 112.73 1git s PHE 189 Ca -0.04 0.51 0.04 0.00 -1.04 0.00 0.00 56.93 56.40 1git s PHE 189 Cb -0.14 0.31 -0.04 0.00 -1.21 0.00 0.00 43.02 41.94 1git s PHE 189 CO 0.04 -0.60 0.00 0.99 -1.34 0.00 0.00 175.22 174.31 1git s THR 190 N -2.15 4.06 -0.30 -4.49 2.01 -1.26 0.52 115.64 114.03 1git s THR 190 Ca -0.07 -0.88 0.02 0.00 0.31 0.00 0.00 61.69 61.07 1git s THR 190 Cb -0.01 -2.90 0.19 0.00 0.01 0.00 0.00 72.50 69.80 1git s THR 190 CO 0.01 0.19 0.61 0.12 -0.69 0.00 0.00 174.62 174.86 1git s PHE 191 N -1.25 -1.69 -0.55 4.92 5.36 0.63 -4.93 117.98 120.46 1git s PHE 191 Ca 0.24 1.36 -0.02 0.00 -0.96 0.00 0.00 56.93 57.55 1git s PHE 191 Cb -0.12 0.43 0.00 0.00 -0.34 0.00 0.00 43.02 43.00 1git s PHE 191 CO 0.16 -0.96 0.48 1.63 -1.46 0.00 0.00 175.22 175.07 1git n LYS 192 N 5.42 -3.20 -1.95 10.12 5.02 -1.26 -3.01 118.16 129.30 1git n LYS 192 Ca 0.02 0.36 -0.18 0.00 -2.02 0.00 0.00 58.31 56.49 1git n LYS 192 Cb 0.53 -3.94 -0.04 0.00 -0.02 0.00 0.00 35.03 31.55 1git n LYS 192 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1git n ASP 193 N -0.95 -4.95 -4.30 4.39 8.00 -1.26 -4.96 116.55 112.51 1git n ASP 193 Ca -0.04 0.26 -0.32 0.00 0.71 0.00 0.00 54.79 55.39 1git n ASP 193 Cb 0.54 -4.29 -0.16 0.00 -0.02 0.00 0.00 41.12 37.19 1git n ASP 193 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1git s LEU 194 N -5.10 2.30 -0.23 0.64 1.43 -1.16 -4.17 118.68 112.38 1git s LEU 194 Ca 0.00 -0.45 -0.09 0.00 -1.03 0.00 0.00 54.13 52.56 1git s LEU 194 Cb 0.00 -1.46 -0.04 0.00 0.03 0.00 0.00 46.19 44.72 1git s LEU 194 CO 0.00 0.21 0.12 -2.28 0.23 0.00 0.00 176.35 174.63 1git s HIS 195 N 0.07 3.22 -0.01 0.29 5.65 -0.53 -0.27 115.29 123.71 1git s HIS 195 Ca -0.09 0.01 -0.02 0.00 0.25 0.00 0.00 55.06 55.21 1git s HIS 195 Cb -0.15 -2.23 -0.04 0.00 -1.18 0.00 0.00 32.58 28.98 1git s HIS 195 CO 0.06 -0.05 0.15 -0.06 -0.65 0.00 0.00 174.74 174.18 1git s PHE 196 N 1.14 3.47 -0.24 3.88 0.40 0.18 0.66 117.98 127.47 1git s PHE 196 Ca 0.06 0.31 -0.01 0.00 -0.60 0.00 0.00 56.93 56.69 1git s PHE 196 Cb -0.14 -1.80 0.07 0.00 0.51 0.00 0.00 43.02 41.66 1git s PHE 196 CO 0.04 0.62 0.04 0.21 0.70 0.00 0.00 175.22 176.83 1git s LYS 197 N -1.89 0.87 -0.17 0.44 2.20 0.11 -1.90 119.74 119.39 1git s LYS 197 Ca 0.26 -0.77 -0.14 0.00 -0.36 0.00 0.00 55.97 54.96 1git s LYS 197 Cb -0.12 -2.17 -0.05 0.00 -1.51 0.00 0.00 37.83 33.98 1git s LYS 197 CO 0.17 -0.76 0.29 1.41 -0.36 0.00 0.00 175.35 176.10 1git s MET 198 N 1.68 4.23 -0.14 4.03 -2.45 0.11 0.10 119.30 126.86 1git s MET 198 Ca 0.02 0.06 -0.01 0.00 -1.25 0.00 0.00 55.69 54.51 1git s MET 198 Cb -0.17 -3.45 -0.02 0.00 1.25 0.00 0.00 34.83 32.44 1git s MET 198 CO -0.14 0.19 -0.12 -0.06 1.05 0.00 0.00 175.02 175.95 1git s PHE 199 N 0.62 2.84 -0.29 4.11 0.08 0.12 -0.44 117.98 125.02 1git s PHE 199 Ca 0.16 -0.64 0.03 0.00 0.12 0.00 0.00 56.93 56.60 1git s PHE 199 Cb -0.13 -1.87 0.08 0.00 -0.57 0.00 0.00 43.02 40.52 1git s PHE 199 CO 0.04 -0.22 -0.03 0.34 -0.10 0.00 0.00 175.22 175.24 1git s ASP 200 N 0.43 4.51 0.00 1.36 2.15 0.63 -0.87 116.67 124.88 1git s ASP 200 Ca -0.09 -1.69 0.24 0.00 0.43 0.00 0.00 52.55 51.44 1git s ASP 200 Cb -0.16 -1.52 0.36 0.00 -0.30 0.00 0.00 42.92 41.29 1git s ASP 200 CO 0.05 -0.28 1.31 1.33 -0.17 0.00 0.00 175.17 177.41 1git n VAL 201 N 4.39 0.00 -0.36 1.11 0.24 -1.26 -0.82 118.33 121.64 1git n VAL 201 Ca -0.06 -0.12 0.04 0.00 -2.04 0.00 0.00 64.34 62.17 1git n VAL 201 Cb 0.42 0.68 -0.02 0.00 -1.47 0.00 0.00 33.84 33.45 1git n VAL 201 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1git n GLY 202 N 1.42 -2.55 0.13 7.63 0.00 -1.26 -4.29 105.19 106.27 1git n GLY 202 Ca 0.09 -1.37 -0.07 0.00 0.00 0.00 0.00 46.02 44.67 1git n GLY 202 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1git h ALA 203 N -0.35 0.21 0.00 4.61 0.00 -1.86 -1.66 119.26 120.21 1git h ALA 203 Ca -0.04 0.10 0.02 0.00 0.00 0.00 0.00 54.91 54.99 1git h ALA 203 Cb 0.34 0.18 -0.06 0.00 0.00 0.00 0.00 17.79 18.25 1git h ALA 203 CO 0.02 -0.44 -0.53 0.37 0.00 0.00 0.00 179.25 178.66 1git h GLN 204 N 0.04 -0.65 0.00 0.00 -0.00 -1.92 -1.50 115.11 111.07 1git h GLN 204 Ca 0.13 0.04 -0.08 0.00 -0.00 0.00 0.00 58.65 58.75 1git h GLN 204 Cb 0.19 0.15 -0.01 0.00 0.00 0.00 0.00 27.48 27.81 1git h GLN 204 CO -0.26 -0.43 -0.36 0.00 0.00 0.00 0.00 178.83 177.77 1git h ARG 205 N -0.68 0.00 -0.53 1.69 3.08 -1.74 -0.96 114.38 115.25 1git h ARG 205 Ca 0.01 0.00 0.08 0.00 0.07 0.00 0.00 59.98 60.14 1git h ARG 205 Cb 0.72 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.74 1git h ARG 205 CO -0.36 0.36 0.36 0.77 -1.07 0.00 0.00 179.97 180.03 1git h SER 206 N 0.00 0.36 0.71 7.04 0.02 -0.57 -2.92 113.55 118.19 1git h SER 206 Ca -0.00 0.00 -0.24 0.00 -0.84 0.00 0.00 61.79 60.71 1git h SER 206 Cb 0.66 -0.07 -0.01 0.00 0.14 0.00 0.00 62.40 63.12 1git h SER 206 CO 0.05 0.23 -1.09 -0.33 -1.14 0.00 0.00 176.83 174.55 1git h GLU 207 N 0.41 0.19 -6.09 3.45 5.08 -0.19 -3.45 114.58 113.99 1git h GLU 207 Ca 0.24 -0.28 -0.54 0.00 -1.00 0.00 0.00 59.36 57.77 1git h GLU 207 Cb 0.40 0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.73 1git h GLU 207 CO -0.06 1.10 1.36 1.03 -1.00 0.00 0.00 179.01 181.44 1git s ARG 208 N -2.81 2.97 0.53 2.33 0.52 -1.08 -4.87 118.95 116.54 1git s ARG 208 Ca -0.02 1.24 0.21 0.00 -0.52 0.00 0.00 55.73 56.64 1git s ARG 208 Cb 0.09 -4.31 1.37 0.00 0.52 