#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hgt n SER 28 N 0.00 0.79 0.00 8.00 3.41 -1.26 -4.92 113.62 119.64 3hgt n SER 28 Ca 0.00 -0.61 0.00 0.00 -0.26 0.00 0.00 58.87 58.00 3hgt n SER 28 Cb 0.00 0.44 0.00 0.00 -0.26 0.00 0.00 64.21 64.39 3hgt n SER 28 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3hgt n GLY 29 N 1.47 0.77 2.80 5.00 0.00 -1.26 -5.02 105.19 108.96 3hgt n GLY 29 Ca 0.06 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.79 3hgt n GLY 29 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3hgt s ASP 30 N -2.58 3.78 0.06 1.61 -1.08 -1.26 0.75 116.67 117.95 3hgt s ASP 30 Ca 0.00 -1.38 0.08 0.00 -0.52 0.00 0.00 52.55 50.72 3hgt s ASP 30 Cb 0.00 -0.93 -0.03 0.00 -1.46 0.00 0.00 42.92 40.51 3hgt s ASP 30 CO 0.00 -0.35 -0.21 -0.31 0.52 0.00 0.00 175.17 174.82 3hgt s TYR 31 N 1.57 1.80 -0.01 -5.34 2.02 0.93 -4.99 117.35 113.33 3hgt s TYR 31 Ca 0.04 -0.39 -0.03 0.00 -0.37 0.00 0.00 57.07 56.32 3hgt s TYR 31 Cb -0.18 -1.05 -0.04 0.00 -0.40 0.00 0.00 41.96 40.29 3hgt s TYR 31 CO -0.16 0.12 0.18 1.67 -1.57 0.00 0.00 175.55 175.80 3hgt s TRP 32 N -0.90 3.55 -0.36 2.71 1.48 -1.26 0.42 118.94 124.58 3hgt s TRP 32 Ca 0.07 0.37 0.03 0.00 -1.06 0.00 0.00 56.10 55.51 3hgt s TRP 32 Cb -0.09 -1.84 0.11 0.00 -1.16 0.00 0.00 33.47 30.49 3hgt s TRP 32 CO 0.02 0.65 0.10 -1.17 -4.06 0.00 0.00 176.95 172.50 3hgt s LEU 33 N -1.89 3.95 0.46 -4.66 2.96 0.82 -4.80 118.68 115.51 3hgt s LEU 33 Ca 0.27 -2.18 -0.25 0.00 -0.22 0.00 0.00 54.13 51.75 3hgt s LEU 33 Cb -0.13 -1.40 -0.08 0.00 0.50 0.00 0.00 46.19 45.08 3hgt s LEU 33 CO 0.18 -0.36 1.44 -2.65 -1.32 0.00 0.00 176.35 173.64 3hgt n PRO 34 N 4.19 2.24 -4.46 0.98 -0.02 -1.26 -2.14 135.00 134.54 3hgt n PRO 34 Ca 0.03 0.80 -0.22 0.00 -2.02 0.00 0.00 63.50 62.09 3hgt n PRO 34 Cb 0.40 -2.65 -0.11 0.00 -0.02 0.00 0.00 33.50 31.13 3hgt n PRO 34 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 3hgt s THR 35 N -1.20 1.39 0.74 3.45 -4.23 0.91 -4.83 115.64 111.88 3hgt s THR 35 Ca 0.62 -2.03 -0.04 0.00 -1.18 0.00 0.00 61.69 59.05 3hgt s THR 35 Cb -0.44 -2.71 0.15 0.00 1.34 0.00 0.00 72.50 70.84 3hgt s THR 35 CO 0.57 -0.09 1.01 0.35 -0.54 0.00 0.00 174.62 175.92 3hgt n THR 36 N -0.68 0.00 -4.80 3.99 -2.24 -1.26 -1.74 114.28 107.55 3hgt n THR 36 Ca -0.03 -1.32 -0.26 0.00 -2.27 0.00 0.00 64.05 60.17 3hgt n THR 36 Cb 0.66 -1.09 -0.15 0.00 -2.10 0.00 0.00 70.33 67.65 3hgt n THR 36 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 3hgt s MET 37 N -5.12 1.47 1.00 -0.78 -1.94 -1.19 -3.50 119.30 109.24 3hgt s MET 37 Ca 0.64 -0.78 -0.11 0.00 -1.71 0.00 0.00 55.69 53.73 3hgt s MET 37 Cb -0.03 -1.47 0.19 0.00 2.01 0.00 0.00 34.83 35.53 3hgt s MET 37 CO 0.43 0.39 1.08 0.45 -0.01 0.00 0.00 175.02 177.37 3hgt s SER 38 N -0.74 2.36 0.17 3.03 0.15 -1.26 -4.77 113.70 112.64 3hgt s SER 38 Ca 0.07 1.72 -0.13 0.00 0.70 0.00 0.00 55.95 58.32 3hgt s SER 38 Cb -0.08 -2.35 0.07 0.00 -1.71 0.00 0.00 66.02 61.95 3hgt s SER 38 CO 0.00 -3.38 1.76 0.25 1.20 0.00 0.00 173.24 173.07 3hgt h LEU 39 N -2.06 0.74 -0.82 3.45 5.85 -1.95 -1.99 115.31 118.54 3hgt h LEU 39 Ca -0.52 -0.13 -0.02 0.00 0.84 0.00 0.00 57.88 58.05 3hgt h LEU 39 Cb 1.30 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 42.10 3hgt h LEU 39 CO 0.49 0.66 0.42 0.22 -0.34 0.00 0.00 178.44 179.89 3hgt h TYR 40 N 0.77 1.14 -0.38 1.25 3.20 -1.93 -2.02 116.97 119.00 3hgt h TYR 40 Ca 0.20 -0.04 -0.06 0.00 3.14 0.00 0.00 58.73 61.97 3hgt h TYR 40 Cb 0.11 -0.36 -0.02 0.00 1.54 0.00 0.00 36.73 38.00 3hgt h TYR 40 CO -0.00 0.81 0.00 1.96 -1.64 0.00 0.00 178.16 179.29 3hgt h GLN 41 N 1.14 0.60 -0.28 1.82 4.20 -1.81 -1.58 115.11 119.21 3hgt h GLN 41 Ca 0.28 -0.14 -0.07 0.00 0.06 0.00 0.00 58.65 58.78 3hgt h GLN 41 Cb 0.07 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 27.76 3hgt h GLN 41 CO -0.04 0.62 -0.11 0.87 -0.67 0.00 0.00 178.83 179.51 3hgt h LYS 42 N 0.57 0.57 -0.30 1.46 1.57 -0.96 -2.99 116.57 116.48 3hgt h LYS 42 Ca 0.12 -0.24 -0.08 0.00 -1.87 0.00 0.00 60.65 58.58 3hgt h LYS 42 Cb 0.36 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.64 3hgt h LYS 42 CO 0.01 0.79 -0.13 0.93 -0.57 0.00 0.00 179.45 180.48 3hgt h GLU 43 N 0.31 0.63 -0.92 3.15 4.39 -1.27 -2.17 114.58 118.70 3hgt h GLU 43 Ca 0.07 -0.27 0.08 0.00 0.34 0.00 0.00 59.36 59.58 3hgt h GLU 43 Cb 0.61 -0.02 -0.06 0.00 -0.10 0.00 0.00 28.75 29.17 3hgt h GLU 43 CO 0.04 0.85 0.59 -0.07 -1.16 0.00 0.00 179.01 179.25 3hgt h LEU 44 N 0.39 0.88 -0.44 1.33 3.38 -1.38 0.17 115.31 119.64 3hgt h LEU 44 Ca 0.07 0.02 -0.15 0.00 0.09 0.00 0.00 57.88 57.91 3hgt h LEU 44 Cb 0.65 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.22 3hgt h LEU 44 CO 0.04 0.54 -0.32 0.74 0.09 0.00 0.00 178.44 179.54 3hgt h THR 45 N 0.99 1.27 -0.27 0.22 2.02 -1.42 0.13 112.91 115.84 3hgt h THR 45 Ca 0.41 -1.49 -0.05 0.00 0.77 0.00 0.00 66.41 66.05 3hgt h THR 45 Cb 0.29 1.28 -0.02 0.00 -1.74 0.00 0.00 68.15 67.96 3hgt h THR 45 CO -0.17 0.50 -0.05 -0.78 0.37 0.00 0.00 175.52 175.40 3hgt h ASP 46 N 0.80 0.39 -0.11 4.18 -0.00 -0.71 -1.18 116.42 119.79 3hgt h ASP 46 Ca 0.08 -0.07 -0.15 0.00 -0.00 0.00 0.00 57.03 56.89 3hgt h ASP 46 Cb 0.91 -0.10 0.01 0.00 -0.00 0.00 0.00 39.33 40.14 3hgt h ASP 46 CO 0.08 0.49 -0.51 1.56 -0.00 0.00 0.00 179.24 180.87 3hgt h GLN 47 N 0.40 0.54 -0.21 0.28 4.20 -0.43 -2.40 115.11 117.48 3hgt h GLN 47 Ca 0.08 -0.43 0.02 0.00 0.06 0.00 0.00 58.65 58.38 3hgt h GLN 47 Cb 0.35 0.09 -0.02 0.00 0.30 0.00 0.00 27.48 28.19 3hgt h GLN 47 CO 0.01 1.06 0.09 0.82 -0.67 0.00 0.00 178.83 180.14 3hgt h ILE 48 N 0.14 0.97 -0.46 2.54 2.04 -0.59 -0.43 117.51 121.72 3hgt h ILE 48 Ca -0.03 -0.07 0.06 0.00 1.00 0.00 0.00 64.86 65.82 3hgt h ILE 48 Cb 1.15 0.75 -0.05 0.00 -0.74 0.00 0.00 36.82 37.93 3hgt h ILE 48 CO 0.11 0.04 0.16 0.58 0.00 0.00 0.00 178.15 179.03 3hgt h VAL 49 N 0.20 0.84 -0.54 1.67 2.07 -1.28 -2.84 116.25 116.37 3hgt h VAL 49 Ca 0.09 -0.11 -0.07 0.00 0.82 0.00 0.00 66.70 67.43 3hgt h VAL 49 Cb 0.04 0.48 -0.02 0.00 -1.52 0.00 0.00 31.29 30.27 3hgt h VAL 49 CO -0.08 0.06 0.07 0.28 0.02 0.00 0.00 177.57 177.92 3hgt h SER 50 N 0.33 0.84 -0.41 0.57 0.02 -0.99 -1.88 113.55 112.03 3hgt h SER 50 Ca 0.22 -0.19 0.12 0.00 -0.84 0.00 0.00 61.79 61.10 3hgt h SER 50 Cb 0.22 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.53 3hgt h SER 50 CO -0.23 0.86 0.31 -0.07 -1.14 0.00 0.00 176.83 176.56 3hgt h LEU 51 N 0.83 0.00 -3.00 5.07 4.07 -0.85 -2.43 115.31 119.00 3hgt h LEU 51 Ca 0.17 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.13 3hgt h LEU 51 Cb 0.40 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.14 3hgt h LEU 51 CO 0.01 0.00 0.00 1.41 -1.08 0.00 0.00 178.44 178.78 3hgt n HIS 52 N -4.29 0.85 -0.13 1.13 8.25 -0.74 -4.71 115.22 115.56 3hgt n HIS 52 Ca 0.07 -0.60 -0.10 0.00 -0.26 0.00 0.00 57.72 56.82 3hgt n HIS 52 Cb 0.50 -0.13 -0.05 0.00 1.12 0.00 0.00 29.99 31.42 3hgt n HIS 52 CO 0.00 0.00 0.00 -0.92 0.64 0.00 0.00 176.34 176.06 3hgt h TYR 53 N 2.69 -1.33 -0.19 4.41 3.20 -1.03 0.69 116.97 125.41 3hgt h TYR 53 Ca 0.00 0.07 0.01 0.00 3.14 0.00 0.00 58.73 61.95 3hgt h TYR 53 Cb 1.07 0.64 -0.02 0.00 1.54 0.00 0.00 36.73 39.96 3hgt h TYR 53 CO 0.43 -0.45 0.09 1.03 -1.64 0.00 0.00 178.16 177.63 3hgt h SER 54 N -0.33 0.14 -0.56 -2.11 0.87 -1.84 -2.73 113.55 106.98 3hgt h SER 54 Ca 0.13 0.01 0.03 0.00 -1.23 0.00 0.00 61.79 60.73 3hgt h SER 54 Cb 0.59 -0.02 -0.03 0.00 -0.44 0.00 0.00 62.40 62.50 3hgt h SER 54 CO -0.59 0.11 0.37 0.44 -0.53 0.00 0.00 176.83 176.64 3hgt h ASP 55 N 0.20 0.58 -0.39 6.23 3.32 -1.71 -0.20 116.42 124.45 3hgt h ASP 55 Ca 0.08 -0.01 -0.08 0.00 0.02 0.00 0.00 57.03 57.04 3hgt h ASP 55 Cb 0.02 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.42 3hgt h ASP 55 CO -0.05 0.40 -0.05 0.40 -1.72 0.00 0.00 179.24 178.21 3hgt h ILE 56 N 0.67 1.27 -0.30 0.35 2.04 -0.60 -0.48 117.51 120.46 3hgt h ILE 56 Ca 0.22 -1.11 -0.08 0.00 1.00 0.00 0.00 64.86 64.90 3hgt h ILE 56 Cb 0.06 1.21 -0.01 0.00 -0.74 0.00 0.00 36.82 37.34 3hgt h ILE 56 CO -0.06 0.37 -0.13 -0.07 0.00 0.00 0.00 178.15 178.26 3hgt h LEU 57 N 0.53 0.63 -1.03 1.44 3.38 -1.14 -2.26 115.31 116.86 3hgt h LEU 57 Ca 0.10 -0.40 0.06 0.00 0.09 0.00 0.00 57.88 57.73 3hgt h LEU 57 Cb 0.55 -0.17 -0.06 0.00 0.09 0.00 0.00 40.66 41.07 3hgt h LEU 57 CO 0.03 0.89 0.64 -0.09 0.09 0.00 0.00 178.44 180.01 3hgt h ARG 58 N 0.37 1.15 -0.25 1.13 9.65 -1.01 0.85 114.38 126.28 3hgt h ARG 58 Ca 0.07 -0.07 -0.01 0.00 -1.10 0.00 0.00 59.98 58.87 3hgt h ARG 58 Cb 0.64 -0.26 -0.01 0.00 -1.39 0.00 0.00 29.97 28.96 3hgt h ARG 58 CO 0.04 0.76 0.11 -0.92 2.80 0.00 0.00 179.97 182.76 3hgt h TYR 59 N 1.18 0.36 0.00 2.20 5.03 -0.85 -2.80 116.97 122.09 3hgt h TYR 59 Ca 0.42 -0.02 -0.12 0.00 2.58 0.00 0.00 58.73 61.59 3hgt h TYR 59 Cb 0.13 -0.11 -0.02 0.00 1.55 0.00 0.00 36.73 38.28 3hgt h TYR 59 CO -0.00 0.36 -0.66 0.74 -1.32 0.00 0.00 178.16 177.27 3hgt h PHE 60 N 0.26 0.00 0.00 -3.82 0.04 -1.25 -3.34 116.94 108.83 3hgt h PHE 60 Ca 0.08 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.85 3hgt h PHE 60 Cb 0.14 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.29 3hgt h PHE 60 CO -0.02 0.56 0.00 -1.91 -0.60 0.00 0.00 178.31 176.34 3hgt n GLU 61 N -3.20 0.00 -0.81 1.51 4.07 0.28 -3.55 120.64 118.94 3hgt n GLU 61 Ca 0.00 0.29 -0.08 0.00 -0.06 0.00 0.00 57.16 57.31 3hgt n GLU 61 Cb 0.77 -1.23 -0.12 0.00 -0.06 0.00 0.00 31.44 30.80 3hgt n GLU 61 CO 0.00 0.00 0.00 0.25 -0.06 0.00 0.00 177.13 177.32 3hgt n THR 62 N -1.38 2.57 -1.62 6.31 -2.24 -1.06 -4.90 114.28 111.97 3hgt n THR 62 Ca 0.00 -1.15 -0.44 0.00 -2.27 0.00 0.00 64.05 60.19 3hgt n THR 62 Cb 0.00 -1.83 -0.04 0.00 -2.10 0.00 0.00 70.33 66.36 3hgt n THR 62 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3hgt