#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2aml s HIS -3 N 0.00 2.36 -0.28 4.41 2.46 -1.26 -4.98 115.29 118.01 2aml s HIS -3 Ca 0.00 0.68 0.03 0.00 0.47 0.00 0.00 55.06 56.24 2aml s HIS -3 Cb 0.00 -3.93 0.07 0.00 -0.13 0.00 0.00 32.58 28.59 2aml s HIS -3 CO 0.00 -2.43 -0.05 -1.01 -2.47 0.00 0.00 174.74 168.77 2aml s HIS -2 N 4.76 3.16 0.31 3.88 3.76 -1.26 -5.03 115.29 124.87 2aml s HIS -2 Ca 0.65 -2.35 0.08 0.00 -0.15 0.00 0.00 55.06 53.29 2aml s HIS -2 Cb -0.22 -2.08 0.86 0.00 1.11 0.00 0.00 32.58 32.25 2aml s HIS -2 CO 0.26 -0.88 1.71 1.12 -0.85 0.00 0.00 174.74 176.10 2aml h HIS -1 N 7.78 0.87 -0.56 1.40 2.07 -2.04 -3.16 115.15 121.51 2aml h HIS -1 Ca -0.15 0.04 -0.34 0.00 -2.85 0.00 0.00 60.37 57.06 2aml h HIS -1 Cb 1.04 -0.23 -0.12 0.00 2.57 0.00 0.00 27.41 30.66 2aml h HIS -1 CO 0.56 -0.01 0.08 0.72 -3.07 0.00 0.00 177.93 176.21 2aml n HIS 0 N -4.97 0.90 0.00 6.12 8.25 -1.26 -5.04 115.22 119.23 2aml n HIS 0 Ca 0.26 -1.73 0.00 0.00 -0.26 0.00 0.00 57.72 55.99 2aml n HIS 0 Cb 0.75 -1.38 0.00 0.00 1.12 0.00 0.00 29.99 30.48 2aml n HIS 0 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 2aml n LYS 2 N 1.48 0.00 -2.07 -0.41 5.02 -1.20 -5.17 118.16 115.81 2aml n LYS 2 Ca 0.43 0.00 -0.37 0.00 -2.02 0.00 0.00 58.31 56.35 2aml n LYS 2 Cb 0.69 0.00 0.02 0.00 -0.02 0.00 0.00 35.03 35.72 2aml n LYS 2 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2aml s PRO 3 N -4.52 3.30 0.05 1.97 0.04 -1.26 -5.04 135.00 129.53 2aml s PRO 3 Ca 0.00 1.87 -0.01 0.00 0.04 0.00 0.00 61.00 62.90 2aml s PRO 3 Cb 0.00 -2.16 -0.01 0.00 0.04 0.00 0.00 34.50 32.38 2aml s PRO 3 CO 0.00 -0.95 -0.03 0.25 0.04 0.00 0.00 177.00 176.31 2aml n THR 4 N -1.09 0.90 0.00 1.26 -2.24 -1.26 -4.89 114.28 106.96 2aml n THR 4 Ca 0.11 0.25 0.00 0.00 -2.27 0.00 0.00 64.05 62.14 2aml n THR 4 Cb 0.48 -1.61 0.00 0.00 -2.10 0.00 0.00 70.33 67.10 2aml n THR 4 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 2aml n THR 7 N -3.42 0.00 0.04 4.28 -1.04 -1.26 -4.75 114.28 108.13 2aml n THR 7 Ca -0.02 0.00 -0.18 0.00 -2.04 0.00 0.00 64.05 61.81 2aml n THR 7 Cb 0.20 0.00 -0.08 0.00 -1.82 0.00 0.00 70.33 68.63 2aml n THR 7 CO 0.00 0.00 0.00 1.88 -0.64 0.00 0.00 175.07 176.31 2aml h TYR 8 N 0.00 0.94 -0.80 -1.42 0.05 -1.98 -2.78 116.97 110.97 2aml h TYR 8 Ca 0.00 -0.49 0.13 0.00 0.05 0.00 0.00 58.73 58.42 2aml h TYR 8 Cb 0.00 -0.11 -0.09 0.00 1.01 0.00 0.00 36.73 37.54 2aml h TYR 8 CO 0.00 1.33 0.39 0.82 -1.05 0.00 0.00 178.16 179.65 2aml h ILE 9 N 0.38 0.74 0.00 -2.88 2.04 -1.95 -1.45 117.51 114.38 2aml h ILE 9 Ca -0.11 -0.20 0.00 0.00 1.00 0.00 0.00 64.86 65.55 2aml h ILE 9 Cb 1.62 0.10 0.00 0.00 -0.74 0.00 0.00 36.82 37.81 2aml h ILE 9 CO 0.19 0.11 0.00 0.59 0.00 0.00 0.00 178.15 179.03 2aml n ASN 10 N -4.90 0.28 0.00 1.72 3.02 -1.15 -1.97 115.26 112.27 2aml n ASN 10 Ca 0.15 0.57 0.11 0.00 -0.03 0.00 0.00 54.58 55.38 2aml n ASN 10 Cb 0.40 -0.63 0.07 0.00 -0.61 0.00 