0.00 0.00 34.95 32.61 1git s ARG 208 CO 0.85 -2.30 2.08 0.87 0.02 0.00 0.00 175.30 176.83 1git h LYS 209 N 14.45 0.00 0.00 3.54 1.57 -1.87 -2.88 116.57 131.38 1git h LYS 209 Ca -0.31 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.35 1git h LYS 209 Cb 1.18 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.48 1git h LYS 209 CO 1.09 0.00 -0.68 0.87 -0.57 0.00 0.00 179.45 180.16 1git h LYS 210 N 0.00 0.00 -0.71 3.15 1.79 -1.97 -3.40 116.57 115.43 1git h LYS 210 Ca 0.12 0.00 0.14 0.00 -2.18 0.00 0.00 60.65 58.73 1git h LYS 210 Cb 0.50 0.00 -0.10 0.00 -1.58 0.00 0.00 32.23 31.05 1git h LYS 210 CO -0.00 0.84 0.23 2.35 -1.08 0.00 0.00 179.45 181.79 1git h TRP 211 N -1.00 0.38 0.00 -1.35 7.01 -1.92 -1.52 115.95 117.56 1git h TRP 211 Ca -0.18 0.04 0.00 0.00 2.11 0.00 0.00 58.89 60.86 1git h TRP 211 Cb 1.04 -0.06 0.00 0.00 -2.10 0.00 0.00 29.16 28.04 1git h TRP 211 CO 0.12 0.01 0.16 1.51 -2.79 0.00 0.00 178.44 177.45 1git n ILE 212 N -5.07 1.05 0.25 2.65 0.13 -1.09 -1.91 119.36 115.36 1git n ILE 212 Ca 0.13 0.66 0.10 0.00 -1.10 0.00 0.00 62.75 62.53 1git n ILE 212 Cb 0.40 -1.66 0.65 0.00 -0.84 0.00 0.00 39.64 38.20 1git n ILE 212 CO 0.00 0.00 0.00 -0.74 2.80 0.00 0.00 176.55 178.61 1git h HIS 213 N 0.00 0.00 0.00 9.51 2.76 -1.51 -1.74 115.15 124.17 1git h HIS 213 Ca 0.00 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 1git h HIS 213 Cb 0.31 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.27 1git h HIS 213 CO 0.00 0.13 0.00 0.00 -1.30 0.00 0.00 177.93 176.76 1git n PHE 215 N -2.09 1.42 -0.26 0.00 3.72 -0.65 -4.77 117.46 114.81 1git n PHE 215 Ca -0.00 -0.69 0.25 0.00 -0.05 0.00 0.00 57.45 56.96 1git n PHE 215 Cb 0.08 -0.30 0.46 0.00 -0.94 0.00 0.00 39.48 38.78 1git n PHE 215 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 176.76 174.80 1git n GLU 216 N 0.59 -0.05 -1.02 -1.08 2.13 -0.48 -1.59 120.64 119.14 1git n GLU 216 Ca 0.24 1.14 -0.09 0.00 0.66 0.00 0.00 57.16 59.12 1git n GLU 216 Cb 0.92 -2.03 0.27 0.00 0.27 0.00 0.00 31.44 30.87 1git n GLU 216 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1git n GLY 217 N -1.23 3.95 3.76 8.31 0.00 -1.26 -4.55 105.19 114.17 1git n GLY 217 Ca 0.30 -1.04 -0.39 0.00 0.00 0.00 0.00 46.02 44.89 1git n GLY 217 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1git s VAL 218 N -3.07 2.29 0.05 1.61 -7.23 -0.62 -4.92 120.40 108.51 1git s VAL 218 Ca 0.54 0.24 -0.27 0.00 -1.81 0.00 0.00 61.98 60.68 1git s VAL 218 Cb 0.44 -3.13 -0.17 0.00 0.56 0.00 0.00 36.38 34.08 1git s VAL 218 CO 0.12 0.02 1.53 0.74 -0.31 0.00 0.00 175.10 177.19 1git h THR 219 N 1.95 0.70 -3.59 5.32 2.02 -1.88 -3.38 112.91 114.05 1git h THR 219 Ca -0.50 -0.24 -0.17 0.00 0.77 0.00 0.00 66.41 66.27 1git h THR 219 Cb 1.27 0.83 -0.23 0.00 -1.74 0.00 0.00 68.15 68.28 1git h THR 219 CO 0.60 0.05 -0.56 0.00 0.37 0.00 0.00 175.52 175.97 1git s ALA 220 N -5.63 -0.22 -0.14 6.16 0.00 -1.21 -0.74 121.76 119.98 1git s ALA 220 Ca -0.15 -0.08 -0.01 0.00 0.00 0.00 0.00 51.96 51.71 1git s ALA 220 Cb 0.04 0.02 -0.02 0.00 0.00 0.00 0.00 23.12 23.16 1git s ALA 220 CO 0.61 -0.15 -0.09 0.42 0.00 0.00 0.00 175.76 176.55 1git s ILE 221 N -0.94 3.39 -0.34 0.00 1.01 0.65 -2.07 121.20 122.90 1git s ILE 221 Ca -0.10 -0.54 -0.10 0.00 0.00 0.00 0.00 60.65 59.90 1git s ILE 221 Cb -0.06 -2.44 0.01 0.00 0.01 0.00 0.00 42.46 39.98 1git s ILE 221 CO 0.01 0.52 0.17 -0.63 0.00 0.00 0.00 174.94 175.00 1git s ILE 222 N 0.29 4.54 -0.30 2.92 1.01 0.18 -1.24 121.20 128.61 1git s ILE 222 Ca -0.07 -0.64 -0.14 0.00 0.00 0.00 0.00 60.65 59.80 1git s ILE 222 Cb -0.15 -3.41 -0.03 0.00 0.01 0.00 0.00 42.46 38.87 1git s ILE 222 CO 0.04 -0.07 0.31 0.12 0.00 0.00 0.00 174.94 175.35 1git s PHE 223 N 1.58 3.23 -0.03 3.97 2.19 0.14 -0.10 117.98 128.96 1git s PHE 223 Ca 0.03 0.15 -0.11 0.00 0.33 0.00 0.00 56.93 57.33 1git s PHE 223 Cb -0.18 -2.54 -0.05 0.00 -1.31 0.00 0.00 43.02 38.94 1git s PHE 223 CO 0.06 -0.28 0.31 0.00 1.83 0.00 0.00 175.22 177.14 1git s VAL 225 N -1.11 0.61 -0.49 0.00 1.01 0.58 -4.28 120.40 116.73 1git s VAL 225 Ca 0.22 -0.23 -0.22 0.00 0.00 0.00 0.00 61.98 61.75 1git s VAL 225 Cb -0.15 -0.58 0.04 0.00 0.00 0.00 0.00 36.38 35.69 1git s VAL 225 CO 0.11 0.21 0.78 0.00 0.00 0.00 0.00 175.10 176.21 1git s ALA 226 N 0.46 3.28 0.31 5.51 0.00 -1.26 0.21 121.76 130.27 1git s ALA 226 Ca -0.06 -1.22 0.01 0.00 0.00 0.00 0.00 51.96 50.68 1git s ALA 226 Cb -0.10 -3.50 0.51 0.00 0.00 0.00 0.00 23.12 20.03 1git s ALA 226 CO 0.00 -2.05 1.91 -0.07 0.00 0.00 0.00 175.76 175.55 1git h LEU 227 N 10.24 0.73 0.00 0.00 3.38 -1.25 -2.91 115.31 125.50 1git h LEU 227 Ca -0.26 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.63 1git h LEU 227 Cb 1.09 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.65 1git h LEU 227 CO 0.99 0.65 0.00 -1.54 0.09 0.00 0.00 178.44 178.62 1git n SER 228 N -4.34 0.00 0.00 -0.43 3.41 -1.26 -3.05 113.62 107.94 1git n SER 228 Ca 0.05 0.09 0.13 0.00 -0.26 0.00 0.00 58.87 58.87 1git n SER 228 Cb 0.15 -0.32 0.62 0.00 -0.26 0.00 0.00 64.21 64.40 1git n SER 228 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1git n ASP 229 N -1.32 0.00 -0.36 4.04 9.92 -1.10 -4.23 116.55 123.51 1git n ASP 229 Ca 0.08 0.19 0.32 0.00 -0.53 0.00 0.00 54.79 54.86 1git n ASP 229 Cb 0.16 -0.39 0.66 0.00 -0.64 0.00 0.00 41.12 40.92 1git n ASP 229 CO 0.00 0.00 0.00 0.10 0.13 0.00 