n SER 63 N 2.24 3.51 0.00 3.42 3.41 -1.23 -3.30 113.62 121.67 3hgt n SER 63 Ca 0.29 0.54 0.00 0.00 -0.26 0.00 0.00 58.87 59.44 3hgt n SER 63 Cb 0.76 -1.51 0.00 0.00 -0.26 0.00 0.00 64.21 63.20 3hgt n SER 63 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 3hgt n HIS 64 N 9.62 0.00 0.00 7.33 8.25 -1.26 -4.99 115.22 134.17 3hgt n HIS 64 Ca 0.27 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.73 3hgt n HIS 64 Cb 0.40 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.51 3hgt n HIS 64 CO 0.00 0.00 0.00 0.98 0.64 0.00 0.00 176.34 177.96 3hgt n TYR 65 N -0.14 -1.49 -2.92 4.41 9.36 -1.21 -5.12 117.16 120.06 3hgt n TYR 65 Ca 0.00 0.00 -0.01 0.00 3.32 0.00 0.00 57.90 61.21 3hgt n TYR 65 Cb 0.00 0.30 -0.01 0.00 -0.63 0.00 0.00 39.34 39.00 3hgt n TYR 65 CO 0.00 0.00 0.00 0.36 0.22 0.00 0.00 176.86 177.44 3hgt n LYS 66 N -2.10 -2.26 -2.20 2.98 2.85 -1.25 -4.92 118.16 111.25 3hgt n LYS 66 Ca 0.00 1.99 -0.41 0.00 -1.05 0.00 0.00 58.31 58.84 3hgt n LYS 66 Cb 0.00 -3.19 -0.03 0.00 -0.65 0.00 0.00 35.03 31.16 3hgt n LYS 66 CO 0.00 0.00 0.00 -1.83 -0.05 0.00 0.00 177.40 175.52 3hgt s GLU 67 N -1.04 4.39 0.42 -1.58 -1.05 -1.26 -4.75 118.70 113.84 3hgt s GLU 67 Ca -0.04 2.09 0.16 0.00 -0.15 0.00 0.00 54.97 57.02 3hgt s GLU 67 Cb 0.00 -3.16 0.94 0.00 -0.44 0.00 0.00 34.13 31.47 3hgt s GLU 67 CO 0.41 -0.22 1.92 -0.44 0.95 0.00 0.00 175.26 177.88 3hgt h ASP 68 N 4.84 0.00 -0.84 0.83 3.32 -1.97 0.92 116.42 123.52 3hgt h ASP 68 Ca -0.46 0.00 0.18 0.00 0.02 0.00 0.00 57.03 56.77 3hgt h ASP 68 Cb 1.22 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 40.66 3hgt h ASP 68 CO 0.74 0.26 0.35 0.58 -1.72 0.00 0.00 179.24 179.45 3hgt h VAL 69 N 0.00 0.56 0.10 -1.35 2.07 -1.99 -1.20 116.25 114.44 3hgt h VAL 69 Ca -0.00 -0.15 -0.32 0.00 0.82 0.00 0.00 66.70 67.05 3hgt h VAL 69 Cb 0.50 0.10 -0.02 0.00 -1.52 0.00 0.00 31.29 30.35 3hgt h VAL 69 CO 0.03 0.08 -1.71 0.40 0.02 0.00 0.00 177.57 176.39 3hgt h ILE 70 N 0.43 0.77 -0.61 4.57 1.08 -0.49 -2.65 117.51 120.61 3hgt h ILE 70 Ca 0.49 -2.32 0.12 0.00 -0.39 0.00 0.00 64.86 62.76 3hgt h ILE 70 Cb 0.85 2.48 -0.09 0.00 -3.07 0.00 0.00 36.82 36.99 3hgt h ILE 70 CO -0.47 0.72 0.11 -0.07 -0.69 0.00 0.00 178.15 177.75 3hgt h LEU 71 N -0.25 -0.05 -0.22 1.44 3.38 0.64 -1.56 115.31 118.69 3hgt h LEU 71 Ca -0.38 0.12 -0.01 0.00 0.09 0.00 0.00 57.88 57.70 3hgt h LEU 71 Cb 1.82 0.18 -0.00 0.00 0.09 0.00 0.00 40.66 42.75 3hgt h LEU 71 CO 0.02 -0.02 -0.05 -0.08 0.09 0.00 0.00 178.44 178.40 3hgt h GLU 72 N 0.23 0.00 -0.23 1.13 4.81 -1.35 -2.45 114.58 116.73 3hgt h GLU 72 Ca 0.32 0.00 -0.09 0.00 -0.13 0.00 0.00 59.36 59.47 3hgt h GLU 72 Cb 0.50 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.87 3hgt h GLU 72 CO -0.44 0.05 -0.23 0.77 -0.73 0.00 0.00 179.01 178.43 3hgt h SER 73 N 0.00 0.41 -0.04 1.04 0.02 -0.93 0.17 113.55 114.22 3hgt h SER 73 Ca -0.00 -0.13 -0.22 0.00 -0.84 0.00 0.00 61.79 60.60 3hgt h SER 73 Cb 0.96 -0.11 0.01 0.00 0.14 0.00 0.00 62.40 63.40 3hgt h SER 73 CO 0.01 0.65 -0.81 0.24 -1.14 0.00 0.00 176.83 175.78 3hgt h MET 74 N 0.37 0.71 0.12 3.45 2.86 -1.20 -2.76 114.93 118.49 3hgt h MET 74 Ca 0.06 -0.60 -0.01 0.00 -2.06 0.00 0.00 59.70 57.09 3hgt h MET 74 Cb 0.62 0.13 0.00 0.00 0.06 0.00 0.00 31.60 32.41 3hgt h MET 74 CO 0.04 1.21 -0.06 -0.22 1.06 0.00 0.00 176.91 178.95 3hgt h LYS 75 N 0.47 -0.16 -0.08 1.72 3.64 -1.16 -1.28 116.57 119.73 3hgt h LYS 75 Ca -0.06 0.01 -0.07 0.00 -1.27 0.00 0.00 60.65 59.26 3hgt h LYS 75 Cb 1.43 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 33.28 3hgt h LYS 75 CO 0.16 -0.06 -0.29 1.79 -2.27 0.00 0.00 179.45 178.78 3hgt h THR 76 N -0.22 1.24 -0.25 1.00 1.35 -1.05 -1.33 112.91 113.65 3hgt h THR 76 Ca -0.02 -1.15 -0.02 0.00 -0.55 0.00 0.00 66.41 64.68 3hgt h THR 76 Cb 0.18 1.51 -0.01 0.00 -1.73 0.00 0.00 68.15 68.10 3hgt h THR 76 CO 0.03 0.34 0.09 -0.03 -0.25 0.00 0.00 175.52 175.69 3hgt h MET 77 N 0.13 0.39 -0.41 4.72 1.85 -1.21 -0.09 114.93 120.31 3hgt h MET 77 Ca 0.02 -0.08 -0.07 0.00 -0.61 0.00 0.00 59.70 58.96 3hgt h MET 77 Cb 0.59 -0.06 -0.02 0.00 0.43 0.00 0.00 31.60 32.54 3hgt h MET 77 CO 0.04 0.45 -0.04 0.00 -0.40 0.00 0.00 176.91 176.96 3hgt h LEU 79 N 0.63 -0.16 -0.58 0.00 5.85 -1.10 -1.74 115.31 118.21 3hgt h LEU 79 Ca 0.12 -0.13 -0.00 0.00 0.84 0.00 0.00 57.88 58.72 3hgt h LEU 79 Cb 0.45 0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.50 3hgt h LEU 79 CO 0.02 0.03 0.36 0.78 -0.34 0.00 0.00 178.44 179.29 3hgt h ASN 80 N -0.34 0.69 -0.04 1.25 4.21 -0.90 0.59 115.58 121.03 3hgt h ASN 80 Ca -0.02 -0.05 -0.02 0.00 1.21 0.00 0.00 56.30 57.42 3hgt h ASN 80 Cb 0.27 -0.17 -0.01 0.00 -1.12 0.00 0.00 38.32 37.29 3hgt h ASN 80 CO 0.03 0.54 -0.03 1.23 -1.29 0.00 0.00 177.43 177.91 3hgt h GLY 81 N 0.79 0.20 1.37 2.83 0.00 -1.19 -2.31 103.07 104.76 3hgt h GLY 81 Ca 0.21 -0.10 -0.26 0.00 0.00 0.00 0.00 47.33 47.18 3hgt h GLY 81 CO -0.04 0.09 -1.08 1.76 0.00 0.00 0.00 176.54 177.28 3hgt h SER 82 N 0.19 0.73 -0.12 0.19 0.02 -0.33 -2.24 113.55 111.99 3hgt h SER 82 Ca 0.05 -0.63 -0.00 0.00 -0.84 0.00 0.00 61.79 60.37 3hgt h SER 82 Cb 0.18 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.49 3hgt h SER 82 CO 0.01 1.43 0.06 -0.07 -1.14 0.00 0.00 176.83 177.12 3hgt h LEU 83 N 0.28 0.16 -0.85 5.07 3.38 -0.75 -2.93 115.31 119.67 3hgt h LEU 83 Ca -0.13 -0.12 0.06 0.00 0.09 0.00 0.00 57.88 57.78 3hgt h LEU 83 Cb 1.74 -0.04 -0.06 0.00 0.09 0.00 0.00 40.66 42.38 3hgt h LEU 83 CO 0.20 0.24 0.52 0.58 0.09 0.00 0.00 178.44 180.07 3hgt h VAL 84 N 0.08 1.04 -0.41 1.22 2.07 -1.48 0.15 116.25 118.92 3hgt h VAL 84 Ca 0.04 -0.33 0.11 0.00 0.82 0.00 0.00 66.70 67.34 3hgt h VAL 84 Cb 0.12 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 29.87 3hgt h VAL 84 CO -0.01 0.18 0.29 0.00 0.02 0.00 0.00 177.57 178.05 3hgt h ALA 85 N 1.40 2.29 0.03 1.67 0.00 -1.22 -2.70 119.26 120.72 3hgt h ALA 85 Ca 0.37 -0.01 -0.35 0.00 0.00 0.00 0.00 54.91 54.91 3hgt h ALA 85 Cb 0.16 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.91 3hgt h ALA 85 CO -0.17 -0.40 -1.97 0.25 0.00 0.00 0.00 179.25 176.96 3hgt n THR 86 N -4.43 1.58 -3.64 0.00 -2.24 -0.80 -4.59 114.28 100.15 3hgt n THR 86 Ca 0.06 -0.34 -0.04 0.00 -2.27 0.00 0.00 64.05 61.46 3hgt n THR 86 Cb 0.44 -1.84 -0.07 0.00 -2.10 0.00 0.00 70.33 66.76 3hgt n THR 86 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 3hgt s HIS 87 N -2.47 -0.71 0.60 4.78 5.65 0.47 -4.50 115.29 119.11 3hgt s HIS 87 Ca -0.31 1.42 0.29 0.00 0.25 0.00 0.00 55.06 56.71 3hgt s HIS 87 Cb 0.09 0.42 1.59 0.00 -1.18 0.00 0.00 32.58 33.51 3hgt s HIS 87 CO 0.60 -0.35 2.00 -1.35 -0.65 0.00 0.00 174.74 174.99 3hgt h PRO 88 N 6.23 0.00 0.00 2.88 0.11 -1.75 -0.89 132.00 138.58 3hgt h PRO 88 Ca -0.29 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.81 3hgt h PRO 88 Cb 1.20 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.31 3hgt h PRO 88 CO 0.18 0.00 -0.07 1.88 -0.21 0.00 0.00 178.00 179.78 3hgt h TYR 89 N 0.00 0.00 0.00 0.65 0.05 -1.90 0.25 116.97 116.02 3hgt h TYR 89 Ca 0.13 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.91 3hgt h TYR 89 Cb 0.78 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.52 3hgt h TYR 89 CO 0.00 0.07 0.00 -0.07 -1.05 0.00 0.00 178.16 177.11 3hgt h LEU 90 N 0.00 0.00 0.00 3.88 3.38 -1.44 -3.33 115.31 117.80 3hgt h LEU 90 Ca -0.00 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.72 3hgt h LEU 90 Cb 0.61 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.32 3hgt h LEU 90 CO 0.01 0.00 -1.85 -0.11 0.09 0.00 0.00 178.44 176.58 3hgt n LEU 91 N -2.89 1.53 -3.99 1.67 7.94 -0.70 -4.94 117.00 115.62 3hgt n LEU 91 Ca 0.01 0.13 -0.31 0.00 -1.11 0.00 0.00 56.01 54.72 3hgt n LEU 91 Cb 0.26 -0.46 -0.15 0.00 0.53 0.00 0.00 43.42 43.60 3hgt n LEU 91 CO 0.24 0.42 -0.31 -0.63 -1.11 0.00 0.00 177.39 176.01 3hgt s ILE 92 N -2.28 2.25 0.08 1.96 1.01 0.81 -5.00 121.20 120.02 3hgt s ILE 92 Ca -0.21 -2.46 -0.21 0.00 0.00 0.00 0.00 60.65 57.78 3hgt s ILE 92 Cb 0.07 -2.65 -0.11 0.00 0.01 0.00 0.00 42.46 39.79 3hgt s ILE 92 CO 0.28 -0.64 1.58 0.44 0.00 0.00 0.00 174.94 176.60 3hgt h ASP 93 N 7.45 0.23 -3.93 3.58 5.19 -1.84 -3.40 116.42 123.70 3hgt h ASP 93 Ca -0.05 -0.22 -0.49 0.00 -0.62 0.00 0.00 57.03 55.65 3hgt h ASP 93 Cb 1.00 -0.06 0.21 0.00 0.18 0.00 0.00 39.33 40.65 3hgt h ASP 93 CO 0.54 0.39 0.15 -1.38 -3.12 0.00 0.00 179.24 175.82 3hgt s HIS 94 N -5.35 1.47 0.00 4.55 -3.43 -1.26 -1.73 115.29 109.54 3hgt s HIS 94 Ca -0.14 1.62 0.00 0.00 -0.80 0.00 0.00 55.06 55.74 3hgt s HIS 94 Cb 0.06 -3.27 0.00 0.00 -1.43 0.00 0.00 32.58 27.94 3hgt s HIS 94 CO 0.71 -3.22 0.00 0.66 -2.00 0.00 0.00 174.74 170.88 3hgt n TYR 95 N -4.51 0.00 -2.27 0.38 4.01 -1.26 -4.96 117.16 108.55 3hgt n TYR 95 Ca 0.09 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.42 3hgt n TYR 95 Cb 0.53 -0.59 -0.03 0.00 -0.31 0.00 0.00 39.34 38.94 3hgt n TYR 95 CO 0.00 0.00 0.00 1.41 -0.46 0.00 0.00 176.86 177.81 3hgt s MET 96 N -0.14 4.42 0.16 -0.72 1.75 -0.71 -4.92 119.30 119.14 3hgt s MET 96 Ca 0.00 2.00 -0.34 0.00 -1.25 0.00 0.00 55.69 56.10 3hgt s MET 96 Cb 0.00 -3.21 -0.15 0.00 2.84 0.00 0.00 34.83 34.31 3hgt s MET 96 CO 0.00 -0.20 1.30 -2.30 -0.65 0.00 0.00 175.02 173.18 3hgt n PRO 97 N 2.55 1.44 0.14 4.11 -0.02 -1.26 -4.87 135.00 137.09 3hgt n PRO 97 Ca 0.05 0.52 0.05 0.00 -2.02 0.00 0.00 63.50 62.10 3hgt n PRO 97 Cb 0.43 -2.11 0.50 0.00 -0.02 0.00 0.00 33.50 32.30 3hgt n PRO 97 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 3hgt h LYS 98 N 4.14 0.24 -5.07 -0.52 1.57 -2.00 -3.40 116.57 111.53 3hgt h LYS 98 Ca -0.45 -0.03 -0.66 0.00 -1.87 0.00 0.00 60.65 57.65 3hgt h LYS 98 Cb 1.32 -0.05 -0.34 0.00 0.08 0.00 0.00 32.23 33.23 3hgt h LYS 98 CO 0.75 0.22 -0.86 0.45 -0.57 0.00 