0.00 39.78 39.00 2aml n ASN 10 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2aml n GLU 11 N -1.81 0.03 -0.28 3.52 1.02 -0.57 -4.58 120.64 117.96 2aml n GLU 11 Ca 0.03 -0.00 -0.04 0.00 -0.02 0.00 0.00 57.16 57.13 2aml n GLU 11 Cb 0.21 -1.51 0.07 0.00 -0.02 0.00 0.00 31.44 30.19 2aml n GLU 11 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 2aml h GLU 12 N 0.00 1.02 0.18 3.49 5.08 -1.07 -3.11 114.58 120.17 2aml h GLU 12 Ca 0.00 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 2aml h GLU 12 Cb 0.52 -0.23 -0.02 0.00 0.50 0.00 0.00 28.75 29.53 2aml h GLU 12 CO 0.00 0.67 -0.19 1.49 -1.00 0.00 0.00 179.01 179.98 2aml h GLU 13 N 1.05 -0.39 -1.57 2.33 4.81 -1.81 -0.01 114.58 118.99 2aml h GLU 13 Ca 0.28 0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.54 2aml h GLU 13 Cb -0.12 0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.35 2aml h GLU 13 CO -0.06 -0.26 0.00 -1.91 -0.73 0.00 0.00 179.01 176.05 2aml n GLU 14 N -5.31 0.33 0.00 1.92 4.07 -1.17 -1.80 120.64 118.68 2aml n GLU 14 Ca -0.08 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.02 2aml n GLU 14 Cb 0.23 -1.32 0.00 0.00 -0.06 0.00 0.00 31.44 30.29 2aml n GLU 14 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2aml h ARG 17 N 0.00 0.90 -0.28 0.00 3.08 -1.60 -0.43 114.38 116.05 2aml h ARG 17 Ca 0.00 -0.05 -0.11 0.00 0.07 0.00 0.00 59.98 59.88 2aml h ARG 17 Cb 0.00 -0.20 -0.00 0.00 0.08 0.00 0.00 29.97 29.84 2aml h ARG 17 CO 0.00 0.59 -0.27 0.28 -1.07 0.00 0.00 179.97 179.50 2aml h VAL 18 N 0.92 1.31 -0.31 2.04 2.07 -1.78 -0.97 116.25 119.53 2aml h VAL 18 Ca 0.29 -1.44 0.03 0.00 0.82 0.00 0.00 66.70 66.41 2aml h VAL 18 Cb 0.00 1.60 -0.03 0.00 -1.52 0.00 0.00 31.29 31.35 2aml h VAL 18 CO -0.11 0.46 0.12 0.40 0.02 0.00 0.00 177.57 178.47 2aml h ILE 19 N 0.40 0.94 -0.76 4.57 2.04 -1.78 -2.36 117.51 120.56 2aml h ILE 19 Ca 0.04 -0.09 0.01 0.00 1.00 0.00 0.00 64.86 65.82 2aml h ILE 19 Cb 0.84 0.64 -0.04 0.00 -0.74 0.00 0.00 36.82 37.52 2aml h ILE 19 CO 0.07 0.05 0.50 0.25 0.00 0.00 0.00 178.15 179.01 2aml h LEU 20 N 0.27 0.87 -1.21 1.44 5.85 -1.02 -1.52 115.31 120.00 2aml h LEU 20 Ca 0.14 -0.03 0.07 0.00 0.84 0.00 0.00 57.88 58.91 2aml h LEU 20 Cb 0.09 -0.22 -0.06 0.00 0.37 0.00 0.00 40.66 40.84 2aml h LEU 20 CO -0.13 0.64 0.56 0.00 -0.34 0.00 0.00 178.44 179.17 2aml h ALA 21 N 1.27 1.59 -0.32 1.25 0.00 -0.76 -3.22 119.26 119.07 2aml h ALA 21 Ca 0.28 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.17 2aml h ALA 21 Cb -0.11 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.44 2aml h ALA 21 CO -0.06 0.26 0.00 -0.25 0.00 0.00 0.00 179.25 179.20 2aml n ASP 22 N -4.50 2.85 0.27 0.00 8.00 -0.93 -4.75 116.55 117.50 2aml n ASP 22 Ca 0.14 -1.97 0.13 0.00 0.71 0.00 0.00 54.79 53.79 2aml n ASP 22 Cb 0.24 -0.21 0.77 0.00 -0.02 0.00 0.00 41.12 41.90 2aml n ASP 22 CO 0.00 0.00 0.00 2.19 -0.39 0.00 0.00 177.20 179.00 2aml h PHE 23 N 2.00 0.00 0.00 1.24 -0.00 -1.30 -2.36 116.94 116.52 2aml h PHE 23 Ca 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 57.97 57.93 2aml h PHE 23 Cb 0.71 0.00 -0.01 0.00 -0.00 0.00 0.00 35.95 36.66 2aml h PHE 23 CO 0.21 0.07 -0.20 1.96 -0.00 0.00 0.00 178.31 180.36 2aml h GLN 24 N 0.00 0.00 0.07 6.09 4.20 -1.87 -2.73 115.11 120.87 2aml h GLN 24 Ca -0.00 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.71 2aml h GLN 24 Cb 0.18 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.96 2aml h GLN 24 CO 0.01 0.20 -0.03 1.15 -0.67 0.00 0.00 178.83 179.48 2aml h THR 25 N 0.00 1.16 -0.94 -0.54 2.02 -1.81 -1.20 112.91 111.59 2aml h THR 25 Ca -0.00 -0.83 0.01 0.00 0.77 0.00 0.00 66.41 66.37 2aml h THR 25 Cb 0.38 1.70 -0.05 0.00 -1.74 0.00 0.00 68.15 68.44 2aml h THR 25 CO 0.03 0.20 0.62 0.78 0.37 0.00 0.00 175.52 177.52 2aml h ASN 26 N -0.47 1.07 -0.59 4.18 2.35 -1.70 -2.42 115.58 118.00 2aml h ASN 26 Ca -0.01 -0.02 -0.04 0.00 -0.55 0.00 0.00 56.30 55.68 2aml h ASN 26 Cb 0.40 -0.26 -0.03 0.00 0.05 0.00 0.00 38.32 38.49 2aml h ASN 26 CO 0.02 0.77 0.22 0.00 -1.65 0.00 0.00 177.43 176.78 2aml h ALA 27 N 1.35 0.77 -0.58 -0.83 0.00 -1.25 -1.57 119.26 117.15 2aml h ALA 27 Ca 0.35 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 2aml h ALA 27 Cb -0.12 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.41 2aml h ALA 27 CO -0.08 0.40 0.16 0.93 0.00 0.00 0.00 179.25 180.66 2aml h GLU 28 N 0.82 0.89 -0.23 0.00 5.08 -1.03 -0.66 114.58 119.44 2aml h GLU 28 Ca 0.19 -0.18 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 2aml h GLU 28 Cb 0.23 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 2aml h GLU 28 CO -0.01 0.79 0.14 0.87 -1.00 0.00 0.00 179.01 179.80 2aml h LYS 29 N 0.86 0.31 -0.31 2.33 1.57 -0.90 -0.85 116.57 119.58 2aml h LYS 29 Ca 0.19 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.94 2aml h LYS 29 Cb 0.29 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.51 2aml h LYS 29 CO -0.00 0.23 0.19 1.25 -0.57 0.00 0.00 179.45 180.55 2aml h LEU 30 N 0.30 0.37 -1.98 2.94 6.46 -0.92 -2.83 115.31 119.65 2aml h LEU 30 Ca 0.08 -0.05 -0.01 0.00 -0.12 0.00 0.00 57.88 57.79 2aml h LEU 30 Cb -0.00 -0.09 -0.00 0.00 -0.73 0.00 0.00 40.66 39.83 2aml h LEU 30 CO -0.02 0.31 -0.03 -0.33 -0.62 0.00 0.00 178.44 177.76 2aml h GLU 31 N 0.40 0.00 0.00 1.25 5.08 -0.94 -1.23 114.58 119.15 2aml h GLU 31 Ca 0.11 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.47 2aml h GLU 31 Cb 0.01 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.26 2aml h GLU 31 CO -0.02 0.03 -0.00 0.66 -1.00 0.00 0.00 179.01 178.67 2aml h SER 32 N 0.00 0.00 0.58 1.42 4.64 -0.89 -2.54 113.55 116.76 2aml h SER 32 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2aml h SER 32 Cb 0.