0.00 177.20 177.43 1git h TYR 230 N 0.00 0.27 -0.77 1.24 -0.00 -1.76 0.15 116.97 116.10 1git h TYR 230 Ca 0.00 0.01 -0.53 0.00 -0.00 0.00 0.00 58.73 58.21 1git h TYR 230 Cb 0.35 -0.08 -0.33 0.00 -0.00 0.00 0.00 36.73 36.67 1git h TYR 230 CO 0.00 -0.00 -0.10 -0.40 -0.00 0.00 0.00 178.16 177.66 1git n ASP 231 N -4.37 5.43 -4.16 0.10 5.75 -1.26 -4.00 116.55 114.04 1git n ASP 231 Ca 0.28 -3.77 -0.14 0.00 -0.01 0.00 0.00 54.79 51.14 1git n ASP 231 Cb 1.19 -0.62 -0.11 0.00 -1.03 0.00 0.00 41.12 40.55 1git n ASP 231 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1git s LEU 232 N -3.62 2.37 0.51 -2.12 1.43 0.51 -4.90 118.68 112.87 1git s LEU 232 Ca 0.55 -0.76 0.04 0.00 -1.03 0.00 0.00 54.13 52.93 1git s LEU 232 Cb 0.44 -0.30 0.01 0.00 0.03 0.00 0.00 46.19 46.38 1git s LEU 232 CO 0.02 -0.24 0.24 0.68 0.23 0.00 0.00 176.35 177.27 1git s VAL 233 N -2.21 1.58 -0.12 -1.59 -7.23 -1.26 -0.17 120.40 109.40 1git s VAL 233 Ca 0.03 -1.69 -0.13 0.00 -1.81 0.00 0.00 61.98 58.37 1git s VAL 233 Cb -0.04 -2.27 -0.05 0.00 0.56 0.00 0.00 36.38 34.58 1git s VAL 233 CO 0.00 0.00 0.31 -0.76 -0.31 0.00 0.00 175.10 174.34 1git s LEU 234 N -4.09 4.32 0.14 1.32 1.43 -0.72 -4.70 118.68 116.37 1git s LEU 234 Ca 0.25 0.62 -0.30 0.00 -1.03 0.00 0.00 54.13 53.67 1git s LEU 234 Cb -0.00 -2.39 -0.08 0.00 0.03 0.00 0.00 46.19 43.75 1git s LEU 234 CO 0.15 0.19 1.51 0.00 0.23 0.00 0.00 176.35 178.42 1git h ALA 235 N 6.01 -0.60 -0.01 4.21 0.00 -1.95 0.20 119.26 127.12 1git h ALA 235 Ca -0.45 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.53 1git h ALA 235 Cb 1.19 1.26 0.00 0.00 0.00 0.00 0.00 17.79 20.24 1git h ALA 235 CO 0.70 -0.94 0.00 -0.85 0.00 0.00 0.00 179.25 178.16 1git n GLU 236 N -5.14 1.06 -2.61 0.00 0.28 -1.26 -3.29 120.64 109.68 1git n GLU 236 Ca -0.00 -0.08 -0.13 0.00 -0.16 0.00 0.00 57.16 56.79 1git n GLU 236 Cb 0.27 -1.35 0.02 0.00 1.43 0.00 0.00 31.44 31.82 1git n GLU 236 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 1git n ASP 237 N -0.76 2.43 -0.20 -1.84 9.92 0.59 -4.99 116.55 121.71 1git n ASP 237 Ca 0.17 -2.92 0.16 0.00 -0.53 0.00 0.00 54.79 51.66 1git n ASP 237 Cb 0.10 -0.50 0.24 0.00 -0.64 0.00 0.00 41.12 40.32 1git n ASP 237 CO 0.00 0.00 0.00 1.21 0.13 0.00 0.00 177.20 178.54 1git n GLU 238 N -0.26 0.00 -0.11 -1.24 4.07 -0.49 0.19 120.64 122.79 1git n GLU 238 Ca 0.18 0.34 0.08 0.00 -0.06 0.00 0.00 57.16 57.70 1git n GLU 238 Cb 0.79 -0.80 0.14 0.00 -0.06 0.00 0.00 31.44 31.50 1git n GLU 238 CO 0.00 0.00 0.00 0.39 -0.06 0.00 0.00 177.13 177.46 1git n GLU 239 N -2.47 1.96 -3.37 5.31 4.71 -1.26 -4.69 120.64 120.83 1git n GLU 239 Ca 0.13 -1.86 -0.43 0.00 -0.01 0.00 0.00 57.16 54.99 1git n GLU 239 Cb 0.62 -1.36 -0.09 0.00 -1.01 0.00 0.00 31.44 29.60 1git n GLU 239 CO 0.00 0.00 0.00 -1.64 0.09 0.00 0.00 177.13 175.58 1git s MET 240 N -1.23 3.03 0.25 3.49 -1.94 0.51 -5.00 119.30 118.40 1git s MET 240 Ca 0.26 -1.02 -0.31 0.00 -1.71 0.00 0.00 55.69 52.92 1git s MET 240 Cb 0.16 -4.03 -0.11 0.00 2.01 0.00 0.00 34.83 32.86 1git s MET 240 CO 0.22 -0.91 1.59 1.21 -0.01 0.00 0.00 175.02 177.13 1git s ASN 241 N 2.07 6.45 0.19 3.03 3.84 -1.26 -1.76 114.94 127.50 1git s ASN 241 Ca 0.08 2.84 -0.04 0.00 0.21 0.00 0.00 52.86 55.95 1git s ASN 241 Cb -0.20 -2.62 0.12 0.00 -0.55 0.00 0.00 41.25 38.01 1git s ASN 241 CO 0.10 -0.88 1.53 0.03 -2.79 0.00 0.00 177.10 175.09 1git h ARG 242 N 5.57 0.63 -0.81 0.43 3.08 -0.76 -2.64 114.38 119.88 1git h ARG 242 Ca -0.45 -0.35 -0.01 0.00 0.07 0.00 0.00 59.98 59.23 1git h ARG 242 Cb 1.21 0.02 -0.04 0.00 0.08 0.00 0.00 29.97 31.25 1git h ARG 242 CO 0.84 0.96 0.45 1.98 -1.07 0.00 0.00 179.97 183.14 1git h MET 243 N 0.50 1.13 -0.07 0.04 4.05 -1.79 -0.89 114.93 117.89 1git h MET 243 Ca 0.03 -0.12 -0.19 0.00 -0.28 0.00 0.00 59.70 59.14 1git h MET 243 Cb 1.00 -0.23 -0.00 0.00 -0.80 0.00 0.00 31.60 31.57 1git h MET 243 CO 0.09 0.82 -0.75 0.45 0.23 0.00 0.00 176.91 177.75 1git h HIS 244 N 1.13 0.56 -0.51 1.39 3.86 -1.93 -1.76 115.15 117.90 1git h HIS 244 Ca 0.29 -0.25 -0.08 0.00 -1.16 0.00 0.00 60.37 59.16 1git h HIS 244 Cb 0.01 -0.08 -0.02 0.00 1.06 0.00 0.00 27.41 28.38 1git h HIS 244 CO 0.01 1.01 -0.02 1.49 0.86 0.00 0.00 177.93 181.28 1git h GLU 245 N 0.28 0.87 0.00 2.45 4.57 -1.05 -0.76 114.58 120.93 1git h GLU 245 Ca -0.03 -0.25 -0.10 0.00 -1.18 0.00 0.00 59.36 57.79 1git h GLU 245 Cb 1.33 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 29.81 1git h GLU 245 CO 0.13 0.88 -0.50 1.03 -1.18 0.00 0.00 179.01 179.37 1git h SER 246 N 0.80 0.00 0.14 1.04 0.87 -1.06 -2.39 113.55 112.96 1git h SER 246 Ca 0.15 0.00 -0.18 0.00 -1.23 0.00 0.00 61.79 60.53 1git h SER 246 Cb 0.50 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.46 1git h SER 246 CO 0.03 0.50 -0.67 0.24 -0.53 0.00 0.00 176.83 176.39 1git h MET 247 N 0.00 0.49 -0.38 2.24 2.86 -0.64 -0.52 114.93 118.98 1git h MET 247 Ca -0.00 -0.37 -0.09 0.00 -2.06 0.00 0.00 59.70 57.18 1git h MET 247 Cb 0.95 0.07 -0.02 0.00 0.06 0.00 0.00 31.60 32.66 1git h MET 247 CO 0.06 0.99 -0.11 -0.22 1.06 0.00 0.00 176.91 178.69 1git h LYS 248 N 0.35 0.68 -0.02 1.72 3.64 -0.88 -1.64 116.57 120.42 1git h LYS 248 Ca -0.02 -0.21 -0.24 0.00 -1.27 0.00 0.00 60.65 58.91 1git h LYS 248 Cb 1.24 -0.06 0.01 0.00 -0.41 0.00 0.00 32.23 33.00 1git h LYS 248 CO 0.12 0.77 -0.94 1.25 -2.27 0.00 0.00 179.45 178.38 1git h LEU 249 N 