0.00 179.45 179.44 3hgt s SER 99 N -6.89 3.01 -0.00 0.86 0.15 -1.26 -4.98 113.70 104.58 3hgt s SER 99 Ca -0.06 -0.59 0.16 0.00 0.70 0.00 0.00 55.95 56.16 3hgt s SER 99 Cb 0.17 -1.40 0.46 0.00 -1.71 0.00 0.00 66.02 63.54 3hgt s SER 99 CO 0.71 0.04 1.38 0.18 1.20 0.00 0.00 173.24 176.75 3hgt n LEU 100 N 4.29 2.80 -0.01 3.45 4.77 -1.26 -4.27 117.00 126.78 3hgt n LEU 100 Ca -0.20 -1.40 0.07 0.00 -0.03 0.00 0.00 56.01 54.44 3hgt n LEU 100 Cb 0.51 -0.35 -0.10 0.00 -2.33 0.00 0.00 43.42 41.15 3hgt n LEU 100 CO 0.26 0.69 -0.58 -0.38 -1.33 0.00 0.00 177.39 176.05 3hgt n ILE 101 N 1.01 0.00 -1.60 -0.08 5.41 -1.26 -4.69 119.36 118.15 3hgt n ILE 101 Ca 0.17 -0.29 -0.33 0.00 1.00 0.00 0.00 62.75 63.30 3hgt n ILE 101 Cb 0.45 0.30 0.07 0.00 -0.71 0.00 0.00 39.64 39.74 3hgt n ILE 101 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 176.55 176.97 3hgt s THR 102 N -2.83 2.91 0.64 1.39 -4.23 -1.26 -4.90 115.64 107.35 3hgt s THR 102 Ca -0.04 0.42 0.42 0.00 -1.18 0.00 0.00 61.69 61.31 3hgt s THR 102 Cb 0.09 -2.94 0.43 0.00 1.34 0.00 0.00 72.50 71.42 3hgt s THR 102 CO 0.55 -0.26 2.35 0.08 -0.54 0.00 0.00 174.62 176.79 3hgt h ARG 103 N -0.17 0.00 0.00 3.99 0.11 -1.97 -2.31 114.38 114.03 3hgt h ARG 103 Ca -0.47 0.00 -0.11 0.00 0.10 0.00 0.00 59.98 59.50 3hgt h ARG 103 Cb 1.26 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 32.33 3hgt h ARG 103 CO 0.52 0.00 -0.64 0.38 0.10 0.00 0.00 179.97 180.33 3hgt h ASP 104 N 0.00 0.00 -0.09 0.08 2.03 -1.98 -3.39 116.42 113.06 3hgt h ASP 104 Ca -0.00 0.00 0.03 0.00 -0.73 0.00 0.00 57.03 56.33 3hgt h ASP 104 Cb 0.01 0.00 -0.04 0.00 -0.83 0.00 0.00 39.33 38.47 3hgt h ASP 104 CO 0.00 0.47 -0.13 0.58 -1.03 0.00 0.00 179.24 179.14 3hgt h VAL 105 N 0.00 0.65 -0.89 4.15 2.07 -1.75 -2.41 116.25 118.07 3hgt h VAL 105 Ca -0.03 0.00 0.19 0.00 0.82 0.00 0.00 66.70 67.68 3hgt h VAL 105 Cb 1.39 0.65 -0.11 0.00 -1.52 0.00 0.00 31.29 31.70 3hgt h VAL 105 CO 0.06 0.00 0.44 -0.65 0.02 0.00 0.00 177.57 177.44 3hgt h PRO 106 N -0.17 0.52 0.01 1.57 0.11 -1.77 -0.62 132.00 131.66 3hgt h PRO 106 Ca 0.08 -0.03 -0.21 0.00 0.11 0.00 0.00 66.00 65.94 3hgt h PRO 106 Cb 0.28 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 31.27 3hgt h PRO 106 CO -0.19 0.35 -0.92 0.00 -0.21 0.00 0.00 178.00 177.02 3hgt h ALA 107 N 1.64 0.44 -0.86 -0.75 0.00 -1.79 -2.36 119.26 115.59 3hgt h ALA 107 Ca 0.52 -0.74 -0.03 0.00 0.00 0.00 0.00 54.91 54.67 3hgt h ALA 107 Cb 0.88 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.57 3hgt h ALA 107 CO -0.44 0.91 0.43 1.25 0.00 0.00 0.00 179.25 181.40 3hgt h HIS 108 N 0.13 1.22 -0.24 0.00 -0.00 -0.81 -1.95 115.15 113.49 3hgt h HIS 108 Ca -0.06 -0.05 -0.19 0.00 -0.00 0.00 0.00 60.37 60.07 3hgt h HIS 108 Cb 1.57 -0.38 0.00 0.00 -0.00 0.00 0.00 27.41 28.60 3hgt h HIS 108 CO 0.04 0.87 -0.58 -0.07 -0.00 0.00 0.00 177.93 178.18 3hgt h LEU 109 N 1.21 0.93 -1.21 0.26 3.38 -1.10 -3.04 115.31 115.75 3hgt h LEU 109 Ca 0.30 -0.56 -0.04 0.00 0.09 0.00 0.00 57.88 57.67 3hgt h LEU 109 Cb 0.09 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 3hgt h LEU 109 CO -0.04 1.32 0.15 0.00 0.09 0.00 0.00 178.44 179.96 3hgt h ALA 110 N 0.63 1.37 0.00 1.53 0.00 -1.40 -2.60 119.26 118.79 3hgt h ALA 110 Ca -0.00 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 54.67 3hgt h ALA 110 Cb 1.20 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 3hgt h ALA 110 CO 0.13 0.46 -0.35 1.49 0.00 0.00 0.00 179.25 180.98 3hgt h GLU 111 N 0.69 0.00 -0.12 0.00 4.81 -1.30 -3.03 114.58 115.63 3hgt h GLU 111 Ca 0.16 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.39 3hgt h GLU 111 Cb 0.20 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.58 3hgt h GLU 111 CO -0.01 0.35 0.00 0.09 -0.73 0.00 0.00 179.01 178.71 3hgt n ASN 112 N -3.71 2.97 -3.68 1.04 4.13 -1.10 -4.83 115.26 110.08 3hgt n ASN 112 Ca -0.01 -1.93 -0.20 0.00 1.68 0.00 0.00 54.58 54.12 3hgt n ASN 112 Cb 0.44 -0.06 -0.18 0.00 -1.54 0.00 0.00 39.78 38.44 3hgt n ASN 112 CO 0.00 0.00 0.00 -0.55 0.28 0.00 0.00 177.26 176.99 3hgt s SER 113 N -1.72 1.16 0.36 6.41 0.15 -1.00 -4.51 113.70 114.56 3hgt s SER 113 Ca 0.28 0.07 0.04 0.00 0.70 0.00 0.00 55.95 57.04 3hgt s SER 113 Cb 0.19 -0.16 0.69 0.00 -1.71 0.00 0.00 66.02 65.02 3hgt s SER 113 CO 0.28 -0.24 1.97 1.23 1.20 0.00 0.00 173.24 177.68 3hgt h GLY 114 N 8.41 0.67 0.87 9.45 0.00 -1.76 -1.72 103.07 118.99 3hgt h GLY 114 Ca -0.13 -0.30 -0.05 0.00 0.00 0.00 0.00 47.33 46.84 3hgt h GLY 114 CO 0.16 0.29 -0.04 1.70 0.00 0.00 0.00 176.54 178.66 3hgt h LYS 115 N 0.63 0.52 -0.85 4.80 3.64 -1.81 -1.93 116.57 121.57 3hgt h LYS 115 Ca 0.16 -0.19 0.04 0.00 -1.27 0.00 0.00 60.65 59.39 3hgt h LYS 115 Cb 0.08 -0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 31.81 3hgt h LYS 115 CO -0.02 0.71 0.56 0.74 -2.27 0.00 0.00 179.45 179.16 3hgt h PHE 116 N 0.29 1.02 0.48 1.91 0.05 -1.73 -1.90 116.94 117.06 3hgt h PHE 116 Ca 0.07 0.03 -0.02 0.00 3.82 0.00 0.00 57.97 61.87 3hgt h PHE 116 Cb 0.50 -0.34 0.00 0.00 2.00 0.00 0.00 35.95 38.11 3hgt h PHE 116 CO 0.04 0.58 -0.23 1.03 -0.18 0.00 0.00 178.31 179.56 3hgt h SER 117 N 1.05 -0.55 -0.73 2.17 0.87 -1.10 0.11 113.55 115.37 3hgt h SER 117 Ca 0.34 -0.00 0.15 0.00 -1.23 0.00 0.00 61.79 61.05 3hgt h SER 117 Cb 0.05 0.14 -0.10 0.00 -0.44 0.00 0.00 62.40 62.05 3hgt h SER 117 CO -0.10 -0.36 0.21 0.58 -0.53 0.00 0.00 176.83 176.63 3hgt h VAL 118 N -0.69 0.57 -0.68 2.23 2.07 -1.24 -0.71 116.25 117.81 3hgt h VAL 118 Ca -0.07 -0.11 -0.06 0.00 0.82 0.00 0.00 66.70 67.28 3hgt h VAL 118 Cb 0.51 0.22 -0.03 0.00 -1.52 0.00 0.00 31.29 30.48 3hgt h VAL 118 CO 0.11 0.06 0.18 0.25 0.02 0.00 0.00 177.57 178.19 3hgt h LEU 119 N 0.32 1.01 -1.12 2.57 5.85 -1.08 -1.07 115.31 121.80 3hgt h LEU 119 Ca 0.40 -0.22 -0.03 0.00 0.84 0.00 0.00 57.88 58.87 3hgt h LEU 119 Cb 0.66 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.40 3hgt h LEU 119 CO -0.46 0.97 0.24 -0.09 -0.34 0.00 0.00 178.44 178.76 3hgt h ARG 120 N 1.00 0.87 -0.18 1.25 2.43 0.35 -0.42 114.38 119.67 3hgt h ARG 120 Ca 0.21 -0.13 -0.14 0.00 -0.81 0.00 0.00 59.98 59.11 3hgt h ARG 120 Cb 0.34 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.73 3hgt h ARG 120 CO -0.00 0.71 -0.48 -0.44 -1.51 0.00 0.00 179.97 178.24 3hgt h ASP 121 N 0.86 0.53 -0.14 -3.80 3.32 -0.86 -2.71 116.42 113.60 3hgt h ASP 121 Ca 0.20 -0.26 -0.04 0.00 0.02 0.00 0.00 57.03 56.96 3hgt h ASP 121 Cb 0.16 -0.15 -0.00 0.00 0.22 0.00 0.00 39.33 39.56 3hgt h ASP 121 CO -0.02 0.93 -0.05 0.25 -1.72 0.00 0.00 179.24 178.63 3hgt h LEU 122 N 0.39 0.29 -0.97 1.55 6.46 -0.36 -3.00 115.31 119.67 3hgt h LEU 122 Ca 0.02 -0.39 0.00 0.00 -0.12 0.00 0.00 57.88 57.39 3hgt h LEU 122 Cb 0.99 -0.08 0.00 0.00 -0.73 0.00 0.00 40.66 40.84 3hgt h LEU 122 CO 0.09 0.62 0.00 0.40 -0.62 0.00 0.00 178.44 178.93 3hgt h ILE 123 N -0.03 0.00 0.00 4.05 1.08 -1.18 -1.90 117.51 119.53 3hgt h ILE 123 Ca 0.03 -0.56 -0.07 0.00 -0.39 0.00 0.00 64.86 63.87 3hgt h ILE 123 Cb 0.50 1.52 -0.01 0.00 -3.07 0.00 0.00 36.82 35.75 3hgt h ILE 123 CO 0.02 0.00 -0.33 0.78 -0.69 0.00 0.00 178.15 177.92 3hgt h ASN 124 N 0.00 0.00 0.09 1.72 -0.26 -1.34 -1.12 115.58 114.67 3hgt h ASN 124 Ca 0.00 0.00 -0.18 0.00 -0.56 0.00 0.00 56.30 55.56 3hgt h ASN 124 Cb 0.60 0.00 0.01 0.00 -1.06 0.00 0.00 38.32 37.86 3hgt h ASN 124 CO 0.00 0.33 -0.86 -0.07 -1.06 0.00 0.00 177.43 175.78 3hgt h LEU 125 N 0.00 0.31 -0.06 1.61 3.38 -1.25 -3.39 115.31 115.91 3hgt h LEU 125 Ca -0.00 -0.90 0.00 0.00 0.09 0.00 0.00 57.88 57.07 3hgt h LEU 125 Cb 0.68 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.33 3hgt h LEU 125 CO 0.04 1.39 0.00 1.62 0.09 0.00 0.00 178.44 181.58 3hgt h VAL 126 N -0.53 0.00 0.00 1.22 3.04 -1.44 -3.02 116.25 115.52 3hgt h VAL 126 Ca -0.18 -0.97 0.00 0.00 -1.01 0.00 0.00 66.70 64.54 3hgt h VAL 126 Cb 1.52 1.97 0.00 0.00 -2.01 0.00 0.00 31.29 32.77 3hgt h VAL 126 CO 0.06 0.00 0.00 0.00 -1.01 0.00 0.00 177.57 176.62 3hgt n GLN 127 N -3.08 0.06 0.00 4.17 10.64 -0.43 -1.35 117.38 127.39 3hgt n GLN 127 Ca 0.04 0.22 0.14 0.00 -1.83 0.00 0.00 57.00 55.57 3hgt n GLN 127 Cb 0.52 -1.50 0.69 0.00 -0.86 0.00 0.00 30.24 29.09 3hgt n GLN 127 CO 0.00 0.00 0.00 0.39 -1.83 0.00 0.00 177.06 175.62 3hgt n GLU 128 N -1.44 0.30 -4.40 2.61 -0.58 -1.14 -4.51 120.64 111.47 3hgt n GLU 128 Ca 0.05 0.02 -0.25 0.00 -0.42 0.00 0.00 57.16 56.55 3hgt n GLU 128 Cb 0.16 -1.50 -0.10 0.00 -0.57 0.00 0.00 31.44 29.43 3hgt n GLU 128 CO 0.00 0.00 0.00 0.71 -0.48 0.00 0.00 177.13 177.36 3hgt s TYR 129 N -2.69 2.41 -0.69 -0.32 2.02 -0.46 -5.04 117.35 112.58 3hgt s TYR 129 Ca 0.23 -0.30 -0.23 0.00 -0.37 0.00 0.00 57.07 56.40 3hgt s TYR 129 Cb 0.19 -1.11 0.07 0.00 -0.40 0.00 0.00 41.96 40.71 3hgt s TYR 129 CO 0.46 0.61 1.02 -1.21 -1.57 0.00 0.00 175.55 174.86 3hgt s GLU 130 N -3.21 3.15 0.03 -0.62 2.02 -1.26 -2.68 118.70 116.14 3hgt s GLU 130 Ca 0.27 -0.83 -0.16 0.00 0.02 0.00 0.00 54.97 54.28 3hgt s GLU 130 Cb -0.07 -4.28 0.03 0.00 0.10 0.00 0.00 34.13 29.91 3hgt s GLU 130 CO 0.14 -1.86 0.34 0.95 0.02 0.00 0.00 175.26 174.86 3hgt s THR 131 N 4.19 0.07 -0.24 3.63 -4.23 -1.06 -4.96 115.64 113.04 3hgt s THR 131 Ca 0.24 -0.57 -0.08 0.00 -1.18 0.00 0.00 61.69 60.11 3hgt s THR 131 Cb -0.15 -0.90 -0.03 0.00 1.34 0.00 0.00 72.50 72.76 3hgt s THR 131 CO 0.09 -0.31 0.08 -1.61 -0.54 0.00 0.00 174.62 172.33 3hgt s GLU 132 N -2.32 3.73 -0.10 3.99 0.41 -1.26 -1.48 118.70 121.67 3hgt s GLU 132 Ca -0.06 -0.44 0.02 0.00 -0.41 0.00 0.00 54.97 54.08 3hgt s GLU 132 Cb -0.01 -3.34 -0.01 0.00 -1.78 0.00 0.00 34.13 28.98 3hgt s GLU 132 CO -0.02 -0.12 -0.19 -0.08 -0.49 0.00 0.00 175.26 174.37 3hgt s THR 133 N 1.44 2.56 -0.12 3.63 -1.32 -0.10 -0.73 115.64 121.01 3hgt s THR 133 Ca 0.06 -0.85 -0.07 0.00 -1.21 0.00 0.00 61.69 59.62 