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.14 2aml h SER 32 CO 0.00 0.00 -1.00 0.18 -0.87 0.00 0.00 176.83 175.15 2aml n LEU 33 N -3.12 0.63 -2.60 5.97 4.77 -0.46 -4.49 117.00 117.69 2aml n LEU 33 Ca -0.02 0.09 -0.20 0.00 -0.03 0.00 0.00 56.01 55.84 2aml n LEU 33 Cb 0.13 -0.10 0.01 0.00 -2.33 0.00 0.00 43.42 41.12 2aml n LEU 33 CO 0.22 -0.02 0.06 1.33 -1.33 0.00 0.00 177.39 177.65 2aml n VAL 34 N -2.12 1.80 0.21 4.08 0.24 -0.96 -4.83 118.33 116.76 2aml n VAL 34 Ca 0.02 -4.27 0.05 0.00 -2.04 0.00 0.00 64.34 58.09 2aml n VAL 34 Cb 0.46 -0.53 0.48 0.00 -1.47 0.00 0.00 33.84 32.78 2aml n VAL 34 CO 0.00 0.00 0.00 0.11 -2.14 0.00 0.00 176.83 174.80 2aml h LYS 35 N 2.78 0.00 -0.05 7.34 1.57 -1.78 -0.70 116.57 125.72 2aml h LYS 35 Ca 0.14 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.92 2aml h LYS 35 Cb 0.99 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.30 2aml h LYS 35 CO 0.71 0.25 0.00 -1.71 -0.57 0.00 0.00 179.45 178.12 2aml n ASN 36 N -4.13 0.70 0.00 0.86 2.85 -1.26 -5.01 115.26 109.27 2aml n ASN 36 Ca -0.02 -1.41 0.00 0.00 -0.11 0.00 0.00 54.58 53.04 2aml n ASN 36 Cb 0.31 -0.03 0.00 0.00 1.24 0.00 0.00 39.78 41.30 2aml n ASN 36 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2aml n GLY 37 N 1.00 2.35 2.88 8.20 0.00 -0.27 -5.06 105.19 114.28 2aml n GLY 37 Ca 0.18 -1.93 -0.11 0.00 0.00 0.00 0.00 46.02 44.16 2aml n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2aml s ALA 38 N -2.89 -1.01 -0.08 4.61 0.00 -1.26 -4.88 121.76 116.25 2aml s ALA 38 Ca 0.00 0.25 0.12 0.00 0.00 0.00 0.00 51.96 52.33 2aml s ALA 38 Cb 0.00 -1.92 -0.24 0.00 0.00 0.00 0.00 23.12 20.96 2aml s ALA 38 CO 0.00 -1.63 0.51 1.63 0.00 0.00 0.00 175.76 176.27 2aml n LYS 39 N 5.35 0.65 -3.91 0.00 5.02 -1.26 -4.78 118.16 119.22 2aml n LYS 39 Ca -0.01 0.23 -0.35 0.00 -2.02 0.00 0.00 58.31 56.16 2aml n LYS 39 Cb 0.49 -1.73 -0.14 0.00 -0.02 0.00 0.00 35.03 33.63 2aml n LYS 39 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 2aml s GLU 40 N -2.57 2.74 0.01 1.97 0.41 -1.26 -0.28 118.70 119.72 2aml s GLU 40 Ca -0.07 -1.05 0.05 0.00 -0.41 0.00 0.00 54.97 53.49 2aml s GLU 40 Cb 0.07 -3.11 -0.03 0.00 -1.78 0.00 0.00 34.13 29.29 2aml s GLU 40 CO 0.82 -0.48 -0.14 -1.58 -0.49 0.00 0.00 175.26 173.39 2aml s TRP 41 N 1.33 2.68 -0.11 1.61 0.52 -0.19 -0.82 118.94 123.96 2aml s TRP 41 Ca -0.01 -0.18 0.04 0.00 0.02 0.00 0.00 56.10 55.97 2aml s TRP 41 Cb -0.18 -1.54 0.00 0.00 -1.15 0.00 0.00 33.47 30.61 2aml s TRP 41 CO -0.02 0.27 -0.23 -1.17 0.02 0.00 0.00 176.95 175.82 2aml s LEU 42 N -1.30 2.07 -0.21 2.99 2.96 0.02 -1.03 118.68 124.19 2aml s LEU 42 Ca 0.15 -0.55 -0.05 0.00 -0.22 0.00 0.00 54.13 53.46 2aml s LEU 42 Cb -0.11 -1.39 -0.02 0.00 0.50 0.00 0.00 46.19 45.18 2aml s LEU 42 CO 0.05 0.14 -0.01 -0.63 -1.32 0.00 0.00 176.35 174.58 2aml s ILE 43 N 0.44 3.80 -0.25 6.68 1.01 0.61 -0.43 121.20 133.07 2aml s ILE 43 Ca -0.17 -0.36 -0.06 0.00 0.00 0.00 0.00 60.65 60.07 2aml s ILE 43 Cb -0.17 -2.72 -0.01 0.00 0.01 0.00 0.00 42.46 39.56 2aml s ILE 43 CO 0.07 0.42 0.03 -0.76 0.00 0.00 0.00 174.94 174.70 2aml s LEU 44 N 1.14 3.34 -0.06 2.97 1.43 -0.02 -1.11 118.68 126.37 2aml s LEU 44 Ca 0.02 -0.41 -0.29 0.00 -1.03 0.00 0.00 54.13 52.42 2aml s LEU 44 Cb -0.14 -1.84 0.11 0.00 0.03 0.00 0.00 46.19 44.34 2aml s LEU 44 CO 0.01 -0.07 0.90 0.00 0.23 0.00 0.00 176.35 177.42 2aml s ALA 45 N 1.53 -1.85 0.15 4.21 0.00 -1.14 -1.56 121.76 123.11 2aml s ALA 45 Ca 0.05 1.22 0.03 0.00 0.00 0.00 0.00 51.96 53.26 2aml s ALA 45 Cb -0.15 0.02 -0.05 0.00 0.00 0.00 0.00 23.12 22.94 2aml s ALA 45 CO 0.01 -0.54 -0.06 -0.08 0.00 0.00 0.00 175.76 175.09 2aml s THR 46 N -2.32 0.92 0.00 0.00 -1.32 -1.26 -4.13 115.64 107.52 2aml s THR 46 Ca 0.01 -2.01 0.00 0.00 -1.21 0.00 0.00 61.69 58.49 2aml s THR 46 Cb -0.01 -1.93 0.00 0.00 -1.51 0.00 0.00 72.50 69.05 2aml s THR 46 CO -0.04 -0.66 0.00 0.61 -2.21 0.00 0.00 174.62 172.32 2aml n GLY 47 N -0.20 2.66 0.26 6.08 0.00 -1.26 -2.08 105.19 110.65 2aml n GLY 47 Ca -0.09 -0.40 0.09 0.00 0.00 0.00 0.00 46.02 45.61 2aml n GLY 47 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2aml h SER 48 N 9.82 0.00 -0.52 1.61 0.02 -1.98 -1.22 113.55 121.28 2aml h SER 48 Ca 0.00 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 60.90 2aml h SER 48 Cb 0.00 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.52 2aml h SER 48 CO 0.00 0.03 0.11 0.28 -1.14 0.00 0.00 176.83 176.11 2aml h SER 49 N 0.00 0.80 -0.30 3.07 0.02 -1.75 -0.05 113.55 115.33 2aml h SER 49 Ca -0.00 -0.24 0.01 0.00 -0.84 0.00 0.00 61.79 60.71 2aml h SER 49 Cb 0.05 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 62.36 2aml h SER 49 CO 0.00 0.84 0.19 0.25 -1.14 0.00 0.00 176.83 176.97 2aml h LEU 50 N 0.73 0.31 -1.35 5.07 6.46 -1.07 -1.76 115.31 123.69 2aml h LEU 50 Ca 0.16 -0.00 -0.05 0.00 -0.12 0.00 0.00 57.88 57.87 2aml h LEU 50 Cb 0.36 -0.07 -0.01 0.00 -0.73 0.00 0.00 40.66 40.21 2aml h LEU 50 CO 0.01 0.22 -0.08 0.78 -0.62 0.00 0.00 178.44 178.75 2aml h ASN 51 N 0.38 0.31 -0.26 1.25 2.35 -1.08 -0.48 115.58 118.05 2aml h ASN 51 Ca 0.12 -0.06 -0.04 0.00 -0.55 0.00 0.00 56.30 55.77 2aml h ASN 51 Cb -0.02 -0.08 -0.01 0.00 0.05 0.00 0.00 38.32 38.26 2aml h ASN 51 CO -0.04 0.44 0.01 0.00 -1.65 0.00 0.00 177.43 176.18 2aml h ALA 52 N 1.60 0.35 -0.59 -0.83 0.00 -0.75 -0.24 119.26 118.81 2aml h ALA 52 Ca 0.07 -0.22 0.05 0.00 0.00 0.00 0.00 54.91 54.81 2aml h ALA 52 Cb 0.35 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.00 2aml h ALA 52 CO 0.02 0.08 0.31 0.00 0.00 0.00 0.00 179.25 179.66 2aml h ALA 53 N 0.82 0.77 -0.30 0.00 0.00 -0.83 -1.88 119.26 117.85 2aml h ALA 53 Ca 0.07 0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.92 2aml h ALA 53 Cb 0.41 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 2aml h ALA 53 CO 0.01 -0.02 -0.17 0.37 0.00 0.00 0.00 179.25 179.44 2aml h GLN 54 N 0.59 0.53 0.00 0.00 5.75 -0.90 -0.69 115.11 120.40 2aml h GLN 54 Ca 0.26 -0.17 -0.05 0.00 -0.15 0.00 0.00 58.65 58.53 2aml h GLN 54 Cb 0.16 -0.05 -0.01 0.00 1.07 0.00 0.00 27.48 28.66 2aml h GLN 54 CO -0.17 0.68 -0.26 