0.62 0.71 -0.14 5.20 5.85 -1.28 -2.19 115.31 124.07 1git h LEU 249 Ca 0.11 -0.55 0.00 0.00 0.84 0.00 0.00 57.88 58.28 1git h LEU 249 Cb 0.56 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.36 1git h LEU 249 CO 0.03 1.34 0.09 0.15 -0.34 0.00 0.00 178.44 179.72 1git h PHE 250 N 0.33 0.17 -0.61 1.25 3.57 -0.84 -1.90 116.94 118.90 1git h PHE 250 Ca -0.09 0.00 0.12 0.00 3.53 0.00 0.00 57.97 61.54 1git h PHE 250 Cb 1.58 -0.06 -0.10 0.00 2.79 0.00 0.00 35.95 40.17 1git h PHE 250 CO 0.08 0.11 0.05 0.22 -2.23 0.00 0.00 178.31 176.53 1git h ASP 251 N 0.18 -0.16 0.72 0.41 3.58 -1.29 0.46 116.42 120.32 1git h ASP 251 Ca 0.05 0.14 -0.03 0.00 0.42 0.00 0.00 57.03 57.61 1git h ASP 251 Cb -0.02 0.22 -0.00 0.00 1.72 0.00 0.00 39.33 41.25 1git h ASP 251 CO -0.01 -0.07 -0.46 0.28 -2.88 0.00 0.00 179.24 176.09 1git h SER 252 N 0.17 -1.18 0.37 2.28 0.02 -0.71 -2.36 113.55 112.14 1git h SER 252 Ca 0.32 0.07 -0.02 0.00 -0.84 0.00 0.00 61.79 61.32 1git h SER 252 Cb 0.51 0.35 -0.00 0.00 0.14 0.00 0.00 62.40 63.40 1git h SER 252 CO -0.48 -0.70 -0.20 0.40 -1.14 0.00 0.00 176.83 174.71 1git h ILE 253 N -1.12 0.59 -0.40 3.27 5.03 -1.04 -3.03 117.51 120.81 1git h ILE 253 Ca -0.10 0.00 0.07 0.00 -0.12 0.00 0.00 64.86 64.71 1git h ILE 253 Cb 0.90 0.59 -0.09 0.00 -3.03 0.00 0.00 36.82 35.19 1git h ILE 253 CO 0.09 0.00 -0.43 0.00 -0.68 0.00 0.00 178.15 177.13 1git n ASN 255 N -5.41 5.99 -4.82 0.00 3.02 -0.89 -4.93 115.26 108.21 1git n ASN 255 Ca -0.01 -3.35 -0.37 0.00 -0.03 0.00 0.00 54.58 50.82 1git n ASN 255 Cb 0.35 -0.93 -0.06 0.00 -0.61 0.00 0.00 39.78 38.52 1git n ASN 255 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 1git s ASN 256 N -0.79 6.52 0.44 6.41 3.84 -0.71 -4.99 114.94 125.66 1git s ASN 256 Ca 0.46 0.62 0.11 0.00 0.21 0.00 0.00 52.86 54.26 1git s ASN 256 Cb 0.37 -2.15 0.99 0.00 -0.55 0.00 0.00 41.25 39.91 1git s ASN 256 CO 0.02 0.30 2.04 0.50 -2.79 0.00 0.00 177.10 177.17 1git h LYS 257 N 5.39 0.40 0.00 0.43 1.63 -1.90 -2.36 116.57 120.15 1git h LYS 257 Ca -0.50 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.28 1git h LYS 257 Cb 1.21 -0.09 0.00 0.00 -0.60 0.00 0.00 32.23 32.75 1git h LYS 257 CO 0.64 0.26 0.00 0.91 -3.45 0.00 0.00 179.45 177.82 1git n TRP 258 N -4.48 0.42 -0.66 1.91 8.01 -1.26 -3.10 117.44 118.28 1git n TRP 258 Ca 0.05 0.15 0.07 0.00 -1.31 0.00 0.00 57.50 56.46 1git n TRP 258 Cb 0.19 -0.74 0.17 0.00 -2.01 0.00 0.00 31.31 28.92 1git n TRP 258 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.69 177.87 1git n PHE 259 N -1.87 0.47 -0.32 -5.99 3.72 -0.89 -4.58 117.46 108.00 1git n PHE 259 Ca 0.04 -0.76 0.27 0.00 -0.05 0.00 0.00 57.45 56.95 1git n PHE 259 Cb 0.26 -0.17 0.58 0.00 -0.94 0.00 0.00 39.48 39.21 1git n PHE 259 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 176.76 177.86 1git h THR 260 N 1.16 0.48 -0.30 4.37 2.02 -1.60 0.56 112.91 119.61 1git h THR 260 Ca 0.00 -0.09 0.00 0.00 0.77 0.00 0.00 66.41 67.09 1git h THR 260 Cb 1.03 0.19 0.00 0.00 -1.74 0.00 0.00 68.15 67.63 1git h THR 260 CO 0.08 0.05 0.00 0.47 0.37 0.00 0.00 175.52 176.49 1git n ASP 261 N -4.50 3.63 -4.66 4.18 9.92 -1.26 -4.96 116.55 118.90 1git n ASP 261 Ca 0.25 -2.70 -0.35 0.00 -0.53 0.00 0.00 54.79 51.47 1git n ASP 261 Cb 0.99 -0.45 -0.10 0.00 -0.64 0.00 0.00 41.12 40.92 1git n ASP 261 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 1git s THR 262 N -2.25 4.54 0.01 -3.53 2.01 0.19 -4.87 115.64 111.74 1git s THR 262 Ca 0.37 -0.14 -0.30 0.00 0.31 0.00 0.00 61.69 61.92 1git s THR 262 Cb 0.27 -2.97 -0.04 0.00 0.01 0.00 0.00 72.50 69.77 1git s THR 262 CO 0.11 0.55 1.12 -0.44 -0.69 0.00 0.00 174.62 175.27 1git s SER 263 N -0.32 7.18 -0.34 3.53 0.01 0.08 -4.86 113.70 118.97 1git s SER 263 Ca 0.08 1.84 -0.13 0.00 1.31 0.00 0.00 55.95 59.05 1git s SER 263 Cb -0.12 -2.57 -0.02 0.00 0.21 0.00 0.00 66.02 63.52 1git s SER 263 CO 0.02 -0.42 0.24 -0.63 0.41 0.00 0.00 173.24 172.86 1git s ILE 264 N 1.27 5.27 -0.10 1.44 -1.09 -1.26 -0.25 121.20 126.48 1git s ILE 264 Ca 0.56 -0.24 -0.01 0.00 -2.23 0.00 0.00 60.65 58.73 1git s ILE 264 Cb -0.25 -3.72 -0.03 0.00 -1.58 0.00 0.00 42.46 36.88 1git s ILE 264 CO 0.27 -0.02 -0.05 -0.63 -1.23 0.00 0.00 174.94 173.28 1git s ILE 265 N 1.72 3.80 -0.18 2.92 1.01 -0.37 -2.31 121.20 127.78 1git s ILE 265 Ca 0.06 -0.42 -0.01 0.00 0.00 0.00 0.00 60.65 60.28 1git s ILE 265 Cb -0.17 -2.60 -0.00 0.00 0.01 0.00 0.00 42.46 39.70 1git s ILE 265 CO 0.10 0.56 -0.12 -0.22 0.00 0.00 0.00 174.94 175.26 1git s LEU 266 N -0.35 2.57 -0.49 2.97 2.96 0.23 0.25 118.68 126.81 1git s LEU 266 Ca 0.05 -0.47 -0.12 0.00 -0.22 0.00 0.00 54.13 53.37 1git s LEU 266 Cb -0.12 -1.61 0.12 0.00 0.50 0.00 0.00 46.19 45.07 1git s LEU 266 CO 0.02 0.04 0.40 -0.36 -1.32 0.00 0.00 176.35 175.13 1git s PHE 267 N 1.11 3.34 -1.04 5.38 0.40 0.49 0.61 117.98 128.27 1git s PHE 267 Ca 0.01 -1.56 -0.19 0.00 -0.60 0.00 0.00 56.93 54.58 1git s PHE 267 Cb -0.14 -3.56 0.11 0.00 0.51 0.00 0.00 43.02 39.94 1git s PHE 267 CO -0.04 -0.98 1.33 -0.51 0.70 0.00 0.00 175.22 175.72 1git s LEU 268 N 1.48 4.50 0.59 -0.37 1.43 0.20 -0.31 118.68 126.20 1git s LEU 268 Ca 0.04 -2.08 -0.09 0.00 -1.03 0.00 0.00 54.13 50.97 1git s LEU 268 Cb -0.27 -2.46 -0.03 0.00 0.03 0.00 0.00 46.19 43.45 1git s LEU 268 CO 0.01 -1.14 0.97 0.21 0.23 0.00 0.00 176.35 176.62 1git s ASN 269 N 3.93 6.14 -0.44 2.29 2.47 0.13 -1.73 114.94 127.73 1git s ASN 269 Ca 0.40 1.23 -0.00 0.00 0.42 0.00 0.00 52.86 54.91 1git s ASN 269 Cb -0.02 -2.33 0.00 0.00 -1.45 0.00 0.00 41.25 37.45 1git s ASN 269 CO -0.06 -0.84 0.05 0.29 -3.72 0.00 0.00 177.10 172.81 1git n LYS 270 N -2.64 -0.70 0.08 0.43 5.02 -0.20 -0.79 118.16 119.38 1git n LYS 270 Ca 0.05 0.25 0.18 0.00 -2.02 0.00 0.00 58.31 56.77 1git n LYS 270 Cb 0.55 -3.95 0.72 0.00 -0.02 0.00 0.00 35.03 32.33 1git n LYS 270 CO 0.00 0.00 0.00 1.57 -0.52 0.00 0.00 177.40 178.45 1git h LYS 271 N -0.11 0.00 -0.30 1.97 2.10 -1.63 0.37 116.57 118.97 1git h LYS 271 Ca -0.13 0.00 -0.03 0.00 -2.00 0.00 0.00 60.65 58.49 1git h LYS 271 Cb 1.10 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.41 1git h LYS 271 CO 0.15 0.00 0.06 0.38 -2.00 0.00 0.00 179.45 178.04 1git h ASP 272 N 0.00 0.47 0.58 7.07 2.03 -1.91 -1.72 116.42 122.94 1git h ASP 272 Ca 0.18 -0.25 -0.17 0.00 -0.73 0.00 0.00 57.03 56.06 1git h ASP 272 Cb 0.81 -0.12 -0.01 0.00 -0.83 0.00 0.00 39.33 39.17 1git h ASP 272 CO -0.00 0.59 -0.78 -0.07 -1.03 0.00 0.00 179.24 177.95 1git h LEU 273 N 0.32 0.18 -0.51 0.15 3.38 -1.36 -3.15 115.31 114.33 1git h LEU 273 Ca 0.09 -0.14 -0.04 0.00 0.09 0.00 0.00 57.88 57.89 1git h LEU 273 Cb 0.32 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 1git h LEU 273 CO 0.00 0.89 0.17 0.15 0.09 0.00 0.00 178.44 179.74 1git h PHE 274 N 0.09 0.81 0.11 1.13 3.57 -1.13 -1.79 116.94 119.73 1git h PHE 274 Ca -0.03 -0.08 0.02 0.00 3.53 0.00 0.00 57.97 61.42 1git h PHE 274 Cb 1.36 -0.23 -0.04 0.00 2.79 0.00 0.00 35.95 39.83 1git h PHE 274 CO 0.02 0.69 -0.37 0.93 -2.23 0.00 0.00 178.31 177.36 1git h GLU 275 N 0.68 -0.57 0.00 1.11 5.08 -1.28 0.16 114.58 119.76 1git h GLU 275 Ca 0.16 0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.53 1git h GLU 275 Cb 0.26 0.13 -0.00 0.00 0.50 0.00 0.00 28.75 29.63 1git h GLU 275 CO -0.01 -0.38 -0.14 1.05 -1.00 0.00 0.00 179.01 178.53 1git h GLU 276 N -0.59 0.00 0.00 2.33 4.11 -1.51 -3.29 114.58 115.63 1git h GLU 276 Ca 0.03 0.00 -0.05 0.00 0.07 0.00 0.00 59.36 59.41 1git h GLU 276 Cb 0.63 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.87 1git h GLU 276 CO -0.22 0.14 -0.29 0.87 0.07 0.00 0.00 179.01 179.58 1git h LYS 277 N 0.00 0.00 -1.06 1.06 1.57 -0.61 -3.37 116.57 114.15 1git h LYS 277 Ca -0.00 0.00 0.30 0.00 -1.87 0.00 0.00 60.65 59.08 1git h LYS 277 Cb 0.37 0.00 -0.12 0.00 0.08 0.00 0.00 32.23 32.56 1git h LYS 277 CO 0.02 0.73 0.65 0.97 -0.57 0.00 0.00 179.45 181.25 1git h ILE 278 N -1.00 0.40 0.00 1.86 6.09 -0.78 0.35 117.51 124.43 1git h ILE 278 Ca -0.07 -0.13 0.00 0.00 -1.37 0.00 0.00 64.86 63.29 1git h ILE 278 Cb 0.83 -0.00 0.00 0.00 0.47 0.00 0.00 36.82 38.12 1git h ILE 278 CO -0.04 0.07 0.00 2.29 -3.07 0.00 0.00 178.15 177.39 1git n LYS 279 N -4.82 0.75 0.00 2.19 -0.00 -1.25 -3.62 118.16 111.41 1git n LYS 279 Ca 0.29 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.60 1git n LYS 279 Cb 0.97 -1.14 0.00 0.00 -0.00 0.00 0.00 35.03 34.85 1git n LYS 279 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 1git n LYS 280 N -0.26 3.08 -4.23 -1.58 5.02 0.11 -5.07 118.16 115.23 1git n LYS 280 Ca 0.00 0.00 -0.29 0.00 -2.02 0.00 0.00 58.31 56.00 1git n LYS 280 Cb 0.07 -0.42 -0.17 0.00 -0.02 0.00 0.00 35.03 34.50 1git n LYS 280 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1git s SER 281 N -0.39 2.45 0.34 4.39 0.15 -0.25 -5.13 113.70 115.27 1git s SER 281 Ca 0.00 -0.42 -0.27 0.00 0.70 0.00 0.00 55.95 55.96 1git s SER 281 Cb 0.00 -1.07 -0.09 0.00 -1.71 0.00 0.00 66.02 63.15 1git s SER 281 CO 0.00 -0.03 1.09 -2.84 1.20 0.00 0.00 173.24 172.66 1git s PRO 282 N 1.25 4.37 0.56 5.44 0.02 -1.26 -4.33 135.00 141.06 1git s PRO 282 Ca -0.01 1.70 0.26 0.00 0.02 0.00 0.00 61.00 62.97 1git s PRO 282 Cb -0.14 -2.87 1.62 0.00 0.02 0.00 0.00 34.50 33.13 1git s PRO 282 CO -0.06 0.00 2.20 1.25 -0.33 0.00 0.00 177.00 180.06 1git h LEU 283 N 3.15 0.00 -1.28 -5.54 5.85 -1.93 -1.27 115.31 114.28 1git h LEU 283 Ca -0.48 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.24 1git h LEU 283 Cb 1.22 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.25 1git h LEU 283 CO 0.65 0.03 0.15 0.71 -0.34 0.00 0.00 178.44 179.63 1git h THR 284 N 0.00 0.00 -0.03 1.05 1.35 -1.90 1.37 112.91 114.76 1git h THR 284 Ca -0.00 0.00 -0.13 0.00 -0.55 0.00 0.00 66.41 65.73 1git h THR 284 Cb 0.06 0.43 -0.02 0.00 -1.73 0.00 0.00 68.15 66.89 1git h THR 284 CO 0.00 0.00 -0.59 0.40 -0.25 0.00 0.00 175.52 175.09 1git h ILE 285 N 0.00 1.40 0.01 6.82 2.04 -1.58 -2.64 117.51 123.57 1git h ILE 285 Ca 0.00 -1.98 -0.29 0.00 1.00 0.00 0.00 64.86 63.59 1git h ILE 285 Cb 0.30 2.04 -0.04 0.00 -0.74 0.00 0.00 36.82 38.38 1git h ILE 285 CO 0.00 0.57 -1.59 0.00 0.00 0.00 0.00 178.15 177.13 1git s TYR 287 N -2.41 2.79 0.66 0.00 2.02 -0.39 -4.97 117.35 115.05 1git s TYR 287 Ca -0.31 -2.94 0.31 0.00 -0.37 0.00 0.00 57.07 53.77 1git s TYR 287 Cb 0.08 -2.40 1.69 0.00 -0.40 0.00 0.00 41.96 40.93 1git s TYR 287 CO 0.58 -0.71 1.96 -1.00 -1.57 0.00 0.00 175.55 174.81 1git h PRO 288 N 6.25 0.00 -0.00 -1.71 0.13 -1.71 0.30 132.00 135.26 1git h PRO 288 Ca 0.02 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.15 1git h PRO 288 Cb 0.87 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.00 1git h PRO 288 CO 0.61 0.00 -0.19 -0.85 -0.23 0.00 0.00 178.00 177.35 1git n GLU 289 N -2.95 0.41 -1.79 0.86 0.00 -1.26 -4.88 120.64 111.03 1git n GLU 289 Ca -0.02 -0.16 -0.42 0.00 0.00 0.00 0.00 57.16 56.57 1git n GLU 289 Cb 0.37 -1.50 -0.03 0.00 0.00 0.00 0.00 31.44 30.28 1git n GLU 289 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.13 176.66 1git s TYR 290 N -2.70 2.95 -0.07 -1.84 5.04 0.11 -4.89 117.35 115.95 1git s TYR 290 Ca 0.22 0.44 0.06 0.00 -2.44 0.00 0.00 57.07 55.35 1git s TYR 290 Cb 0.19 -4.07 -0.09 0.00 0.35 0.00 0.00 41.96 38.34 1git s TYR 290 CO 0.54 -4.02 0.17 0.00 -1.34 0.00 0.00 175.55 170.89 1git n ALA 291 N 3.95 2.36 -1.00 3.97 0.00 -1.26 -4.86 120.51 123.67 1git n ALA 291 Ca 0.15 -0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1git n ALA 291 Cb 0.36 -0.22 0.00 0.00 0.00 0.00 0.00 19.45 19.59 1git n ALA 291 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1git n GLY 292 N 1.93 -2.46 3.97 0.00 0.00 -1.26 -5.04 105.19 102.32 1git n GLY 292 Ca -0.01 -1.39 -0.21 0.00 0.00 0.00 0.00 46.02 44.41 1git n GLY 292 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1git s SER 293 N -1.58 6.02 -1.15 1.61 1.04 -1.26 -5.03 113.70 113.36 1git s SER 293 Ca 0.00 0.12 -0.08 0.00 0.48 0.00 0.00 55.95 56.47 1git s SER 293 Cb 0.00 -1.55 0.25 0.00 0.10 0.00 0.00 66.02 64.82 1git s SER 293 CO 0.00 -0.46 1.44 0.59 0.98 0.00 0.00 173.24 175.79 1git n ASN 294 N -1.79 5.72 -4.40 7.02 3.02 -1.26 -4.06 115.26 119.52 1git n ASN 294 Ca -0.02 -3.18 -0.22 0.00 -0.03 0.00 0.00 54.58 51.13 1git n ASN 294 Cb 0.57 -1.39 -0.10 0.00 -0.61 0.00 0.00 39.78 38.25 1git n ASN 294 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1git s THR 295 N -1.08 2.13 0.17 3.41 -4.23 -1.26 -4.59 115.64 110.19 1git s THR 295 Ca 0.34 -2.20 -0.18 0.00 -1.18 0.00 0.00 61.69 58.47 1git s THR 295 Cb -0.00 -2.12 0.10 0.00 1.34 0.00 0.00 72.50 71.83 1git s THR 295 CO 0.02 -0.39 1.66 0.22 -0.54 0.00 0.00 174.62 175.58 1git h TYR 296 N 2.68 -0.31 -0.13 3.99 3.20 -1.91 -2.22 116.97 122.27 1git h TYR 296 Ca -0.41 0.04 0.04 0.00 3.14 0.00 0.00 58.73 61.55 1git h TYR 296 Cb 1.23 0.20 -0.05 0.00 1.54 0.00 0.00 36.73 39.65 1git h TYR 296 CO 0.74 -0.21 -0.19 0.93 -1.64 0.00 0.00 178.16 177.79 1git h GLU 297 N -0.04 -0.23 -0.04 1.82 3.07 -1.96 -1.58 114.58 115.61 1git h GLU 297 Ca 0.20 0.02 -0.05 0.00 -0.50 0.00 0.00 59.36 59.03 1git h GLU 297 Cb 0.35 0.05 0.00 0.00 -0.84 0.00 0.00 28.75 28.31 1git h GLU 297 CO -0.44 -0.15 -0.16 0.93 -1.40 0.00 0.00 179.01 177.79 1git h GLU 298 N -0.24 0.18 -0.25 2.33 5.08 -1.79 -3.08 114.58 116.81 1git h GLU 298 Ca 0.10 -0.14 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1git h GLU 298 Cb 0.38 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.65 1git h GLU 298 CO -0.27 0.78 0.16 0.00 -1.00 0.00 0.00 179.01 178.68 1git h ALA 299 N 0.40 0.32 -0.63 3.43 0.00 -1.43 -1.32 119.26 120.02 1git h ALA 299 Ca -0.01 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1git h ALA 299 Cb 0.80 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.46 1git h ALA 299 CO 0.03 -0.21 0.33 0.00 0.00 0.00 0.00 179.25 179.40 1git h ALA 300 N 1.09 0.81 -0.39 0.00 0.00 -1.42 -0.80 119.26 118.54 1git h ALA 300 Ca 0.09 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1git h ALA 300 Cb -0.04 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 1git h ALA 300 CO -0.02 0.35 0.18 0.00 0.00 0.00 0.00 179.25 179.76 1git h ALA 301 N 1.15 1.58 -0.32 0.00 0.00 -1.42 -0.90 119.26 119.35 1git h ALA 301 Ca 0.22 -0.09 -0.10 0.00 0.00 0.00 0.00 54.91 54.94 1git h ALA 301 Cb 0.08 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1git h ALA 301 CO -0.03 0.34 -0.20 -0.92 0.00 0.00 0.00 179.25 178.44 1git h TYR 302 N 0.55 0.81 -0.10 0.00 3.20 -0.40 -1.50 116.97 119.53 1git h TYR 302 Ca 0.14 -0.22 -0.00 0.00 3.14 0.00 0.00 58.73 61.79 1git h TYR 302 Cb 0.07 -0.18 -0.00 0.00 1.54 0.00 0.00 36.73 38.16 1git h TYR 302 CO 0.00 0.93 0.06 0.82 -1.64 0.00 0.00 178.16 178.33 1git h ILE 303 N 0.46 1.09 -0.28 1.81 2.04 -0.57 -1.52 117.51 120.54 1git h ILE 303 Ca 0.07 -0.25 0.04 0.00 1.00 0.00 0.00 64.86 65.71 1git h ILE 303 Cb 0.74 1.07 -0.04 0.00 -0.74 0.00 0.00 36.82 37.86 1git h ILE 303 CO 0.06 0.08 0.04 -0.61 0.00 0.00 0.00 178.15 177.71 1git h GLN 304 N 0.07 0.13 -0.46 2.37 4.15 -1.10 -2.35 115.11 117.91 1git h GLN 304 Ca 0.04 -0.01 0.04 0.00 0.77 0.00 0.00 58.65 59.49 1git h GLN 304 Cb 0.08 -0.03 -0.04 0.00 0.21 0.00 0.00 27.48 27.70 1git h GLN 304 CO -0.01 0.09 0.24 0.00 -1.93 0.00 0.00 178.83 177.22 1git h GLN 306 N 0.47 0.82 0.10 0.00 1.08 -0.85 0.15 115.11 116.87 1git h GLN 306 Ca 0.20 -0.05 -0.23 0.00 -1.45 0.00 0.00 58.65 57.12 1git h GLN 306 Cb 0.10 -0.19 0.02 0.00 -0.05 0.00 0.00 27.48 27.37 1git h GLN 306 CO -0.14 0.54 -0.97 0.74 -0.95 0.00 0.00 178.83 178.06 1git h PHE 307 N 0.85 0.78 -0.56 2.96 0.04 -1.06 -3.33 116.94 116.61 1git h PHE 307 Ca 0.54 -0.50 -0.07 0.00 2.80 0.00 0.00 57.97 60.74 1git h PHE 307 Cb 0.74 -0.06 -0.02 0.00 2.20 0.00 0.00 35.95 38.81 1git h PHE 307 CO -0.00 1.35 0.05 0.93 -0.60 0.00 0.00 178.31 180.04 1git h GLU 308 N -0.01 0.92 0.00 1.51 5.08 -0.60 -2.86 114.58 118.62 1git h GLU 308 Ca -0.15 -0.24 0.00 0.00 -1.00 0.00 0.00 59.36 57.97 1git h GLU 308 Cb 1.70 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.84 1git h GLU 308 CO 0.19 0.88 0.00 -0.44 -1.00 0.00 0.00 179.01 178.64 1git h ASP 309 N 0.86 0.00 0.59 1.42 3.32 -0.84 -1.36 