3hgt s THR 133 Cb -0.15 -2.02 -0.04 0.00 -1.51 0.00 0.00 72.50 68.78 3hgt s THR 133 CO 0.04 0.55 0.13 0.00 -2.21 0.00 0.00 174.62 173.13 3hgt s ALA 134 N 0.20 3.85 -0.08 11.08 0.00 -0.67 -0.71 121.76 135.43 3hgt s ALA 134 Ca -0.11 -0.65 0.02 0.00 0.00 0.00 0.00 51.96 51.22 3hgt s ALA 134 Cb -0.16 -1.94 0.01 0.00 0.00 0.00 0.00 23.12 21.03 3hgt s ALA 134 CO 0.06 0.62 -0.13 0.42 0.00 0.00 0.00 175.76 176.74 3hgt s ILE 135 N -1.03 1.23 -0.10 0.00 1.01 0.11 -0.46 121.20 121.97 3hgt s ILE 135 Ca 0.15 -0.51 -0.00 0.00 0.00 0.00 0.00 60.65 60.29 3hgt s ILE 135 Cb -0.12 -1.13 -0.03 0.00 0.01 0.00 0.00 42.46 41.19 3hgt s ILE 135 CO 0.04 0.38 -0.07 -0.69 0.00 0.00 0.00 174.94 174.60 3hgt s VAL 136 N 0.81 3.66 0.24 2.92 1.01 0.18 -1.08 120.40 128.14 3hgt s VAL 136 Ca -0.12 -0.48 -0.19 0.00 0.00 0.00 0.00 61.98 61.20 3hgt s VAL 136 Cb -0.15 -2.52 0.02 0.00 0.00 0.00 0.00 36.38 33.72 3hgt s VAL 136 CO 0.02 0.56 0.63 0.00 0.00 0.00 0.00 175.10 176.31 3hgt s ARG 138 N -3.91 2.79 0.94 0.00 1.70 -1.26 -1.63 118.95 117.58 3hgt s ARG 138 Ca 0.11 1.71 -0.12 0.00 -0.47 0.00 0.00 55.73 56.96 3hgt s ARG 138 Cb -0.04 -1.92 0.15 0.00 -0.57 0.00 0.00 34.95 32.58 3hgt s ARG 138 CO 0.03 -1.32 1.13 -1.25 -1.08 0.00 0.00 175.30 172.81 3hgt s PRO 139 N -3.60 0.94 0.98 3.89 0.04 -1.26 -3.79 135.00 132.21 3hgt s PRO 139 Ca 0.74 0.33 0.00 0.00 0.04 0.00 0.00 61.00 62.12 3hgt s PRO 139 Cb -0.28 -1.81 0.00 0.00 0.04 0.00 0.00 34.50 32.45 3hgt s PRO 139 CO 0.37 -2.35 0.00 0.41 0.04 0.00 0.00 177.00 175.47 3hgt n GLY 140 N -1.94 0.90 0.23 0.56 0.00 -1.26 -4.24 105.19 99.43 3hgt n GLY 140 Ca 0.06 -1.34 0.02 0.00 0.00 0.00 0.00 46.02 44.76 3hgt n GLY 140 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3hgt h ARG 141 N 0.00 0.20 -0.96 1.61 2.43 -2.00 -2.40 114.38 113.26 3hgt h ARG 141 Ca 0.00 -0.06 0.05 0.00 -0.81 0.00 0.00 59.98 59.16 3hgt h ARG 141 Cb 0.00 -0.02 -0.06 0.00 -0.42 0.00 0.00 29.97 29.47 3hgt h ARG 141 CO 0.00 0.41 0.62 1.15 -1.51 0.00 0.00 179.97 180.64 3hgt h THR 142 N 0.18 1.13 -0.52 0.20 2.02 -1.78 -1.23 112.91 112.91 3hgt h THR 142 Ca 0.03 -0.40 -0.12 0.00 0.77 0.00 0.00 66.41 66.69 3hgt h THR 142 Cb 0.48 -0.15 -0.02 0.00 -1.74 0.00 0.00 68.15 66.72 3hgt h THR 142 CO 0.03 0.21 -0.16 -0.03 0.37 0.00 0.00 175.52 175.95 3hgt h MET 143 N 1.17 1.02 -0.09 6.66 1.85 -1.53 -1.72 114.93 122.29 3hgt h MET 143 Ca 0.40 -0.40 -0.11 0.00 -0.61 0.00 0.00 59.70 58.97 3hgt h MET 143 Cb 0.07 -0.05 -0.01 0.00 0.43 0.00 0.00 31.60 32.04 3hgt h MET 143 CO -0.14 1.09 -0.45 -0.44 -0.40 0.00 0.00 176.91 176.56 3hgt h ASP 144 N 0.88 0.22 0.37 1.39 3.32 -1.20 -2.21 116.42 119.20 3hgt h ASP 144 Ca 0.13 -0.10 -0.22 0.00 0.02 0.00 0.00 57.03 56.86 3hgt h ASP 144 Cb 0.73 -0.06 -0.00 0.00 0.22 0.00 0.00 39.33 40.22 3hgt h ASP 144 CO 0.06 0.65 -0.92 -0.07 -1.72 0.00 0.00 179.24 177.23 3hgt h LEU 145 N 0.17 0.49 -0.69 1.55 3.38 -1.17 -1.52 115.31 117.52 3hgt h LEU 145 Ca 0.01 -0.39 0.00 0.00 0.09 0.00 0.00 57.88 57.60 3hgt h LEU 145 Cb 0.87 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.44 3hgt h LEU 145 CO 0.07 1.18 0.44 0.25 0.09 0.00 0.00 178.44 180.47 3hgt h LEU 146 N 0.21 0.81 -0.15 1.67 6.46 -1.24 -0.50 115.31 122.58 3hgt h LEU 146 Ca -0.07 -0.04 -0.05 0.00 -0.12 0.00 0.00 57.88 57.60 3hgt h LEU 146 Cb 1.55 -0.20 -0.00 0.00 -0.73 0.00 0.00 40.66 41.27 3hgt h LEU 146 CO 0.16 0.60 -0.09 -0.08 -0.62 0.00 0.00 178.44 178.41 3hgt h GLU 147 N 0.94 0.32 -0.48 1.25 4.81 -1.42 -1.72 114.58 118.28 3hgt h GLU 147 Ca 0.25 -0.15 0.10 0.00 -0.13 0.00 0.00 59.36 59.43 3hgt h GLU 147 Cb -0.08 -0.01 -0.09 0.00 0.63 0.00 0.00 28.75 29.21 3hgt h GLU 147 CO -0.05 0.66 -0.10 0.00 -0.73 0.00 0.00 179.01 178.79 3hgt h ALA 148 N 0.66 0.34 0.04 2.92 0.00 -1.11 -2.01 119.26 120.09 3hgt h ALA 148 Ca 0.03 0.18 0.02 0.00 0.00 0.00 0.00 54.91 55.14 3hgt h ALA 148 Cb 0.57 0.35 -0.03 0.00 0.00 0.00 0.00 17.79 18.68 3hgt h ALA 148 CO 0.02 -0.44 -0.15 1.25 0.00 0.00 0.00 179.25 179.94 3hgt h LEU 149 N 0.02 -0.42 0.00 0.00 6.46 -1.02 -3.03 115.31 117.31 3hgt h LEU 149 Ca 0.23 0.06 0.00 0.00 -0.12 0.00 0.00 57.88 58.05 3hgt h LEU 149 Cb 0.36 0.17 0.00 0.00 -0.73 0.00 0.00 40.66 40.46 3hgt h LEU 149 CO -0.48 -0.21 0.00 0.18 -0.62 0.00 0.00 178.44 177.31 3hgt n LEU 150 N -5.28 0.00 0.00 2.25 4.77 -0.65 -1.58 117.00 116.51 3hgt n LEU 150 Ca -0.06 0.42 0.10 0.00 -0.03 0.00 0.00 56.01 56.44 3hgt n LEU 150 Cb 0.20 -0.42 0.48 0.00 -2.33 0.00 0.00 43.42 41.35 3hgt n LEU 150 CO 0.27 -0.18 0.81 0.18 -1.33 0.00 0.00 177.39 177.14 3hgt n LEU 151 N -1.42 0.00 -0.79 2.23 4.77 -0.87 -2.34 117.00 118.59 3hgt n LEU 151 Ca 0.06 0.33 0.13 0.00 -0.03 0.00 0.00 56.01 56.49 3hgt n LEU 151 Cb 0.17 -0.33 0.22 0.00 -2.33 0.00 0.00 43.42 41.15 3hgt n LEU 151 CO 0.15 -0.11 0.68 0.61 -1.33 0.00 0.00 177.39 177.38 3hgt n GLY 152 N 0.43 0.64 3.81 -0.72 0.00 -0.62 -4.92 105.19 103.81 3hgt n GLY 152 Ca 0.08 -0.61 -0.22 0.00 0.00 0.00 0.00 46.02 45.27 3hgt n GLY 152 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3hgt s ASN 153 N -2.04 5.44 -1.27 1.61 0.01 -0.99 -5.05 114.94 112.67 3hgt s ASN 153 Ca 0.30 -0.27 -0.14 0.00 -0.71 0.00 0.00 52.86 52.04 3hgt s ASN 153 Cb 0.20 -1.36 0.13 0.00 0.41 0.00 0.00 41.25 40.63 3hgt s ASN 153 CO 0.33 -0.02 1.65 0.29 -1.51 0.00 0.00 177.10 177.83 3hgt n LYS 154 N -1.07 3.32 -3.82 -0.60 4.76 -1.26 -4.91 118.16 114.58 3hgt n LYS 154 Ca -0.08 -3.55 -0.12 0.00 -2.87 0.00 0.00 58.31 51.69 3hgt n LYS 154 Cb 0.58 -3.17 -0.10 0.00 -1.84 0.00 0.00 35.03 30.50 3hgt n LYS 154 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 3hgt s VAL 155 N 2.24 0.05 0.26 -0.18 1.01 -1.26 -4.67 120.40 117.84 3hgt s VAL 155 Ca 0.46 -0.40 -0.22 0.00 0.00 0.00 0.00 61.98 61.82 3hgt s VAL 155 Cb 0.02 -0.44 -0.09 0.00 0.00 0.00 0.00 36.38 35.88 3hgt s VAL 155 CO 0.02 -0.22 0.81 -1.00 0.00 0.00 0.00 175.10 174.71 3hgt s HIS 156 N -0.84 3.66 -0.13 5.22 3.76 -0.33 -4.94 115.29 121.69 3hgt s HIS 156 Ca -0.09 1.54 0.01 0.00 -0.15 0.00 0.00 55.06 56.37 3hgt s HIS 156 Cb -0.05 -2.73 0.02 0.00 1.11 0.00 0.00 32.58 30.92 3hgt s HIS 156 CO 0.02 0.29 -0.16 0.42 -0.85 0.00 0.00 174.74 174.45 3hgt s ILE 157 N -1.56 1.65 -0.13 0.60 1.01 -1.26 0.76 121.20 122.26 3hgt s ILE 157 Ca 0.46 -0.71 -0.01 0.00 0.00 0.00 0.00 60.65 60.39 3hgt s ILE 157 Cb -0.17 -1.51 -0.02 0.00 0.01 0.00 0.00 42.46 40.77 3hgt s ILE 157 CO 0.22 0.47 -0.11 -0.54 0.00 0.00 0.00 174.94 174.98 3hgt s LYS 158 N 1.19 3.44 0.17 2.79 -0.14 -0.00 -4.96 119.74 122.22 3hgt s LYS 158 Ca -0.01 -0.65 0.08 0.00 -1.36 0.00 0.00 55.97 54.03 3hgt s LYS 158 Cb -0.14 -2.69 -0.04 0.00 -1.68 0.00 0.00 37.83 33.28 3hgt s LYS 158 CO -0.06 0.23 -0.09 1.03 -0.76 0.00 0.00 175.35 175.70 3hgt s ARG 159 N 0.34 2.11 -0.26 1.68 0.52 -1.26 0.09 118.95 122.17 3hgt s ARG 159 Ca -0.09 -1.21 0.14 0.00 -0.52 0.00 0.00 55.73 54.04 3hgt s ARG 159 Cb -0.16 -2.20 0.47 0.00 0.52 0.00 0.00 34.95 33.58 3hgt s ARG 159 CO 0.05 0.45 1.16 0.66 0.02 0.00 0.00 175.30 177.64 3hgt n TYR 160 N 0.13 1.87 -1.55 -0.53 4.01 -1.23 -4.66 117.16 115.21 3hgt n TYR 160 Ca -0.11 -2.04 0.02 0.00 -0.16 0.00 0.00 57.90 55.60 3hgt n TYR 160 Cb 0.55 -0.28 0.02 0.00 -0.31 0.00 0.00 39.34 39.32 3hgt n TYR 160 CO 0.00 0.00 0.00 -0.40 -0.46 0.00 0.00 176.86 176.00 3hgt n ASP 161 N -0.64 0.49 -0.50 7.72 3.85 -1.26 -4.85 116.55 121.36 3hgt n ASP 161 Ca 0.27 -1.98 -0.07 0.00 -0.71 0.00 0.00 54.79 52.30 3hgt n ASP 161 Cb 0.90 -0.19 -0.03 0.00 -1.35 0.00 0.00 41.12 40.45 3hgt n ASP 161 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3hgt n GLY 162 N -0.26 0.72 3.36 6.12 0.00 -1.26 -4.96 105.19 108.91 3hgt n GLY 162 Ca 0.03 -0.10 -0.18 0.00 0.00 0.00 0.00 46.02 45.76 3hgt n GLY 162 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3hgt s HIS 163 N -1.78 1.67 0.00 1.61 3.76 -1.26 -5.15 115.29 114.14 3hgt s HIS 163 Ca 0.00 -0.93 0.00 0.00 -0.15 0.00 0.00 55.06 53.98 3hgt s HIS 163 Cb 0.00 -1.00 0.00 0.00 1.11 0.00 0.00 32.58 32.69 3hgt s HIS 163 CO 0.00 -0.03 0.00 0.45 -0.85 0.00 0.00 174.74 174.31 3hgt n SER 164 N -0.49 0.00 -0.11 1.40 2.88 -1.26 -4.82 113.62 111.22 3hgt n SER 164 Ca -0.04 0.00 -0.14 0.00 -1.33 0.00 0.00 58.87 57.36 3hgt n SER 164 Cb 0.65 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 64.00 3hgt n SER 164 CO 0.00 0.00 0.00 -0.38 -1.23 0.00 0.00 175.04 173.43 3hgt n ILE 165 N -0.86 1.24 -0.40 2.46 5.41 -1.26 -5.19 119.36 120.76 3hgt n ILE 165 Ca 0.00 -0.50 0.00 0.00 1.00 0.00 0.00 62.75 63.25 3hgt n ILE 165 Cb 0.00 -1.20 0.00 0.00 -0.71 0.00 0.00 39.64 37.73 3hgt n ILE 165 CO 0.00 0.00 0.00 0.47 0.00 0.00 0.00 176.55 177.02 3hgt n ASP 173 N -3.08 0.00 -4.69 4.38 8.00 -1.26 -5.11 116.55 114.79 3hgt n ASP 173 Ca -0.37 -0.40 -0.35 0.00 0.71 0.00 0.00 54.79 54.38 3hgt n ASP 173 Cb 0.92 0.00 -0.09 0.00 -0.02 0.00 0.00 41.12 41.93 3hgt n ASP 173 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3hgt s PHE 174 N 0.79 3.21 0.30 1.24 0.40 -1.26 -5.01 117.98 117.66 3hgt s PHE 174 Ca 0.00 0.20 0.12 0.00 -0.60 0.00 0.00 56.93 56.64 3hgt s PHE 174 Cb 0.00 -1.84 0.49 0.00 0.51 0.00 0.00 43.02 42.19 3hgt s PHE 174 CO 0.00 0.45 1.69 0.66 0.70 0.00 0.00 175.22 178.72 3hgt h SER 175 N 5.34 0.00 -3.29 1.36 4.64 -1.84 -3.44 113.55 116.33 3hgt h SER 175 Ca -0.49 0.00 -0.62 0.00 -0.47 0.00 0.00 61.79 60.21 3hgt h SER 175 Cb 1.19 0.00 -0.18 0.00 -0.31 0.00 0.00 62.40 63.10 3hgt h SER 175 CO 0.56 0.53 -0.60 0.00 -0.87 0.00 0.00 176.83 176.45 3hgt s THR 177 N 0.34 3.01 -0.21 0.00 2.01 -0.55 -1.19 115.64 119.05 3hgt s THR 177 Ca 0.00 -0.68 -0.06 0.00 0.31 0.00 0.00 61.69 61.26 3hgt s THR 177 Cb -0.13 -2.25 -0.03 0.00 0.01 0.00 0.00 72.50 70.10 3hgt s THR 177 CO 0.01 0.53 0.03 -0.69 -0.69 0.00 0.00 174.62 173.81 3hgt s VAL 178 N 0.30 4.21 -0.21 