0.77 -2.65 0.00 0.00 178.83 177.20 2aml h SER 55 N 0.48 0.00 0.01 -0.69 0.02 -0.37 -3.27 113.55 109.73 2aml h SER 55 Ca 0.08 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.03 2aml h SER 55 Cb 0.57 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.11 2aml h SER 55 CO 0.04 0.26 -1.99 0.00 -1.14 0.00 0.00 176.83 173.99 2aml n ALA 56 N -2.39 2.78 -0.10 3.77 0.00 -0.77 -4.68 120.51 119.12 2aml n ALA 56 Ca -0.02 -0.53 -0.07 0.00 0.00 0.00 0.00 53.44 52.82 2aml n ALA 56 Cb 0.34 -0.74 -0.01 0.00 0.00 0.00 0.00 19.45 19.04 2aml n ALA 56 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2aml h LYS 57 N 0.00 -0.23 0.00 0.00 3.64 -1.20 -2.41 116.57 116.37 2aml h LYS 57 Ca -0.01 0.02 -0.08 0.00 -1.27 0.00 0.00 60.65 59.31 2aml h LYS 57 Cb 1.02 0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.88 2aml h LYS 57 CO 0.00 -0.15 -0.38 1.88 -2.27 0.00 0.00 179.45 178.53 2aml h TYR 58 N -0.24 0.00 -0.10 1.91 0.05 -1.84 -1.12 116.97 115.63 2aml h TYR 58 Ca 0.17 0.00 0.03 0.00 0.05 0.00 0.00 58.73 58.98 2aml h TYR 58 Cb 0.51 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 38.22 2aml h TYR 58 CO -0.49 0.38 -0.06 -0.92 -1.05 0.00 0.00 178.16 176.02 2aml h TYR 59 N 0.00 -0.15 -0.25 4.88 3.20 -1.64 -0.84 116.97 122.17 2aml h TYR 59 Ca -0.00 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.86 2aml h TYR 59 Cb 1.12 0.08 -0.01 0.00 1.54 0.00 0.00 36.73 39.46 2aml h TYR 59 CO 0.00 -0.10 0.08 0.82 -1.64 0.00 0.00 178.16 177.32 2aml h ILE 60 N -0.06 1.19 0.00 1.81 2.04 -1.12 -2.63 117.51 118.74 2aml h ILE 60 Ca 0.06 -0.59 -0.01 0.00 1.00 0.00 0.00 64.86 65.32 2aml h ILE 60 Cb 0.15 1.11 -0.00 0.00 -0.74 0.00 0.00 36.82 37.34 2aml h ILE 60 CO -0.14 0.19 -0.04 -0.33 0.00 0.00 0.00 178.15 177.84 2aml h GLU 61 N 0.24 0.00 0.00 2.37 5.08 -1.12 -1.25 114.58 119.89 2aml h GLU 61 Ca 0.08 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.28 2aml h GLU 61 Cb 0.22 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.45 2aml h GLU 61 CO -0.00 0.04 -0.74 -0.97 -1.00 0.00 0.00 179.01 176.33 2aml h ASN 62 N 0.00 0.00 0.16 1.42 -1.24 -0.78 -3.35 115.58 111.79 2aml h ASN 62 Ca -0.00 0.00 -0.34 0.00 0.71 0.00 0.00 56.30 56.67 2aml h ASN 62 Cb 0.35 0.00 -0.06 0.00 0.73 0.00 0.00 38.32 39.33 2aml h ASN 62 CO 0.00 0.74 -2.17 0.18 -1.29 0.00 0.00 177.43 174.90 2aml n LEU 63 N -3.34 0.28 -4.31 0.34 4.77 -0.94 -4.99 117.00 108.80 2aml n LEU 63 Ca 0.01 0.13 -0.28 0.00 -0.03 0.00 0.00 56.01 55.84 2aml n LEU 63 Cb 0.81 0.39 -0.14 0.00 -2.33 0.00 0.00 43.42 42.15 2aml n LEU 63 CO 0.44 0.46 -0.55 0.00 -1.33 0.00 0.00 177.39 176.40 2aml s ALA 64 N -2.54 2.07 -1.06 -1.18 0.00 -0.52 -4.52 121.76 114.01 2aml s ALA 64 Ca -0.08 -1.22 -0.19 0.00 0.00 0.00 0.00 51.96 50.47 2aml s ALA 64 Cb 0.07 -0.40 -0.07 0.00 0.00 0.00 0.00 23.12 22.71 2aml s ALA 64 CO 0.83 0.48 2.01 -3.47 0.00 0.00 0.00 175.76 175.61 2aml n ASP 65 N 1.65 3.16 -4.08 0.00 2.03 -1.26 -4.49 116.55 