116.42 120.40 1git h ASP 309 Ca 0.17 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.22 1git h ASP 309 Cb 0.44 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.99 1git h ASP 309 CO 0.02 0.00 0.00 0.18 -1.72 0.00 0.00 179.24 177.72 1git n LEU 310 N -2.87 0.00 -4.57 1.55 4.77 -1.08 -4.64 117.00 110.16 1git n LEU 310 Ca -0.02 0.50 -0.43 0.00 -0.03 0.00 0.00 56.01 56.03 1git n LEU 310 Cb 0.13 -0.50 -0.03 0.00 -2.33 0.00 0.00 43.42 40.70 1git n LEU 310 CO 0.20 -0.20 0.93 0.21 -1.33 0.00 0.00 177.39 177.19 1git s ASN 311 N -2.99 6.48 0.06 -1.43 2.47 -0.52 -4.80 114.94 114.21 1git s ASN 311 Ca 0.09 0.09 -0.17 0.00 0.42 0.00 0.00 52.86 53.29 1git s ASN 311 Cb 0.11 -2.50 -0.14 0.00 -1.45 0.00 0.00 41.25 37.27 1git s ASN 311 CO 0.31 -1.28 1.31 0.11 -3.72 0.00 0.00 177.10 173.84 1git h LYS 312 N 9.32 0.55 -2.18 0.43 1.57 -1.88 -3.22 116.57 121.16 1git h LYS 312 Ca -0.25 -0.36 -0.07 0.00 -1.87 0.00 0.00 60.65 58.10 1git h LYS 312 Cb 1.06 0.05 -0.03 0.00 0.08 0.00 0.00 32.23 33.40 1git h LYS 312 CO 1.12 0.97 -0.05 0.54 -0.57 0.00 0.00 179.45 181.46 1git n ARG 313 N -4.30 1.04 0.00 3.15 3.00 -1.26 -4.50 116.66 113.79 1git n ARG 313 Ca -0.06 -0.36 0.22 0.00 -0.01 0.00 0.00 57.85 57.64 1git n ARG 313 Cb 0.51 -1.53 0.73 0.00 0.00 0.00 0.00 32.46 32.17 1git n ARG 313 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.63 178.50 1git h LYS 314 N 3.06 0.00 0.00 5.56 1.57 -1.72 1.07 116.57 126.10 1git h LYS 314 Ca 0.07 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 1git h LYS 314 Cb 0.86 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.17 1git h LYS 314 CO 0.17 0.00 -0.01 -0.44 -0.57 0.00 0.00 179.45 178.60 1git h ASP 315 N 0.00 0.00 -0.17 0.86 3.32 -1.92 -3.41 116.42 115.09 1git h ASP 315 Ca 0.26 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.31 1git h ASP 315 Cb 1.20 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.74 1git h ASP 315 CO -0.00 0.06 0.11 0.71 -1.72 0.00 0.00 179.24 178.39 1git h THR 316 N -0.11 1.08 -2.83 0.35 1.35 -1.89 -3.44 112.91 107.41 1git h THR 316 Ca 0.00 -0.19 -0.65 0.00 -0.55 0.00 0.00 66.41 65.02 1git h THR 316 Cb 0.01 0.89 -0.08 0.00 -1.73 0.00 0.00 68.15 67.24 1git h THR 316 CO 0.00 0.07 -0.46 -0.75 -0.25 0.00 0.00 175.52 174.13 1git s LYS 317 N -6.00 3.67 -0.04 4.72 2.20 0.37 -5.10 119.74 119.56 1git s LYS 317 Ca -0.13 -0.11 0.07 0.00 -0.36 0.00 0.00 55.97 55.44 1git s LYS 317 Cb 0.08 -3.25 -0.02 0.00 -1.51 0.00 0.00 37.83 33.13 1git s LYS 317 CO 0.69 0.64 -0.24 -2.00 -0.36 0.00 0.00 175.35 174.08 1git s GLU 318 N -0.65 2.35 -0.17 4.03 2.12 -1.26 -4.21 118.70 120.90 1git s GLU 318 Ca 0.14 -0.89 -0.06 0.00 0.36 0.00 0.00 54.97 54.51 1git s GLU 318 Cb -0.12 -2.13 -0.04 0.00 0.26 0.00 0.00 34.13 32.10 1git s GLU 318 CO 0.03 0.49 0.04 0.42 -0.54 0.00 0.00 175.26 175.70 1git s ILE 319 N -0.42 4.58 -0.40 -3.70 1.01 -1.26 -4.35 121.20 116.66 1git s ILE 319 Ca 0.04 -0.11 -0.09 0.00 0.00 0.00 0.00 60.65 60.49 1git s ILE 319 Cb -0.12 -3.04 0.06 0.00 0.01 0.00 0.00 42.46 39.37 1git s ILE 319 CO 0.01 0.48 0.22 -0.31 0.00 0.00 0.00 174.94 175.34 1git s TYR 320 N 0.27 3.31 -0.10 3.97 2.02 -0.98 -5.01 117.35 120.82 1git s TYR 320 Ca 0.02 -1.43 -0.10 0.00 -0.37 0.00 0.00 57.07 55.19 1git s TYR 320 Cb -0.13 -2.74 -0.05 0.00 -0.40 0.00 0.00 41.96 38.65 1git s TYR 320 CO 0.01 -0.79 0.22 0.99 -1.57 0.00 0.00 175.55 174.41 1git s THR 321 N 1.44 5.36 0.01 -0.71 2.01 -1.26 -0.60 115.64 121.88 1git s THR 321 Ca 0.02 0.40 0.01 0.00 0.31 0.00 0.00 61.69 62.43 1git s THR 321 Cb -0.22 -3.51 -0.01 0.00 0.01 0.00 0.00 72.50 68.78 1git s THR 321 CO 0.03 0.56 -0.04 -1.00 -0.69 0.00 0.00 174.62 173.48 1git s HIS 322 N -0.72 0.38 -0.22 4.92 3.76 0.20 -4.92 115.29 118.69 1git s HIS 322 Ca 0.16 -0.18 -0.13 0.00 -0.15 0.00 0.00 55.06 54.77 1git s HIS 322 Cb -0.13 -0.24 -0.04 0.00 1.11 0.00 0.00 32.58 33.28 1git s HIS 322 CO 0.06 -0.03 0.28 -0.06 -0.85 0.00 0.00 174.74 174.13 1git s PHE 323 N -0.42 3.34 0.18 1.40 0.40 -1.26 -0.63 117.98 120.99 1git s PHE 323 Ca -0.02 0.42 0.04 0.00 -0.60 0.00 0.00 56.93 56.77 1git s PHE 323 Cb -0.04 -2.40 -0.05 0.00 0.51 0.00 0.00 43.02 41.05 1git s PHE 323 CO -0.00 0.02 -0.07 0.95 0.70 0.00 0.00 175.22 176.82 1git s THR 324 N 1.21 1.14 -0.48 0.64 -4.23 -0.71 -4.94 115.64 108.28 1git s THR 324 Ca 0.13 -2.06 0.03 0.00 -1.18 0.00 0.00 61.69 58.61 1git s THR 324 Cb -0.14 -2.03 0.14 0.00 1.34 0.00 0.00 72.50 71.81 1git s THR 324 CO 0.06 -0.59 0.28 0.00 -0.54 0.00 0.00 174.62 173.84 1git h ALA 326 N 6.42 2.26 0.00 0.00 0.00 -1.95 0.82 119.26 126.82 1git h ALA 326 Ca 0.04 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1git h ALA 326 Cb 0.90 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.73 1git h ALA 326 CO 0.52 -0.74 0.00 0.25 0.00 0.00 0.00 179.25 179.27 1git n THR 327 N -3.82 0.38 -3.16 0.00 -2.24 -1.26 -4.59 114.28 99.58 1git n THR 327 Ca 0.09 -0.15 -0.44 0.00 -2.27 0.00 0.00 64.05 61.28 1git n THR 327 Cb 0.69 -0.58 -0.06 0.00 -2.10 0.00 0.00 70.33 68.28 1git n THR 327 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1git s ASP 328 N -3.92 6.21 0.26 3.42 -1.08 0.28 -4.96 116.67 116.88 1git s ASP 328 Ca 0.12 -1.08 -0.03 0.00 -0.52 0.00 0.00 52.55 51.03 1git s ASP 328 Cb 0.15 -2.28 0.41 0.00 -1.46 0.00 0.00 42.92 39.73 1git s ASP 328 CO 0.56 -0.93 1.84 0.74 0.52 0.00 0.00 175.17 177.91 1git h THR 329 N 