3.82 1.01 0.23 -0.92 120.40 128.83 3hgt s VAL 178 Ca -0.10 -0.22 -0.09 0.00 0.00 0.00 0.00 61.98 61.57 3hgt s VAL 178 Cb -0.16 -2.93 -0.04 0.00 0.00 0.00 0.00 36.38 33.25 3hgt s VAL 178 CO 0.06 0.40 0.10 -1.00 0.00 0.00 0.00 175.10 174.66 3hgt s HIS 179 N 1.10 3.27 -0.27 5.22 0.09 0.11 -0.82 115.29 123.99 3hgt s HIS 179 Ca 0.03 0.09 -0.10 0.00 -0.00 0.00 0.00 55.06 55.08 3hgt s HIS 179 Cb -0.14 -2.17 -0.05 0.00 -0.00 0.00 0.00 32.58 30.22 3hgt s HIS 179 CO 0.02 0.08 0.16 -0.51 -0.00 0.00 0.00 174.74 174.50 3hgt s LEU 180 N 0.74 3.92 0.05 0.89 1.43 0.11 -0.71 118.68 125.11 3hgt s LEU 180 Ca 0.05 -0.04 0.09 0.00 -1.03 0.00 0.00 54.13 53.20 3hgt s LEU 180 Cb -0.13 -2.08 -0.03 0.00 0.03 0.00 0.00 46.19 43.98 3hgt s LEU 180 CO 0.02 -0.04 -0.23 -0.36 0.23 0.00 0.00 176.35 175.97 3hgt s PHE 181 N 1.67 2.41 0.38 0.29 0.08 -0.24 -3.49 117.98 119.08 3hgt s PHE 181 Ca 0.07 -0.35 -0.24 0.00 0.12 0.00 0.00 56.93 56.53 3hgt s PHE 181 Cb -0.16 -1.41 -0.10 0.00 -0.57 0.00 0.00 43.02 40.78 3hgt s PHE 181 CO 0.09 0.19 0.99 0.45 -0.10 0.00 0.00 175.22 176.83 3hgt s SER 182 N -1.36 6.99 0.07 1.36 0.15 -1.26 -1.93 113.70 117.71 3hgt s SER 182 Ca 0.13 1.87 0.25 0.00 0.70 0.00 0.00 55.95 58.90 3hgt s SER 182 Cb -0.10 -2.57 0.46 0.00 -1.71 0.00 0.00 66.02 62.10 3hgt s SER 182 CO 0.03 -0.32 1.39 -1.54 1.20 0.00 0.00 173.24 174.00 3hgt n SER 183 N -0.03 0.58 -2.09 5.45 3.41 -0.64 -4.18 113.62 116.11 3hgt n SER 183 Ca 0.05 -0.00 -0.27 0.00 -0.26 0.00 0.00 58.87 58.38 3hgt n SER 183 Cb 0.51 0.16 0.07 0.00 -0.26 0.00 0.00 64.21 64.69 3hgt n SER 183 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3hgt n GLU 184 N -1.84 2.96 0.00 4.33 1.02 -1.26 -4.66 120.64 121.19 3hgt n GLU 184 Ca 0.04 -3.62 0.00 0.00 -0.02 0.00 0.00 57.16 53.56 3hgt n GLU 184 Cb 0.39 -2.24 0.00 0.00 -0.02 0.00 0.00 31.44 29.58 3hgt n GLU 184 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3hgt n GLY 185 N -0.87 2.08 0.00 0.62 0.00 -1.26 -5.05 105.19 100.71 3hgt n GLY 185 Ca 0.52 -1.25 0.00 0.00 0.00 0.00 0.00 46.02 45.29 3hgt n GLY 185 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3hgt n ILE 186 N 2.20 0.00 -0.19 -0.61 5.41 -1.26 -4.70 119.36 120.21 3hgt n ILE 186 Ca 0.00 0.36 0.00 0.00 1.00 0.00 0.00 62.75 64.11 3hgt n ILE 186 Cb 0.00 -1.35 0.00 0.00 -0.71 0.00 0.00 39.64 37.58 3hgt n ILE 186 CO 0.00 0.00 0.00 -3.20 0.00 0.00 0.00 176.55 173.35 3hgt n ASN 187 N -2.19 -0.25 0.00 4.38 5.15 -1.26 -4.91 115.26 116.18 3hgt n ASN 187 Ca 0.00 0.00 0.10 0.00 -0.60 0.00 0.00 54.58 54.08 3hgt n ASN 187 Cb 0.00 -0.10 0.50 0.00 -0.53 0.00 0.00 39.78 39.65 3hgt n ASN 187 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 3hgt n PHE 188 N -0.15 0.00 0.49 1.20 3.72 -1.26 -1.83 117.46 119.63 3hgt n PHE 188 Ca 0.00 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.51 3hgt n PHE 188 Cb 0.06 -0.29 -0.08 0.00 -0.94 0.00 0.00 39.48 38.24 3hgt n PHE 188 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 3hgt n THR 189 N -1.29 0.08 -0.03 4.37 -2.24 -1.26 -2.31 114.28 111.61 3hgt n THR 189 Ca 0.09 -0.27 0.07 0.00 -2.27 0.00 0.00 64.05 61.67 3hgt n THR 189 Cb 0.16 0.34 -0.16 0.00 -2.10 0.00 0.00 70.33 68.57 3hgt n THR 189 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 3hgt n LYS 190 N -1.95 0.67 -3.47 -0.78 4.81 -1.16 -4.79 118.16 111.49 3hgt n LYS 190 Ca 0.01 -0.16 -0.28 0.00 -0.87 0.00 0.00 58.31 57.00 3hgt n LYS 190 Cb 0.45 -1.51 -0.11 0.00 0.02 0.00 0.00 35.03 33.88 3hgt n LYS 190 CO 0.00 0.00 0.00 0.71 1.17 0.00 0.00 177.40 179.28 3hgt s TYR 191 N -3.28 1.06 0.63 5.64 2.02 -0.76 -5.08 117.35 117.57 3hgt s TYR 191 Ca -0.08 -2.01 -0.14 0.00 -0.37 0.00 0.00 57.07 54.47 3hgt s TYR 191 Cb 0.12 -1.06 -0.02 0.00 -0.40 0.00 0.00 41.96 40.60 3hgt s TYR 191 CO 0.87 -0.82 1.05 -2.14 -1.57 0.00 0.00 175.55 172.95 3hgt s PRO 192 N 0.55 3.23 -0.11 -1.71 0.02 -0.98 -4.26 135.00 131.73 3hgt s PRO 192 Ca 0.24 1.07 -0.29 0.00 0.02 0.00 0.00 61.00 62.04 3hgt s PRO 192 Cb -0.12 -2.03 -0.03 0.00 0.02 0.00 0.00 34.50 32.34 3hgt s PRO 192 CO -0.07 -0.88 1.42 0.42 -0.33 0.00 0.00 177.00 177.56 3hgt s ILE 193 N -2.72 3.99 0.04 2.83 -1.09 -1.26 -4.90 121.20 118.09 3hgt s ILE 193 Ca 0.61 1.21 0.07 0.00 -2.23 0.00 0.00 60.65 60.31 3hgt s ILE 193 Cb -0.15 -3.78 -0.23 0.00 -1.58 0.00 0.00 42.46 36.72 3hgt s ILE 193 CO 0.44 -0.10 0.97 0.50 -1.23 0.00 0.00 174.94 175.52 3hgt h LYS 194 N 8.67 0.05 0.00 2.79 3.64 -2.00 -3.42 116.57 126.30 3hgt h LYS 194 Ca -0.32 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 58.98 3hgt h LYS 194 Cb 1.14 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.99 3hgt h LYS 194 CO 0.96 0.84 0.00 0.45 -2.27 0.00 0.00 179.45 179.43 3hgt n SER 195 N -3.26 0.00 0.00 4.20 2.88 -1.26 -4.82 113.62 111.36 3hgt n SER 195 Ca -0.09 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.45 3hgt n SER 195 Cb 1.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.46 3hgt n SER 195 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 3hgt n LYS 196 N -1.15 0.00 -4.44 -1.46 5.02 -1.26 -5.04 118.16 109.84 3hgt n LYS 196 Ca 0.00 0.00 -0.23 0.00 -2.02 0.00 0.00 58.31 56.06 3hgt n LYS 196 Cb 0.00 -0.26 -0.10 0.00 -0.02 0.00 0.00 35.03 34.65 3hgt n LYS 196 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3hgt s ALA 197 N -2.26 2.55 1.02 7.82 0.00 -1.26 -5.11 121.76 124.52 3hgt s ALA 197 Ca 0.00 -1.81 -0.15 0.00 0.00 0.00 0.00 51.96 50.00 3hgt s ALA 197 Cb 0.00 -0.22 0.06 0.00 0.00 0.00 0.00 23.12 22.96 3hgt s ALA 197 CO 0.00 0.23 0.25 0.54 0.00 0.00 0.00 175.76 176.78 3hgt n ARG 198 N -0.53 -0.78 -3.44 0.00 1.74 -1.26 -4.95 116.66 107.44 3hgt n ARG 198 Ca -0.06 -0.20 -0.38 0.00 -0.77 0.00 0.00 57.85 56.44 3hgt n ARG 198 Cb 0.60 -1.79 -0.09 0.00 -1.02 0.00 0.00 32.46 30.16 3hgt n ARG 198 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 3hgt s PHE 199 N -2.33 3.28 0.24 -1.55 0.08 -1.26 -4.28 117.98 112.15 3hgt s PHE 199 Ca 0.56 0.40 0.22 0.00 0.12 0.00 0.00 56.93 58.23 3hgt s PHE 199 Cb -0.18 -2.51 0.93 0.00 -0.57 0.00 0.00 43.02 40.70 3hgt s PHE 199 CO 0.67 -0.14 1.85 -0.44 -0.10 0.00 0.00 175.22 177.05 3hgt h ASP 200 N 7.95 0.00 -5.02 1.36 3.45 -1.30 -3.45 116.42 119.41 3hgt h ASP 200 Ca -0.34 0.00 -0.07 0.00 0.43 0.00 0.00 57.03 57.06 3hgt h ASP 200 Cb 1.17 0.00 -0.17 0.00 -0.56 0.00 0.00 39.33 39.77 3hgt h ASP 200 CO 0.65 0.27 0.01 0.00 -1.57 0.00 0.00 179.24 178.60 3hgt s MET 201 N -3.82 0.99 -0.21 3.56 0.23 -1.26 -4.24 119.30 114.56 3hgt s MET 201 Ca -0.01 -0.20 -0.02 0.00 -1.03 0.00 0.00 55.69 54.44 3hgt s MET 201 Cb 0.12 0.45 0.01 0.00 -1.53 0.00 0.00 34.83 33.88 3hgt s MET 201 CO 0.65 -0.35 -0.10 -1.17 -2.03 0.00 0.00 175.02 172.02 3hgt s LEU 202 N -1.85 2.67 -0.16 0.18 0.20 0.91 -1.67 118.68 118.96 3hgt s LEU 202 Ca -0.06 -0.58 -0.11 0.00 0.69 0.00 0.00 54.13 54.07 3hgt s LEU 202 Cb -0.01 -1.63 -0.05 0.00 -0.43 0.00 0.00 46.19 44.08 3hgt s LEU 202 CO -0.00 -0.03 0.19 -0.63 -0.29 0.00 0.00 176.35 175.59 3hgt s ILE 203 N 1.38 5.38 -0.35 6.68 1.01 0.39 -0.72 121.20 134.97 3hgt s ILE 203 Ca 0.04 0.33 -0.11 0.00 0.00 0.00 0.00 60.65 60.91 3hgt s ILE 203 Cb -0.14 -3.51 0.01 0.00 0.01 0.00 0.00 42.46 38.83 3hgt s ILE 203 CO -0.07 0.47 0.19 0.00 0.00 0.00 0.00 174.94 175.53 3hgt h LEU 205 N 8.41 -0.04 -9.93 0.00 5.85 -1.67 0.11 115.31 118.04 3hgt h LEU 205 Ca -0.28 -0.67 -0.59 0.00 0.84 0.00 0.00 57.88 57.17 3hgt h LEU 205 Cb 1.12 0.01 -0.09 0.00 0.37 0.00 0.00 40.66 42.07 3hgt h LEU 205 CO 0.65 0.71 -0.49 1.51 -0.34 0.00 0.00 178.44 180.48 3hgt s ASP 206 N -5.89 4.32 -0.00 1.25 1.47 -1.26 -4.56 116.67 111.99 3hgt s ASP 206 Ca -0.16 -1.23 0.01 0.00 1.18 0.00 0.00 52.55 52.36 3hgt s ASP 206 Cb -0.01 -0.22 0.04 0.00 -0.34 0.00 0.00 42.92 42.39 3hgt s ASP 206 CO 0.59 -0.64 0.92 0.35 0.68 0.00 0.00 175.17 177.07 3hgt n THR 207 N -1.26 0.09 0.16 2.11 -2.24 -1.26 -3.06 114.28 108.81 3hgt n THR 207 Ca -0.04 -0.07 0.06 0.00 -2.27 0.00 0.00 64.05 61.73 3hgt n THR 207 Cb 0.65 -0.10 0.06 0.00 -2.10 0.00 0.00 70.33 68.85 3hgt n THR 207 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hgt h THR 208 N 0.25 0.48 -3.11 4.28 1.03 -1.97 -3.45 112.91 110.43 3hgt h THR 208 Ca 0.00 -1.70 -0.55 0.00 -0.01 0.00 0.00 66.41 64.14 3hgt h THR 208 Cb 0.19 2.19 -0.03 0.00 -1.07 0.00 0.00 68.15 69.43 3hgt h THR 208 CO 0.01 0.27 0.69 -0.69 -0.01 0.00 0.00 175.52 175.79 3hgt s VAL 209 N -3.07 4.37 -0.45 0.00 1.01 -1.17 -4.85 120.40 116.23 3hgt s VAL 209 Ca 0.04 1.68 -0.10 0.00 0.00 0.00 0.00 61.98 63.60 3hgt s VAL 209 Cb 0.07 -4.08 0.10 0.00 0.00 0.00 0.00 36.38 32.46 3hgt s VAL 209 CO 0.73 -0.02 0.32 -0.62 0.00 0.00 0.00 175.10 175.51 3hgt s ASP 210 N 1.43 5.73 0.00 3.32 2.15 -1.26 -4.95 116.67 123.09 3hgt s ASP 210 Ca 0.54 -1.67 0.16 0.00 0.43 0.00 0.00 52.55 52.01 3hgt s ASP 210 Cb -0.23 -2.02 0.71 0.00 -0.30 0.00 0.00 42.92 41.07 3hgt s ASP 210 CO 0.20 -0.63 1.52 0.35 -0.17 0.00 0.00 175.17 176.44 3hgt n THR 211 N 4.95 0.85 0.47 1.71 -2.24 -1.26 -2.40 114.28 116.37 3hgt n THR 211 Ca -0.10 0.21 0.12 0.00 -2.27 0.00 0.00 64.05 62.02 3hgt n THR 211 Cb 0.42 -0.93 0.17 0.00 -2.10 0.00 0.00 70.33 67.88 3hgt n THR 211 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 3hgt h SER 212 N 0.00 0.00 -4.22 3.42 4.64 -1.96 -3.36 113.55 112.06 3hgt h SER 212 Ca 0.00 -0.14 -0.53 0.00 -0.47 0.00 0.00 61.79 60.65 3hgt h SER 212 Cb 0.27 0.00 0.19 0.00 -0.31 0.00 0.00 62.40 62.55 3hgt h SER 212 CO 0.00 0.07 0.31 -1.58 -0.87 0.00 0.00 176.83 174.76 3hgt s GLN 213 N -3.20 1.44 0.24 4.77 2.00 -1.01 -4.80 119.66 119.11 3hgt s GLN 213 Ca 0.06 1.71 -0.03 0.00 -2.00 0.00 0.00 55.36 55.09 3hgt s GLN 213 Cb 0.12 -1.76 0.27 0.00 0.80 0.00 0.00 33.01 32.45 3hgt s GLN 213 CO 0.72 -2.35 1.73 -0.22 -0.50 0.00 0.00 175.29 174.66 3hgt h LYS 214 N -1.19 