113.56 2aml n ASP 65 Ca -0.17 -2.75 -0.12 0.00 0.52 0.00 0.00 54.79 52.27 2aml n ASP 65 Cb 0.53 -1.38 -0.11 0.00 -0.72 0.00 0.00 41.12 39.43 2aml n ASP 65 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 2aml s VAL 66 N 4.93 0.54 -0.10 5.18 -7.23 -1.26 -4.59 120.40 117.87 2aml s VAL 66 Ca 0.55 -1.29 0.03 0.00 -1.81 0.00 0.00 61.98 59.45 2aml s VAL 66 Cb 0.12 -0.86 0.01 0.00 0.56 0.00 0.00 36.38 36.21 2aml s VAL 66 CO 0.05 -0.52 -0.18 -0.13 -0.31 0.00 0.00 175.10 174.01 2aml s ARG 67 N -2.17 2.45 -0.18 4.82 0.52 0.61 -4.66 118.95 120.35 2aml s ARG 67 Ca -0.05 -0.66 -0.02 0.00 -0.52 0.00 0.00 55.73 54.48 2aml s ARG 67 Cb -0.06 -1.97 -0.01 0.00 0.52 0.00 0.00 34.95 33.43 2aml s ARG 67 CO -0.01 0.04 -0.08 0.42 0.02 0.00 0.00 175.30 175.68 2aml s ILE 68 N 0.70 3.23 -0.14 1.52 1.01 -1.26 -1.02 121.20 125.24 2aml s ILE 68 Ca -0.12 -0.57 -0.04 0.00 0.00 0.00 0.00 60.65 59.92 2aml s ILE 68 Cb -0.16 -2.42 -0.03 0.00 0.01 0.00 0.00 42.46 39.86 2aml s ILE 68 CO 0.03 0.48 0.00 -0.89 0.00 0.00 0.00 174.94 174.56 2aml s THR 69 N 0.92 4.27 -0.15 2.92 2.01 -0.20 -4.99 115.64 120.42 2aml s THR 69 Ca -0.02 -0.24 -0.01 0.00 0.31 0.00 0.00 61.69 61.74 2aml s THR 69 Cb -0.15 -2.86 -0.01 0.00 0.01 0.00 0.00 72.50 69.49 2aml s THR 69 CO 0.00 0.53 -0.11 -0.63 -0.69 0.00 0.00 174.62 173.72 2aml s ILE 70 N -0.10 3.11 -0.02 1.82 1.01 -1.26 -0.28 121.20 125.47 2aml s ILE 70 Ca 0.04 -0.63 0.02 0.00 0.00 0.00 0.00 60.65 60.09 2aml s ILE 70 Cb -0.13 -2.33 0.00 0.00 0.01 0.00 0.00 42.46 40.01 2aml s ILE 70 CO 0.02 0.50 -0.08 -1.61 0.00 0.00 0.00 174.94 173.77 2aml s GLU 71 N 0.62 0.78 0.21 2.79 0.41 -0.26 -4.97 118.70 118.27 2aml s GLU 71 Ca -0.06 -0.27 -0.32 0.00 -0.41 0.00 0.00 54.97 53.90 2aml s GLU 71 Cb -0.15 -0.75 -0.12 0.00 -1.78 0.00 0.00 34.13 31.33 2aml s GLU 71 CO 0.03 0.12 1.72 0.39 -0.49 0.00 0.00 175.26 177.03 2aml n GLU 72 N 3.16 2.77 0.08 1.61 -0.58 -1.26 -2.87 120.64 123.55 2aml n GLU 72 Ca -0.16 1.00 -0.09 0.00 -0.42 0.00 0.00 57.16 57.49 2aml n GLU 72 Cb 0.55 -2.85 0.00 0.00 -0.57 0.00 0.00 31.44 28.58 2aml n GLU 72 CO 0.00 0.00 0.00 -1.00 -0.48 0.00 0.00 177.13 175.65 2aml h PRO 73 N 6.79 0.24 0.38 3.49 0.13 -1.88 -1.15 132.00 140.00 2aml h PRO 73 Ca -0.43 -0.24 -0.02 0.00 -0.87 0.00 0.00 66.00 64.44 2aml h PRO 73 Cb 1.20 0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.40 2aml h PRO 73 CO 0.96 0.95 -0.18 0.35 -0.23 0.00 0.00 178.00 179.84 2aml h PHE 74 N 0.14 -0.48 -0.97 1.56 3.57 -1.92 -0.75 116.94 118.10 2aml h PHE 74 Ca -0.04 -0.01 0.12 0.00 3.53 0.00 0.00 57.97 61.57 2aml h PHE 74 Cb 1.46 0.16 -0.09 0.00 2.79 0.00 0.00 35.95 40.27 2aml h PHE 74 CO 0.03 -0.23 0.59 -0.97 -2.23 0.00 0.00 178.31 175.50 2aml h ASN 75 N -0.63 0.85 -0.39 0.41 -1.24 -1.97 -1.86 115.58 110.76 2aml h ASN 75 Ca -0.05 0.06 -0.02 0.00 0.71 0.00 0.00 56.30 57.00 2aml h ASN 75 Cb 0.46 -0.11 -0.02 0.00 0.73 0.00 0.00 38.32 39.38 2aml h ASN 75 CO 0.09 0.44 