5.87 1.00 -0.31 1.71 2.02 -1.82 -1.82 112.91 119.56 1git h THR 329 Ca -0.28 -0.34 -0.02 0.00 0.77 0.00 0.00 66.41 66.54 1git h THR 329 Cb 1.09 -0.07 -0.01 0.00 -1.74 0.00 0.00 68.15 67.42 1git h THR 329 CO 0.99 0.18 0.12 0.50 0.37 0.00 0.00 175.52 177.68 1git h LYS 330 N 0.98 0.47 0.17 6.66 3.64 -1.94 -0.05 116.57 126.50 1git h LYS 330 Ca 0.42 -0.09 -0.01 0.00 -1.27 0.00 0.00 60.65 59.70 1git h LYS 330 Cb 0.28 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 32.02 1git h LYS 330 CO -0.21 0.48 -0.09 -0.97 -2.27 0.00 0.00 179.45 176.39 1git h ASN 331 N 0.35 -0.23 -0.70 4.20 -0.73 -1.80 -0.31 115.58 116.36 1git h ASN 331 Ca 0.10 0.01 0.03 0.00 1.87 0.00 0.00 56.30 58.32 1git h ASN 331 Cb 0.19 0.07 -0.04 0.00 0.27 0.00 0.00 38.32 38.81 1git h ASN 331 CO -0.01 -0.16 0.46 0.58 -0.37 0.00 0.00 177.43 177.94 1git h VAL 332 N -0.25 1.12 0.26 2.57 2.07 -1.26 0.16 116.25 120.93 1git h VAL 332 Ca -0.02 -0.30 -0.01 0.00 0.82 0.00 0.00 66.70 67.19 1git h VAL 332 Cb 0.20 0.17 0.00 0.00 -1.52 0.00 0.00 31.29 30.15 1git h VAL 332 CO 0.02 0.16 -0.13 -0.61 0.02 0.00 0.00 177.57 177.03 1git h GLN 333 N 0.87 -0.34 -0.52 1.57 4.15 -0.51 0.23 115.11 120.56 1git h GLN 333 Ca 0.28 0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.72 1git h GLN 333 Cb 0.03 0.08 -0.03 0.00 0.21 0.00 0.00 27.48 27.77 1git h GLN 333 CO -0.08 -0.08 0.33 0.74 -1.93 0.00 0.00 178.83 177.81 1git h PHE 334 N -0.57 0.67 -0.83 3.99 0.04 -0.65 -0.65 116.94 118.94 1git h PHE 334 Ca -0.04 0.01 -0.04 0.00 2.80 0.00 0.00 57.97 60.71 1git h PHE 334 Cb 0.41 -0.22 -0.04 0.00 2.20 0.00 0.00 35.95 38.30 1git h PHE 334 CO -0.00 0.44 0.38 0.28 -0.60 0.00 0.00 178.31 178.80 1git h VAL 335 N 0.70 1.26 -0.13 -0.55 2.07 -0.92 -2.21 116.25 116.48 1git h VAL 335 Ca 0.19 -0.76 -0.11 0.00 0.82 0.00 0.00 66.70 66.84 1git h VAL 335 Cb -0.06 0.22 -0.01 0.00 -1.52 0.00 0.00 31.29 29.92 1git h VAL 335 CO -0.04 0.32 -0.40 0.15 0.02 0.00 0.00 177.57 177.63 1git h PHE 336 N 1.19 0.33 -0.26 1.57 3.57 -0.05 -0.84 116.94 122.45 1git h PHE 336 Ca 0.28 -0.09 0.00 0.00 3.53 0.00 0.00 57.97 61.70 1git h PHE 336 Cb 0.15 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 38.81 1git h PHE 336 CO 0.02 0.65 0.17 0.22 -2.23 0.00 0.00 178.31 177.14 1git h ASP 337 N 0.24 0.31 0.30 0.41 3.58 -0.56 -0.32 116.42 120.38 1git h ASP 337 Ca 0.02 -0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.46 1git h ASP 337 Cb 0.81 -0.08 -0.02 0.00 1.72 0.00 0.00 39.33 41.76 1git h ASP 337 CO 0.06 0.22 -0.32 0.00 -2.88 0.00 0.00 179.24 176.33 1git h ALA 338 N 1.09 -0.67 -0.45 -0.78 0.00 -0.88 -1.53 119.26 116.05 1git h ALA 338 Ca 0.10 -0.10 0.09 0.00 0.00 0.00 0.00 54.91 55.00 1git h ALA 338 Cb -0.04 0.47 -0.08 0.00 0.00 0.00 0.00 17.79 18.14 1git h ALA 338 CO -0.02 -0.91 -0.09 0.28 0.00 0.00 0.00 179.25 178.51 1git h VAL 339 N -0.66 0.57 0.00 0.00 2.07 -0.94 -0.52 116.25 116.77 1git h VAL 339 Ca -0.01 -0.01 -0.02 0.00 0.82 0.00 0.00 66.70 67.48 1git h VAL 339 Cb 0.61 0.54 -0.00 0.00 -1.52 0.00 0.00 31.29 30.92 1git h VAL 339 CO -0.07 0.00 -0.07 0.71 0.02 0.00 0.00 177.57 178.16 1git h THR 340 N 0.02 0.94 0.00 2.57 1.35 -0.60 -0.05 112.91 117.14 1git h THR 340 Ca 0.22 -0.26 -0.07 0.00 -0.55 0.00 0.00 66.41 65.75 1git h THR 340 Cb 0.34 1.14 -0.01 0.00 -1.73 0.00 0.00 68.15 67.89 1git h THR 340 CO -0.45 0.07 -0.35 0.44 -0.25 0.00 0.00 175.52 174.98 1git h ASP 341 N 0.00 0.00 0.14 5.36 3.32 -0.08 -2.53 116.42 122.63 1git h ASP 341 Ca -0.00 0.00 -0.22 0.00 0.02 0.00 0.00 57.03 56.83 1git h ASP 341 Cb 0.14 0.00 0.02 0.00 0.22 0.00 0.00 39.33 39.71 1git h ASP 341 CO 0.01 0.35 -0.96 1.62 -1.72 0.00 0.00 179.24 178.54 1git h VAL 342 N 0.00 1.43 -0.86 -1.35 3.04 -0.64 -2.86 116.25 115.01 1git h VAL 342 Ca -0.00 -2.49 0.00 0.00 -1.01 0.00 0.00 66.70 63.19 1git h VAL 342 Cb 0.89 3.03 -0.04 0.00 -2.01 0.00 0.00 31.29 33.16 1git h VAL 342 CO 0.05 0.72 0.55 0.40 -1.01 0.00 0.00 177.57 178.27 1git h ILE 343 N -0.16 1.23 -0.67 3.17 2.04 -1.38 -0.12 117.51 121.61 1git h ILE 343 Ca -0.16 -0.46 -0.06 0.00 1.00 0.00 0.00 64.86 65.18 1git h ILE 343 Cb 1.73 -0.01 -0.03 0.00 -0.74 0.00 0.00 36.82 37.77 1git h ILE 343 CO 0.18 0.23 0.18 0.40 0.00 0.00 0.00 178.15 179.14 1git h ILE 344 N 1.18 1.25 0.00 -0.67 2.04 -1.52 0.15 117.51 119.94 1git h ILE 344 Ca 0.31 -0.91 -0.04 0.00 1.00 0.00 0.00 64.86 65.22 1git h ILE 344 Cb -0.09 0.54 -0.01 0.00 -0.74 0.00 0.00 36.82 36.52 1git h ILE 344 CO -0.06 0.35 -0.19 0.50 0.00 0.00 0.00 178.15 178.74 1git h LYS 345 N 1.01 0.00 0.00 2.37 3.64 -0.79 -3.39 116.57 119.41 1git h LYS 345 Ca 0.22 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.60 1git h LYS 345 Cb 0.33 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.15 1git h LYS 345 CO -0.00 0.19 0.00 0.27 -2.27 0.00 0.00 179.45 177.64 1git n ASN 346 N -3.72 0.00 0.00 4.20 6.94 -0.94 -4.96 115.26 116.78 1git n ASN 346 Ca -0.01 -0.63 0.00 0.00 -0.02 0.00 0.00 54.58 53.91 1git n ASN 346 Cb 0.31 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.73 1git n ASN 346 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 1git n ASN 347 N 0.00 0.20 -0.79 0.53 3.02 0.52 -5.08 115.26 113.65 1git n ASN 347 Ca 0.00 -0.42 0.10 0.00 -0.03 0.00 0.00 54.58 54.23 1git n ASN 347 Cb 0.16 0.88 0.08 0.00 -0.61 0.00 0.00 39.78 40.29 1git n ASN 347 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82