0.83 -0.31 1.67 3.64 -1.91 -2.48 116.57 116.83 3hgt h LYS 214 Ca -0.45 -0.24 -0.09 0.00 -1.27 0.00 0.00 60.65 58.60 3hgt h LYS 214 Cb 1.29 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 33.01 3hgt h LYS 214 CO 0.45 0.85 -0.17 0.38 -2.27 0.00 0.00 179.45 178.69 3hgt h ASP 215 N 0.77 0.55 0.73 4.20 -0.00 -1.95 -1.85 116.42 118.86 3hgt h ASP 215 Ca 0.14 -0.16 -0.24 0.00 -0.00 0.00 0.00 57.03 56.77 3hgt h ASP 215 Cb 0.50 -0.15 -0.01 0.00 -0.00 0.00 0.00 39.33 39.68 3hgt h ASP 215 CO 0.03 0.73 -1.09 0.40 -0.00 0.00 0.00 179.24 179.31 3hgt h ILE 216 N 0.50 1.56 0.00 4.15 5.03 -1.83 -3.00 117.51 123.93 3hgt h ILE 216 Ca 0.08 -3.08 -0.05 0.00 -0.12 0.00 0.00 64.86 61.70 3hgt h ILE 216 Cb 0.58 2.81 -0.01 0.00 -3.03 0.00 0.00 36.82 37.18 3hgt h ILE 216 CO 0.04 0.89 -0.22 1.56 -0.68 0.00 0.00 178.15 179.75 3hgt h GLN 217 N 0.06 0.00 -0.12 2.37 1.08 -1.34 -1.02 115.11 116.14 3hgt h GLN 217 Ca -0.08 0.00 -0.04 0.00 -1.45 0.00 0.00 58.65 57.09 3hgt h GLN 217 Cb 1.81 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 29.24 3hgt h GLN 217 CO 0.17 0.22 -0.06 -0.92 -0.95 0.00 0.00 178.83 177.28 3hgt h TYR 218 N 0.00 0.30 -0.87 2.96 5.03 -1.29 -3.09 116.97 120.01 3hgt h TYR 218 Ca -0.00 -0.08 -0.03 0.00 2.58 0.00 0.00 58.73 61.21 3hgt h TYR 218 Cb 0.54 -0.07 -0.04 0.00 1.55 0.00 0.00 36.73 38.71 3hgt h TYR 218 CO 0.00 0.61 0.44 -0.07 -1.32 0.00 0.00 178.16 177.82 3hgt h LEU 219 N -0.09 1.11 -1.92 2.82 3.38 -1.29 -2.85 115.31 116.47 3hgt h LEU 219 Ca 0.03 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 3hgt h LEU 219 Cb 0.53 -0.29 -0.00 0.00 0.09 0.00 0.00 40.66 40.99 3hgt h LEU 219 CO 0.02 0.92 -0.06 -0.07 0.09 0.00 0.00 178.44 179.34 3hgt h LEU 220 N 1.23 0.00 -6.56 1.67 3.38 -1.23 -3.31 115.31 110.49 3hgt h LEU 220 Ca 0.30 0.00 -0.63 0.00 0.09 0.00 0.00 57.88 57.64 3hgt h LEU 220 Cb 0.08 0.00 -0.40 0.00 0.09 0.00 0.00 40.66 40.43 3hgt h LEU 220 CO -0.04 0.06 -0.41 0.00 0.09 0.00 0.00 178.44 178.13 3hgt n GLN 221 N -3.27 2.58 -0.63 1.13 6.02 -1.08 -2.01 117.38 120.12 3hgt n GLN 221 Ca -0.01 -4.61 0.09 0.00 -0.01 0.00 0.00 57.00 52.46 3hgt n GLN 221 Cb 0.24 -2.30 0.36 0.00 1.02 0.00 0.00 30.24 29.56 3hgt n GLN 221 CO 0.00 0.00 0.00 0.98 -1.01 0.00 0.00 177.06 177.03 3hgt n TYR 222 N 1.26 1.52 0.00 1.08 9.36 -1.25 -4.93 117.16 124.21 3hgt n TYR 222 Ca 0.27 -0.62 0.00 0.00 3.32 0.00 0.00 57.90 60.87 3hgt n TYR 222 Cb 0.39 -0.26 0.00 0.00 -0.63 0.00 0.00 39.34 38.84 3hgt n TYR 222 CO 0.00 0.00 0.00 1.17 0.22 0.00 0.00 176.86 178.25 3hgt n LYS 223 N 1.12 0.00 -3.65 2.98 4.81 -1.26 -4.41 118.16 117.75 3hgt n LYS 223 Ca 0.26 0.00 0.02 0.00 -0.87 0.00 0.00 58.31 57.72 3hgt n LYS 223 Cb 0.91 0.00 -0.06 0.00 0.02 0.00 0.00 35.03 35.90 3hgt n LYS 223 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3hgt s ALA 233 N 0.00 -2.64 0.37 3.14 0.00 -0.85 -5.15 121.76 116.62 3hgt s ALA 233 Ca 0.00 1.92 -0.28 0.00 0.00 0.00 0.00 51.96 53.61 3hgt s ALA 233 Cb 0.00 -1.98 -0.10 0.00 0.00 0.00 0.00 23.12 21.04 3hgt s ALA 233 CO 0.00 -0.28 1.34 -2.14 0.00 0.00 0.00 175.76 174.68 3hgt s PRO 234 N 0.88 4.17 -0.24 0.00 0.02 -1.26 -4.71 135.00 133.85 3hgt s PRO 234 Ca -0.06 2.26 -0.10 0.00 0.02 0.00 0.00 61.00 63.12 3hgt s PRO 234 Cb -0.02 -2.94 -0.05 0.00 0.02 0.00 0.00 34.50 31.51 3hgt s PRO 234 CO -0.10 -0.36 0.15 0.42 -0.33 0.00 0.00 177.00 176.78 3hgt s ILE 235 N -1.18 5.26 -0.15 2.83 1.01 0.23 -0.06 121.20 129.14 3hgt s ILE 235 Ca 0.52 0.15 0.00 0.00 0.00 0.00 0.00 60.65 61.33 3hgt s ILE 235 Cb -0.40 -3.45 -0.00 0.00 0.01 0.00 0.00 42.46 38.61 3hgt s ILE 235 CO 0.53 0.35 -0.16 0.54 0.00 0.00 0.00 174.94 176.21 3hgt s VAL 236 N 1.07 2.69 -0.27 2.92 0.11 0.10 -0.05 120.40 126.97 3hgt s VAL 236 Ca 0.07 -0.77 -0.07 0.00 -2.93 0.00 0.00 61.98 58.28 3hgt s VAL 236 Cb -0.14 -2.13 -0.01 0.00 -1.53 0.00 0.00 36.38 32.58 3hgt s VAL 236 CO 0.04 0.52 0.08 -0.13 -3.33 0.00 0.00 175.10 172.28 3hgt s ARG 237 N 0.69 3.41 -0.44 1.54 0.52 0.17 -0.38 118.95 124.46 3hgt s ARG 237 Ca -0.07 -0.64 -0.29 0.00 -0.52 0.00 0.00 55.73 54.21 3hgt s ARG 237 Cb -0.16 -3.35 0.02 0.00 0.52 0.00 0.00 34.95 31.98 3hgt s ARG 237 CO 0.02 -0.30 1.34 -0.51 0.02 0.00 0.00 175.30 175.87 3hgt s LEU 238 N 1.57 3.59 -0.24 2.53 1.43 0.37 -0.13 118.68 127.79 3hgt s LEU 238 Ca 0.05 0.71 0.02 0.00 -1.03 0.00 0.00 54.13 53.87 3hgt s LEU 238 Cb -0.16 -3.53 0.06 0.00 0.03 0.00 0.00 46.19 42.59 3hgt s LEU 238 CO 0.03 -1.40 -0.09 -0.69 0.23 0.00 0.00 176.35 174.43 3hgt s VAL 239 N 5.20 1.89 -0.05 -1.59 1.01 -0.91 -4.68 120.40 121.27 3hgt s VAL 239 Ca 0.57 -1.42 -0.30 0.00 0.00 0.00 0.00 61.98 60.84 3hgt s VAL 239 Cb -0.12 -2.05 -0.06 0.00 0.00 0.00 0.00 36.38 34.16 3hgt s VAL 239 CO 0.32 -0.03 1.71 0.00 0.00 0.00 0.00 175.10 177.11 3hgt s ALA 240 N 1.24 3.58 0.28 5.51 0.00 -1.26 -0.06 121.76 131.05 3hgt s ALA 240 Ca -0.07 0.97 -0.30 0.00 0.00 0.00 0.00 51.96 52.56 3hgt s ALA 240 Cb -0.19 -3.77 -0.11 0.00 0.00 0.00 0.00 23.12 19.05 3hgt s ALA 240 CO -0.06 -1.47 1.58 0.42 0.00 0.00 0.00 175.76 176.24 3hgt s ILE 241 N 4.21 2.15 -0.66 0.00 -1.09 -0.71 -2.39 121.20 122.71 3hgt s ILE 241 Ca 0.76 0.12 0.00 0.00 -2.23 0.00 0.00 60.65 59.30 3hgt s ILE 241 Cb -0.34 -3.08 0.00 0.00 -1.58 0.00 0.00 42.46 37.46 3hgt s ILE 241 CO 0.31 0.02 0.00 0.59 -1.23 0.00 0.00 174.94 174.63 3hgt n ASN 242 N 2.35 -4.58 -5.01 3.58 3.02 -1.26 -0.52 115.26 112.83 3hgt n ASN 242 Ca 0.09 0.15 -0.21 0.00 -0.03 0.00 0.00 54.58 54.58 3hgt n ASN 242 Cb 0.38 -2.63 0.05 0.00 -0.61 0.00 0.00 39.78 36.97 3hgt n ASN 242 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 3hgt s SER 243 N -2.45 4.94 0.40 6.41 1.04 -1.01 -4.60 113.70 118.44 3hgt s SER 243 Ca 0.00 -0.99 0.15 0.00 0.48 0.00 0.00 55.95 55.59 3hgt s SER 243 Cb 0.00 0.45 1.02 0.00 0.10 0.00 0.00 66.02 67.59 3hgt s SER 243 CO 0.00 -1.36 1.86 -0.29 0.98 0.00 0.00 173.24 174.43 3hgt h ILE 244 N 0.24 0.72 0.08 -1.02 6.09 -1.88 -1.45 117.51 120.29 3hgt h ILE 244 Ca -0.30 -0.16 0.01 0.00 -1.37 0.00 0.00 64.86 63.04 3hgt h ILE 244 Cb 1.29 0.21 -0.02 0.00 0.47 0.00 0.00 36.82 38.77 3hgt h ILE 244 CO 0.44 0.09 -0.16 0.44 -3.07 0.00 0.00 178.15 175.89 3hgt h ASP 245 N 0.47 -0.43 -0.58 2.19 3.32 -1.93 0.14 116.42 119.60 3hgt h ASP 245 Ca 0.46 0.05 0.05 0.00 0.02 0.00 0.00 57.03 57.61 3hgt h ASP 245 Cb 1.04 0.17 -0.03 0.00 0.22 0.00 0.00 39.33 40.72 3hgt h ASP 245 CO -0.18 -0.22 0.39 -0.74 -1.72 0.00 0.00 179.24 176.76 3hgt h HIS 246 N -0.30 0.59 -0.04 4.55 2.76 -1.47 -1.30 115.15 119.94 3hgt h HIS 246 Ca 0.03 0.01 -0.16 0.00 -2.20 0.00 0.00 60.37 58.06 3hgt h HIS 246 Cb 0.32 -0.19 0.01 0.00 1.55 0.00 0.00 27.41 29.10 3hgt h HIS 246 CO -0.17 0.32 -0.59 0.00 -1.30 0.00 0.00 177.93 176.19 3hgt h ARG 248 N -0.00 0.35 0.37 0.00 3.08 -0.54 -1.10 114.38 116.54 3hgt h ARG 248 Ca -0.06 -0.09 -0.00 0.00 0.07 0.00 0.00 59.98 59.90 3hgt h ARG 248 Cb 1.28 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 31.26 3hgt h ARG 248 CO 0.12 0.47 -0.34 -0.07 -1.07 0.00 0.00 179.97 179.08 3hgt h LEU 249 N 0.17 -0.92 -0.14 3.04 -0.00 -1.33 0.18 115.31 116.31 3hgt h LEU 249 Ca 0.07 0.08 -0.02 0.00 -0.00 0.00 0.00 57.88 58.00 3hgt h LEU 249 Cb 0.28 0.31 -0.01 0.00 -0.00 0.00 0.00 40.66 41.24 3hgt h LEU 249 CO 0.00 -0.49 -0.00 0.15 -0.00 0.00 0.00 178.44 178.10 3hgt h PHE 250 N -0.73 0.28 0.00 1.13 3.04 -1.37 -2.86 116.94 116.43 3hgt h PHE 250 Ca -0.03 -0.05 0.00 0.00 3.98 0.00 0.00 57.97 61.87 3hgt h PHE 250 Cb 0.65 -0.07 0.00 0.00 2.56 0.00 0.00 35.95 39.09 3hgt h PHE 250 CO -0.19 0.49 0.00 0.74 -2.02 0.00 0.00 178.31 177.33 3hgt h PHE 251 N -0.01 0.00 -0.45 0.41 0.04 -1.26 -3.08 116.94 112.59 3hgt h PHE 251 Ca 0.04 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.81 3hgt h PHE 251 Cb 0.38 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.51 3hgt h PHE 251 CO 0.04 0.00 0.30 0.78 -0.60 0.00 0.00 178.31 178.82 3hgt h GLY 252 N 3.68 0.63 0.00 -1.45 0.00 -0.39 -0.15 103.07 105.39 3hgt h GLY 252 Ca 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 47.33 47.10 3hgt h GLY 252 CO 0.00 0.23 0.00 0.28 0.00 0.00 0.00 176.54 177.05 3hgt n LYS 253 N -4.47 0.00 0.00 4.80 5.02 -1.17 -2.66 118.16 119.69 3hgt n LYS 253 Ca 0.04 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.33 3hgt n LYS 253 Cb 0.06 -0.31 0.00 0.00 -0.02 0.00 0.00 35.03 34.76 3hgt n LYS 253 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3hgt n LYS 254 N 0.00 0.00 0.00 1.97 4.76 -1.15 -2.15 118.16 121.59 3hgt n LYS 254 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 3hgt n LYS 254 Cb 0.00 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.19 3hgt n LYS 254 CO 0.00 0.00 0.00 1.19 -1.37 0.00 0.00 177.40 177.22 3hgt n PHE 255 N -0.72 0.00 -1.33 2.13 3.72 -0.08 -5.10 117.46 116.08 3hgt n PHE 255 Ca 0.00 0.00 0.17 0.00 -0.05 0.00 0.00 57.45 57.57 3hgt n PHE 255 Cb 0.00 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 38.48 3hgt n PHE 255 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 3hgt n ASP 256 N -1.36 -7.65 -0.11 4.37 2.03 -0.91 -4.61 116.55 108.31 3hgt n ASP 256 Ca 0.00 0.85 0.00 0.00 0.52 0.00 0.00 54.79 56.16 3hgt n ASP 256 Cb 0.00 -4.26 0.00 0.00 -0.72 0.00 0.00 41.12 36.14 3hgt n ASP 256 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 3hgt n LYS 257 N -3.99 0.00 -0.93 -0.67 5.02 -1.26 -2.58 118.16 113.74 3hgt n LYS 257 Ca -0.03 0.00 -0.14 0.00 -2.02 0.00 0.00 58.31 56.12 3hgt n LYS 257 Cb 0.66 0.00 -0.02 0.00 -0.02 0.00 0.00 35.03 35.65 3hgt n LYS 257 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3hgt n ASN 258 N -3.75 6.06 -4.49 4.39 3.02 -1.26 -4.87 115.26 114.36 3hgt n ASN 258 Ca 0.00 -2.87 -0.32 0.00 -0.03 0.00 0.00 54.58 51.36 3hgt n ASN 258 Cb 0.00 -1.16 0.14 0.00 -0.61 0.00 0.00 39.78 38.16 3hgt n ASN 258 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 3hgt n SER 259 N 0.99 -1.34 0.25 6.41 2.88 -1.07 -4.88 113.62 116.86 3hgt n SER 259 Ca 0.29 0.31 -0.10 0.00 -1.33 0.00 0.00 58.87 58.04 3hgt n SER 259 Cb 0.60 -1.28 -0.05 0.00 -0.75 0.00 0.00 64.21 62.74 3hgt n SER 259 CO 0.00 0.00 0.00 -0.09 -1.23 0.00 0.00 175.04 173.72 3hgt h ARG 260 N -1.74 -0.60 0.00 -1.46 2.43 -1.92 -3.13 114.38 107.95 3hgt h ARG 260 Ca -0.45 0.04 0.00 0.00 -0.81 0.00 0.00 59.98 58.77 3hgt h ARG 260 Cb 1.28 0.14 0.00 0.00 -0.42 0.00 0.00 29.97 30.97 3hgt h ARG 260 CO 0.37 -0.40 0.00 0.93 -1.51 0.00 0.00 179.97 179.36 3hgt h GLU 261 N -0.67 0.00 0.35 0.20 5.08 -1.94 -2.86 114.58 114.74 3hgt h GLU 261 Ca -0.06 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.28 3hgt h GLU 261 Cb 0.48 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.73 3hgt h GLU 261 CO 0.11 0.00 -0.17 -0.92 -1.00 0.00 0.00 179.01 177.03 3hgt h TYR 262 N 0.00 -0.44 -0.99 4.33 5.03 -1.86 -1.02 116.97 122.02 3hgt h TYR 262 Ca 0.00 -0.01 0.18 0.00 2.58 0.00 0.00 58.73 61.48 3hgt h TYR 262 Cb 0.19 0.14 -0.10 0.00 1.55 0.00 0.00 36.73 38.52 3hgt h TYR 262 CO 0.00 -0.27 0.62 1.25 -1.32 0.00 0.00 178.16 178.43 3hgt h LEU 263 N -0.70 0.77 -0.05 2.82 6.46 -1.45 -0.49 115.31 122.67 3hgt h LEU 263 Ca -0.05 0.08 -0.02 0.00 -0.12 0.00 0.00 57.88 57.77 3hgt h LEU 263 Cb 0.36 -0.06 -0.00 0.00 -0.73 0.00 0.00 40.66 40.23 3hgt h LEU 263 CO 0.08 0.31 -0.06 -0.33 -0.62 0.00 0.00 178.44 177.81 3hgt h GLU 264 N 0.77 0.13 -0.57 1.25 5.08 -1.57 -2.40 114.58 117.27 3hgt h GLU 264 Ca 0.55 -0.07 -0.05 0.00 -1.00 0.00 0.00 59.36 58.78 3hgt h GLU 264 Cb 0.85 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 30.08 3hgt h GLU 264 CO -0.33 0.61 0.14 -0.91 -1.00 0.00 0.00 179.01 177.52 3hgt h ASN 265 N -0.35 0.81 -0.42 1.42 2.35 -0.60 -1.15 115.58 117.64 3hgt h ASN 265 Ca 0.01 -0.15 -0.11 0.00 -0.55 0.00 0.00 56.30 55.49 3hgt h ASN 265 Cb 0.60 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.74 3hgt h ASN 265 CO 0.01 0.80 -0.15 0.58 -1.65 0.00 0.00 177.43 177.02 3hgt h VAL 266 N 0.84 1.27 0.12 2.81 2.07 -1.12 -1.71 116.25 120.52 3hgt h VAL 266 Ca 0.18 -1.28 -0.28 0.00 0.82 0.00 0.00 66.70 66.15 3hgt h VAL 266 Cb 0.30 1.06 0.02 0.00 -1.52 0.00 0.00 31.29 31.15 3hgt h VAL 266 CO -0.00 0.44 -1.22 0.71 0.02 0.00 0.00 177.57 177.52 3hgt h THR 267 N 0.80 1.40 -0.69 2.57 1.35 -1.24 -1.81 112.91 115.29 3hgt h THR 267 Ca 0.12 -2.75 -0.01 0.00 -0.55 0.00 0.00 66.41 63.23 3hgt h THR 267 Cb 0.69 2.80 -0.03 0.00 -1.73 0.00 0.00 68.15 69.87 3hgt h THR 267 CO 0.05 0.81 0.41 0.00 -0.25 0.00 0.00 175.52 176.54 3hgt h ALA 268 N 0.49 0.88 -0.19 6.62 0.00 -1.20 -1.35 119.26 124.51 3hgt h ALA 268 Ca -0.15 -0.09 -0.19 0.00 0.00 0.00 0.00 54.91 54.48 3hgt h ALA 268 Cb 1.91 -0.28 0.01 0.00 0.00 0.00 0.00 17.79 19.43 3hgt h ALA 268 CO 0.21 0.36 -0.61 0.00 0.00 0.00 0.00 179.25 179.21 3hgt h ALA 269 N 1.21 0.33 -0.12 0.00 0.00 -1.38 0.31 119.26 119.61 3hgt h ALA 269 Ca 0.25 -0.54 0.04 0.00 0.00 0.00 0.00 54.91 54.66 3hgt h ALA 269 Cb -0.01 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.70 3hgt h ALA 269 CO -0.04 0.58 -0.16 1.98 0.00 0.00 0.00 179.25 181.61 3hgt h MET 270 N 0.46 -0.19 -0.20 0.00 4.05 -1.22 0.31 114.93 118.14 3hgt h MET 270 Ca -0.02 0.01 -0.01 0.00 -0.28 0.00 0.00 59.70 59.40 3hgt h MET 270 Cb 1.23 0.04 -0.01 0.00 -0.80 0.00 0.00 31.60 32.07 3hgt h MET 270 CO 0.13 -0.13 0.08 0.28 0.23 0.00 0.00 176.91 177.50 3hgt h VAL 271 N -0.20 1.17 -0.21 -5.77 2.07 -1.22 -2.94 116.25 109.14 3hgt h VAL 271 Ca 0.09 -0.51 -0.18 0.00 0.82 0.00 0.00 66.70 66.93 3hgt h VAL 271 Cb 0.33 1.13 0.00 0.00 -1.52 0.00 0.00 31.29 31.23 3hgt h VAL 271 CO -0.24 0.16 -0.55 0.40 0.02 0.00 0.00 177.57 177.37 3hgt h ILE 272 N 0.17 1.30 0.00 4.57 2.04 -0.73 -2.89 117.51 121.97 3hgt h ILE 272 Ca 0.07 -1.76 0.00 0.00 1.00 0.00 0.00 64.86 64.16 3hgt h ILE 272 Cb 0.18 1.84 0.00 0.00 -0.74 0.00 0.00 36.82 38.10 3hgt h ILE 272 CO -0.00 0.56 0.00 0.18 0.00 0.00 0.00 178.15 178.88 3hgt n LEU 273 N -4.09 0.00 0.13 1.44 4.77 0.11 -4.09 117.00 115.27 3hgt n LEU 273 Ca -0.06 0.00 0.09 0.00 -0.03 0.00 0.00 56.01 56.01 3hgt n LEU 273 Cb 0.63 0.00 0.48 0.00 -2.33 0.00 0.00 43.42 42.19 3hgt n LEU 273 CO 0.49 0.00 0.78 -1.14 -1.33 0.00 0.00 177.39 176.19 3hgt n ARG 274 N -0.98 0.12 0.01 3.23 0.63 -1.09 -0.67 116.66 117.91 3hgt n ARG 274 Ca 0.19 0.57 0.11 0.00 -0.92 0.00 0.00 57.85 57.80 3hgt n ARG 274 Cb 0.08 -1.86 0.02 0.00 0.45 0.00 0.00 32.46 31.15 3hgt n ARG 274 CO 0.00 0.00 0.00 -0.40 -2.51 0.00 0.00 177.63 174.72 3hgt n ASP 275 N -2.12 0.73 -1.08 6.15 5.68 -1.26 -4.07 116.55 120.59 3hgt n ASP 275 Ca -0.01 -0.57 -0.02 0.00 -0.50 0.00 0.00 54.79 53.69 3hgt n ASP 275 Cb 0.06 0.75 0.20 0.00 -1.14 0.00 0.00 41.12 41.00 3hgt n ASP 275 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 3hgt n ARG 276 N -1.62 1.86 -1.85 0.11 1.74 0.16 -5.04 116.66 112.03 3hgt n ARG 276 Ca 0.04 -3.17 -0.42 0.00 -0.77 0.00 0.00 57.85 53.53 3hgt n ARG 276 Cb 0.36 -1.80 -0.02 0.00 -1.02 0.00 0.00 32.46 29.99 3hgt n ARG 276 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3hgt s LEU 277 N -3.22 4.36 -1.37 0.55 1.43 -1.16 -3.96 118.68 115.30 3hgt s LEU 277 Ca 0.44 2.85 0.00 0.00 -1.03 0.00 0.00 54.13 56.39 3hgt s LEU 277 Cb 0.40 -3.63 0.00 0.00 0.03 0.00 0.00 46.19 42.99 3hgt s LEU 277 CO -0.00 -0.85 0.00 0.61 0.23 0.00 0.00 176.35 176.33 3hgt n GLY 278 N 2.36 1.24 3.45 -3.19 0.00 0.32 -4.74 105.19 104.63 3hgt n GLY 278 Ca 0.09 -0.01 -0.34 0.00 0.00 0.00 0.00 46.02 45.76 3hgt n GLY 278 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3hgt s THR 279 N -2.11 3.68 0.41 2.61 -4.23 -1.25 -3.17 115.64 111.59 3hgt s THR 279 Ca 0.00 -0.43 -0.19 0.00 -1.18 0.00 0.00 61.69 59.90 3hgt s THR 279 Cb 0.00 -2.61 -0.10 0.00 1.34 0.00 0.00 72.50 71.13 3hgt s THR 279 CO 0.00 0.49 0.89 -0.76 -0.54 0.00 0.00 174.62 174.70 3hgt s LEU 280 N 0.52 3.94 0.49 4.79 1.43 -1.26 -4.97 118.68 123.62 3hgt s LEU 280 Ca -0.04 1.55 -0.24 0.00 -1.03 0.00 0.00 54.13 54.37 3hgt s LEU 280 Cb -0.15 -4.40 -0.07 0.00 0.03 0.00 0.00 46.19 41.61 3hgt s LEU 280 CO 0.03 -0.34 1.41 -2.84 0.23 0.00 0.00 176.35 174.84 3hgt s PRO 281 N -3.24 3.47 0.54 1.29 0.02 -1.26 -4.86 135.00 130.95 3hgt s PRO 281 Ca 0.59 2.38 0.27 0.00 0.02 0.00 0.00 61.00 64.26 3hgt s PRO 281 Cb -0.09 -2.51 1.44 0.00 0.02 0.00 0.00 34.50 33.36 3hgt s PRO 281 CO 0.17 -0.98 1.97 -1.35 -0.33 0.00 0.00 177.00 176.48 3hgt h PRO 282 N 1.99 0.00 0.00 5.54 0.11 -2.02 -0.41 132.00 137.21 3hgt h PRO 282 Ca -0.51 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3hgt h PRO 282 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 3hgt h PRO 282 CO 0.60 0.00 0.00 0.38 -0.21 0.00 0.00 178.00 178.77 3hgt h ASP 283 N 0.00 0.00 1.14 -2.05 2.03 -2.05 -2.98 116.42 112.51 3hgt h ASP 283 Ca 0.27 0.00 -0.15 0.00 -0.73 0.00 0.00 57.03 56.42 3hgt h ASP 283 Cb 1.11 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 39.59 3hgt h ASP 283 CO -0.00 0.00 -0.90 -0.07 -1.03 0.00 0.00 179.24 177.24 3hgt h LEU 284 N 0.00 0.00 -1.37 0.15 -0.00 -1.41 -3.41 115.31 109.27 3hgt h LEU 284 Ca 0.00 0.00 0.11 0.00 -0.00 0.00 0.00 57.88 57.99 3hgt h LEU 284 Cb 0.65 0.00 -0.06 0.00 -0.00 0.00 0.00 40.66 41.25 3hgt h LEU 284 CO 0.00 0.62 0.52 0.03 -0.00 0.00 0.00 178.44 179.61 3hgt h ARG 285 N 0.00 0.67 -0.13 1.13 3.08 -1.56 -1.98 114.38 115.59 3hgt h ARG 285 Ca -0.06 -0.04 -0.17 0.00 0.07 0.00 0.00 59.98 59.78 3hgt h ARG 285 Cb 1.53 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 31.42 3hgt h ARG 285 CO 0.07 0.44 -0.63 -1.35 -1.07 0.00 0.00 179.97 177.44 3hgt h PRO 286 N 0.69 0.45 -1.00 0.04 0.11 -1.78 -1.01 132.00 129.49 3hgt h PRO 286 Ca 0.38 -0.32 0.05 0.00 0.11 0.00 0.00 66.00 66.22 3hgt h PRO 286 Cb 0.52 0.05 -0.06 0.00 0.11 0.00 0.00 31.00 31.62 3hgt h PRO 286 CO -0.15 0.93 0.65 0.82 -0.21 0.00 0.00 178.00 180.05 3hgt h ILE 287 N 0.33 1.14 0.13 4.15 2.04 -1.64 0.52 117.51 124.18 3hgt h ILE 287 Ca -0.01 -0.42 -0.31 0.00 1.00 0.00 0.00 64.86 65.12 3hgt h ILE 287 Cb 1.17 -0.20 -0.00 0.00 -0.74 0.00 0.00 36.82 37.05 3hgt h ILE 287 CO 0.11 0.22 -1.55 1.88 0.00 0.00 0.00 178.15 178.81 3hgt h TYR 288 N 1.23 0.48 -0.35 1.37 0.05 -1.49 0.24 116.97 118.51 3hgt h TYR 288 Ca 0.41 -0.35 -0.03 0.00 0.05 0.00 0.00 58.73 58.80 3hgt h TYR 288 Cb 0.06 -0.02 -0.02 0.00 1.01 0.00 0.00 36.73 37.76 3hgt h TYR 288 CO -0.00 1.41 0.08 1.03 -1.05 0.00 0.00 178.16 179.63 3hgt h SER 289 N 0.07 0.47 -0.33 3.88 0.87 -1.00 0.30 113.55 117.81 3hgt h SER 289 Ca -0.25 -0.06 -0.01 0.00 -1.23 0.00 0.00 61.79 60.23 3hgt h SER 289 Cb 2.03 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 63.86 3hgt h SER 289 CO 0.16 0.48 0.02 1.67 -0.53 0.00 0.00 176.83 178.63 3hgt n GLN 290 N -4.34 3.11 -3.20 2.24 -0.06 0.18 -4.89 117.38 110.42 3hgt n GLN 290 Ca 0.02 -1.75 -0.21 0.00 -2.00 0.00 0.00 57.00 53.06 3hgt n GLN 290 Cb 0.19 -1.92 0.05 0.00 -4.06 0.00 0.00 30.24 24.50 3hgt n GLN 290 CO 0.00 0.00 0.00 1.17 -0.20 0.00 0.00 177.06 178.03 3hgt n LYS 291 N 0.31 -5.70 -1.27 3.69 0.00 0.09 -2.05 118.16 113.24 3hgt n LYS 291 Ca 0.16 0.77 -0.09 0.00 0.00 0.00 0.00 58.31 59.15 3hgt n LYS 291 Cb 0.80 -5.48 -0.04 0.00 0.00 0.00 0.00 35.03 30.31 3hgt n LYS 291 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 3hgt n LEU 292 N -4.04 -0.33 0.18 3.14 4.77 0.84 -4.79 117.00 116.77 3hgt n LEU 292 Ca -0.05 0.23 0.17 0.00 -0.03 0.00 0.00 56.01 56.34 3hgt n LEU 292 Cb 0.58 -2.24 0.81 0.00 -2.33 0.00 0.00 43.42 40.24 3hgt n LEU 292 CO 0.50 -0.83 1.15 0.45 -1.33 0.00 0.00 177.39 177.33 3hgt h HIS 293 N 0.00 0.00 -0.42 -1.77 3.86 -1.59 0.18 115.15 115.41 3hgt h HIS 293 Ca -0.19 0.00 0.12 0.00 -1.16 0.00 0.00 60.37 59.14 3hgt h HIS 293 Cb 0.95 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.40 3hgt h HIS 293 CO 0.48 0.00 0.51 -0.92 0.86 0.00 0.00 177.93 178.86 3hgt h TYR 294 N 0.00 0.00 -0.52 2.45 3.20 -1.82 -2.54 116.97 117.75 3hgt h TYR 294 Ca 0.10 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.97 3hgt h TYR 294 Cb 0.58 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.85 3hgt h TYR 294 CO 0.00 0.00 0.00 1.28 -1.64 0.00 0.00 178.16 177.80 3hgt n LEU 295 N -3.56 2.83 -0.03 2.82 4.77 0.05 -4.50 117.00 119.38 3hgt n LEU 295 Ca 0.08 -1.41 -0.17 0.00 -0.03 0.00 0.00 56.01 54.47 3hgt n LEU 295 Cb 0.68 -0.36 -0.07 0.00 -2.33 0.00 0.00 43.42 41.35 3hgt n LEU 295 CO 0.25 0.69 0.31 0.58 -1.33 0.00 0.00 177.39 177.90 3hgt h VAL 296 N 3.05 1.29 -0.37 4.08 2.07 -1.65 -1.95 116.25 122.76 3hgt h VAL 296 Ca 0.00 -1.90 -0.01 0.00 0.82 0.00 0.00 66.70 65.61 3hgt h VAL 296 Cb 0.72 1.95 -0.02 0.00 -1.52 0.00 0.00 31.29 32.41 3hgt h VAL 296 CO 0.01 0.60 0.20 -0.08 0.02 0.00 0.00 177.57 178.32 3hgt h GLU 297 N 0.50 0.51 -0.10 1.57 4.81 -1.84 0.39 114.58 120.42 3hgt h GLU 297 Ca -0.04 -0.05 -0.22 0.00 -0.13 0.00 0.00 59.36 58.93 3hgt h GLU 297 Cb 1.32 -0.11 0.01 0.00 0.63 0.00 0.00 28.75 30.60 3hgt h GLU 297 CO 0.14 0.38 -0.82 2.35 -0.73 0.00 0.00 179.01 180.34 3hgt h TRP 298 N 0.51 0.88 0.00 0.92 7.01 -1.78 -1.76 115.95 121.74 3hgt h TRP 298 Ca 0.13 -0.41 -0.05 0.00 2.11 0.00 0.00 58.89 60.68 3hgt h TRP 298 Cb 0.03 -0.13 -0.01 0.00 -2.10 0.00 0.00 29.16 26.95 3hgt h TRP 298 CO 0.00 1.22 -0.22 -0.07 -2.79 0.00 0.00 178.44 176.59 3hgt h LEU 299 N 0.42 0.00 0.01 0.65 3.38 -0.72 -2.56 115.31 116.49 3hgt h LEU 299 Ca -0.06 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 3hgt h LEU 299 Cb 1.44 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.19 3hgt h LEU 299 CO 0.16 0.22 -0.00 -0.33 0.09 0.00 0.00 178.44 178.57 3hgt h GLU 300 N 0.00 -0.01 -3.91 1.13 4.39 -0.79 -3.40 114.58 111.99 3hgt h GLU 300 Ca -0.00 0.00 -0.64 0.00 0.34 0.00 0.00 59.36 59.06 3hgt h GLU 300 Cb 0.41 0.00 -0.40 0.00 -0.10 0.00 0.00 28.75 28.66 3hgt h GLU 300 CO 0.03 0.48 -0.69 -0.80 -1.16 0.00 0.00 179.01 176.86 3hgt s ASN 301 N -5.68 4.40 0.00 1.42 0.01 -0.68 -4.96 114.94 109.46 3hgt s ASN 301 Ca -0.16 -2.45 0.12 0.00 -0.71 0.00 0.00 52.86 49.66 3hgt s ASN 301 Cb 0.02 -1.48 0.65 0.00 0.41 0.00 0.00 41.25 40.85 3hgt s ASN 301 CO 0.67 -0.32 1.19 -2.65 -1.51 0.00 0.00 177.10 174.48 3hgt n PRO 302 N 3.84 0.28 0.07 -0.60 -0.02 -0.98 -0.56 135.00 137.04 3hgt n PRO 302 Ca 0.04 0.08 0.12 0.00 -2.02 0.00 0.00 63.50 61.71 3hgt n PRO 302 Cb 0.38 -1.50 0.05 0.00 -0.02 0.00 0.00 33.50 32.41 3hgt n PRO 302 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 3hgt n THR 303 N -1.12 0.42 -1.84 3.45 -2.24 -1.26 -4.89 114.28 106.79 3hgt n THR 303 Ca 0.07 -0.40 -0.38 0.00 -2.27 0.00 0.00 64.05 61.08 3hgt n THR 303 Cb 0.06 -0.15 0.04 0.00 -2.10 0.00 0.00 70.33 68.19 3hgt n THR 303 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3hgt s VAL 304 N -3.27 2.22 0.34 2.28 1.01 0.28 -4.71 120.40 118.55 3hgt s VAL 304 Ca 0.02 0.15 -0.29 0.00 0.00 0.00 0.00 61.98 61.87 3hgt s VAL 304 Cb 0.12 -3.07 -0.10 0.00 0.00 0.00 0.00 36.38 33.32 3hgt s VAL 304 CO 0.77 -0.01 1.34 -2.84 0.00 0.00 0.00 175.10 174.36 3hgt s PRO 305 N -3.04 4.31 -0.11 2.72 0.02 -1.26 -4.50 135.00 133.15 3hgt s PRO 305 Ca 0.74 2.28 -0.36 0.00 0.02 0.00 0.00 61.00 63.68 3hgt s PRO 305 Cb -0.38 -3.05 -0.14 0.00 0.02 0.00 0.00 34.50 30.95 3hgt s PRO 305 CO 0.43 -0.25 1.74 1.87 -0.33 0.00 0.00 177.00 180.47 3hgt n TRP 306 N 0.75 2.15 0.31 6.54 -0.00 -1.26 -4.84 117.44 121.09 3hgt n TRP 306 Ca 0.00 0.27 0.16 0.00 -0.00 0.00 0.00 57.50 57.93 3hgt n TRP 306 Cb 0.41 -2.55 0.70 0.00 -0.00 0.00 0.00 31.31 29.88 3hgt n TRP 306 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 177.69 176.34 3hgt h PRO 307 N 7.67 0.00 -6.14 5.87 0.11 -1.95 -3.46 132.00 134.10 3hgt h PRO 307 Ca -0.47 0.00 -0.53 0.00 0.11 0.00 0.00 66.00 65.11 3hgt h PRO 307 Cb 1.29 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.34 3hgt h PRO 307 CO 0.93 0.00 -0.52 -0.51 -0.21 0.00 0.00 178.00 177.69 3hgt s LEU 308 N -5.38 3.40 0.65 2.35 1.43 -1.26 -5.11 118.68 114.77 3hgt s LEU 308 Ca 0.01 -0.63 -0.18 0.00 -1.03 0.00 0.00 54.13 52.29 3hgt s LEU 308 Cb 0.09 -1.93 -0.01 0.00 0.03 0.00 0.00 46.19 44.37 3hgt s LEU 308 CO 0.42 -0.27 1.30 -2.84 0.23 0.00 0.00 176.35 175.19 3hgt s PRO 309 N -3.88 2.53 0.87 1.29 0.02 -1.26 -5.01 135.00 129.56 3hgt s PRO 309 Ca 0.38 2.07 -0.11 0.00 0.02 0.00 0.00 61.00 63.36 3hgt s PRO 309 Cb -0.04 -1.84 0.12 0.00 0.02 0.00 0.00 34.50 32.75 3hgt s PRO 309 CO 0.24 -1.62 1.10 -0.51 -0.33 0.00 0.00 177.00 175.88 3hgt s ASP 310 N -1.40 3.58 -0.23 2.53 1.01 -1.26 -4.87 116.67 116.03 3hgt s ASP 310 Ca 0.83 1.76 -0.38 0.00 0.71 0.00 0.00 52.55 55.47 3hgt s ASP 310 Cb -0.38 -2.40 -0.14 0.00 1.01 0.00 0.00 42.92 41.02 3hgt s ASP 310 CO 0.40 -2.61 1.84 0.00 0.21 0.00 0.00 175.17 175.01 3hgt n ILE 311 N -3.89 0.38 -1.80 0.77 3.06 -1.26 -4.87 119.36 111.76 3hgt n ILE 311 Ca 0.08 -0.09 -0.41 0.00 -2.50 0.00 0.00 62.75 59.83 3hgt n ILE 311 Cb 0.54 -1.48 -0.01 0.00 0.54 0.00 0.00 39.64 39.23 3hgt n ILE 311 CO 0.00 0.00 0.00 -0.31 -2.50 0.00 0.00 176.55 173.74 3hgt s TYR 312 N 4.18 2.76 0.40 9.51 4.12 -1.26 -4.95 117.35 132.11 3hgt s TYR 312 Ca 0.98 0.84 -0.26 0.00 0.02 0.00 0.00 57.07 58.64 3hgt s TYR 312 Cb -0.93 -4.05 -0.09 0.00 -1.52 0.00 0.00 41.96 35.37 3hgt s TYR 312 CO 0.60 -3.47 1.35 -2.14 0.02 0.00 0.00 175.55 171.91 3hgt s PRO 313 N -0.64 3.97 -0.15 -1.71 0.02 -1.26 -4.99 135.00 130.24 3hgt s PRO 313 Ca 0.62 2.27 -0.04 0.00 0.02 0.00 0.00 61.00 63.87 3hgt s PRO 313 Cb -0.47 -2.80 -0.03 0.00 0.02 0.00 0.00 34.50 31.22 3hgt s PRO 313 CO 0.49 -0.53 -0.02 -0.51 -0.33 0.00 0.00 177.00 176.10 3hgt s LEU 314 N -2.37 3.39 0.58 -5.54 1.43 -1.26 -5.09 118.68 109.81 3hgt s LEU 314 Ca 0.56 -0.05 -0.21 0.00 -1.03 0.00 0.00 54.13 53.40 3hgt s LEU 314 Cb -0.41 -1.82 -0.04 0.00 0.03 0.00 0.00 46.19 43.96 3hgt s LEU 314 CO 0.53 0.20 1.35 -0.54 0.23 0.00 0.00 176.35 178.12 3hgt s LYS 315 N 0.17 2.96 -0.28 1.70 1.02 -1.26 -4.96 119.74 119.09 3hgt s LYS 315 Ca -0.00 2.20 -0.25 0.00 0.02 0.00 0.00 55.97 57.94 3hgt s LYS 315 Cb -0.13 -2.14 0.00 0.00 -0.52 0.00 0.00 37.83 35.04 3hgt s LYS 315 CO 0.02 -1.32 0.86 -0.65 -0.92 0.00 0.00 175.35 173.34 3hgt s GLN 316 N -3.04 4.08 0.06 1.68 -0.21 -1.26 -4.89 119.66 116.07 3hgt s GLN 316 Ca 0.75 0.85 0.01 0.00 0.02 0.00 0.00 55.36 56.98 3hgt s GLN 316 Cb -0.40 -3.69 -0.04 0.00 1.00 0.00 0.00 33.01 29.88 3hgt s GLN 316 CO 0.46 -0.64 0.15 0.71 -2.12 0.00 0.00 175.29 173.84 3hgt s TYR 317 N 3.03 3.38 0.46 0.91 2.02 -1.26 -5.11 117.35 120.77 3hgt s TYR 317 Ca 0.36 0.19 -0.02 0.00 -0.37 0.00 0.00 57.07 57.23 3hgt s TYR 317 Cb -0.14 -1.71 -0.01 0.00 -0.40 0.00 0.00 41.96 39.70 3hgt s TYR 317 CO 0.10 0.56 0.71 0.99 -1.57 0.00 0.00 175.55 176.35 3hgt s THR 318 N -1.42 4.27 0.51 -0.71 2.01 -1.26 -4.94 115.64 114.10 3hgt s THR 318 Ca 0.31 -0.29 0.15 0.00 0.31 0.00 0.00 61.69 62.17 3hgt s THR 318 Cb -0.13 -3.60 0.27 0.00 0.01 0.00 0.00 72.50 69.05 3hgt s THR 318 CO 0.24 -0.48 2.14 -1.28 -0.69 0.00 0.00 174.62 174.55 3hgt h SER 319 N 0.33 0.04 0.69 3.53 0.87 -1.99 -1.13 113.55 115.88 3hgt h SER 319 Ca -0.47 -0.00 -0.18 0.00 -1.23 0.00 0.00 61.79 59.91 3hgt h SER 319 Cb 1.24 -0.01 -0.02 0.00 -0.44 0.00 0.00 62.40 63.17 3hgt h SER 319 CO 0.59 0.03 -0.82 0.24 -0.53 0.00 0.00 176.83 176.34 3hgt h MET 320 N 0.04 0.09 -0.66 2.24 2.86 -1.97 -2.62 114.93 114.91 3hgt h MET 320 Ca 0.01 -0.09 -0.05 0.00 -2.06 0.00 0.00 59.70 57.50 3hgt h MET 320 Cb -0.00 0.03 -0.03 0.00 0.06 0.00 0.00 31.60 31.65 3hgt h MET 320 CO -0.00 0.85 0.19 -0.44 1.06 0.00 0.00 176.91 178.57 3hgt h ASP 321 N 0.05 0.94 0.03 1.22 3.32 -1.61 -2.66 116.42 117.71 3hgt h ASP 321 Ca -0.02 -0.17 -0.19 0.00 0.02 0.00 0.00 57.03 56.67 3hgt h ASP 321 Cb 1.43 -0.25 -0.00 0.00 0.22 0.00 0.00 39.33 40.73 3hgt h ASP 321 CO 0.11 0.89 -0.68 0.58 -1.72 0.00 0.00 179.24 178.43 3hgt h VAL 322 N 0.97 1.32 -0.30 -1.35 2.07 -1.20 -2.75 116.25 115.01 3hgt h VAL 322 Ca 0.21 -1.96 -0.13 0.00 0.82 0.00 0.00 66.70 65.64 3hgt h VAL 322 Cb 0.30 1.93 -0.01 0.00 -1.52 0.00 0.00 31.29 31.99 3hgt h VAL 322 CO -0.01 0.61 -0.35 -0.08 0.02 0.00 0.00 177.57 177.77 3hgt h GLU 323 N 0.43 0.67 0.13 1.57 4.81 -1.43 -1.81 114.58 118.95 3hgt h GLU 323 Ca -0.02 -0.32 0.01 0.00 -0.13 0.00 0.00 59.36 58.90 3hgt h GLU 323 Cb 1.26 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 30.62 3hgt h GLU 323 CO 0.13 0.91 -0.17 0.00 -0.73 0.00 0.00 179.01 179.15 3hgt h ARG 324 N 0.56 -0.34 -0.68 1.92 3.08 -1.45 -2.06 114.38 115.42 3hgt h ARG 324 Ca 0.06 0.02 0.05 0.00 0.07 0.00 0.00 59.98 60.18 3hgt h ARG 324 Cb 0.86 0.08 -0.04 0.00 0.08 0.00 0.00 29.97 30.94 3hgt h ARG 324 CO 0.07 -0.22 0.45 1.03 -1.07 0.00 0.00 179.97 180.23 3hgt h SER 325 N -0.35 0.65 0.75 7.04 0.87 -1.26 -2.40 113.55 118.85 3hgt h SER 325 Ca 0.01 -0.00 -0.19 0.00 -1.23 0.00 0.00 61.79 60.39 3hgt h SER 325 Cb 0.35 -0.14 -0.02 0.00 -0.44 0.00 0.00 62.40 62.15 3hgt h SER 325 CO -0.07 0.43 -0.86 -0.07 -0.53 0.00 0.00 176.83 175.73 3hgt h LEU 326 N 0.74 0.09 -0.04 2.23 3.38 -1.16 -3.26 115.31 117.29 3hgt h LEU 326 Ca 0.28 -0.08 -0.00 0.00 0.09 0.00 0.00 57.88 58.17 3hgt h LEU 326 Cb 0.18 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 40.89 3hgt h LEU 326 CO -0.09 0.91 0.01 -0.07 0.09 0.00 0.00 178.44 179.29 3hgt h LEU 327 N 0.04 0.06 0.00 1.67 3.38 -0.87 -3.51 115.31 116.07 3hgt h LEU 327 Ca -0.02 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 57.73 3hgt h LEU 327 Cb 1.50 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 42.24 3hgt h LEU 327 CO 0.12 0.26 0.00 0.35 0.09 0.00 0.00 178.44 179.26