0.17 -0.74 -1.29 0.00 0.00 177.43 176.10 2aml h HIS 76 N 0.92 0.57 -0.24 0.67 2.76 -0.99 0.12 115.15 118.96 2aml h HIS 76 Ca 0.49 -0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.63 2aml h HIS 76 Cb 0.52 -0.17 -0.01 0.00 1.55 0.00 0.00 27.41 29.29 2aml h HIS 76 CO -0.02 0.49 0.16 1.25 -1.30 0.00 0.00 177.93 178.51 2aml h LEU 77 N 0.48 0.27 0.00 0.26 5.85 -0.76 -2.36 115.31 119.05 2aml h LEU 77 Ca 0.13 -0.01 -0.07 0.00 0.84 0.00 0.00 57.88 58.78 2aml h LEU 77 Cb 0.15 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 2aml h LEU 77 CO -0.01 0.20 -1.09 1.88 -0.34 0.00 0.00 178.44 179.07 2aml h TYR 78 N 0.32 0.00 0.00 1.25 0.05 -1.23 -3.42 116.97 113.94 2aml h TYR 78 Ca 0.09 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.87 2aml h TYR 78 Cb -0.04 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.70 2aml h TYR 78 CO -0.06 0.24 -0.55 0.66 -1.05 0.00 0.00 178.16 177.39 2aml n TYR 79 N -2.80 0.00 -3.77 4.88 4.01 0.41 -5.08 117.16 114.81 2aml n TYR 79 Ca -0.03 0.00 -0.34 0.00 -0.16 0.00 0.00 57.90 57.37 2aml n TYR 79 Cb 0.66 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.64 2aml n TYR 79 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 2aml s GLU 80 N -1.13 3.57 0.22 -0.72 0.41 -0.89 -5.01 118.70 115.14 2aml s GLU 80 Ca 0.00 -0.12 -0.16 0.00 -0.41 0.00 0.00 54.97 54.28 2aml s GLU 80 Cb 0.00 -3.05 -0.08 0.00 -1.78 0.00 0.00 34.13 29.23 2aml s GLU 80 CO 0.00 0.62 0.65 0.15 -0.49 0.00 0.00 175.26 176.19 2aml s LYS 81 N -1.96 4.05 0.25 1.61 1.02 -1.26 -4.81 119.74 118.64 2aml s LYS 81 Ca 0.30 0.63 -0.30 0.00 0.02 0.00 0.00 55.97 56.62 2aml s LYS 81 Cb -0.13 -2.77 -0.09 0.00 -0.52 0.00 0.00 37.83 34.32 2aml s LYS 81 CO 0.18 0.36 1.18 -0.51 -0.92 0.00 0.00 175.35 175.65 2aml s LEU 82 N -2.30 4.49 0.33 3.17 1.43 -1.26 -5.03 118.68 119.50 2aml s LEU 82 Ca 0.44 2.33 -0.29 0.00 -1.03 0.00 0.00 54.13 55.59 2aml s LEU 82 Cb -0.14 -3.62 -0.10 0.00 0.03 0.00 0.00 46.19 42.35 2aml s LEU 82 CO 0.20 -0.31 1.37 -0.55 0.23 0.00 0.00 176.35 177.29 2aml s SER 83 N -0.37 6.65 0.62 2.29 0.15 -1.26 -4.90 113.70 116.87 2aml s SER 83 Ca 0.49 2.77 0.41 0.00 0.70 0.00 0.00 55.95 60.32 2aml s SER 83 Cb -0.34 -2.65 2.06 0.00 -1.71 0.00 0.00 66.02 63.38 2aml s SER 83 CO 0.41 -0.65 2.23 0.28 1.20 0.00 0.00 173.24 176.71 2aml h SER 84 N 3.59 0.00 -0.47 5.45 0.02 -2.06 -3.17 113.55 116.91 2aml h SER 84 Ca -0.49 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.46 2aml h SER 84 Cb 1.23 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.77 2aml h SER 84 CO 0.67 0.00 0.00 1.41 -1.14 0.00 0.00 176.83 177.77 2aml n HIS 85 N -3.05 0.79 -2.35 3.45 8.25 -1.26 -5.00 115.22 116.06 2aml n HIS 85 Ca -0.02 -0.56 -0.41 0.00 -0.26 0.00 0.00 57.72 56.47 2aml n HIS 85 Cb 0.14 -0.09 -0.03 0.00 1.12 0.00 0.00 29.99 31.13 2aml n HIS 85 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2aml s LEU 86 N -1.35 4.46 -0.01 2.41 1.43 -1.20 -4.60 118.68 119.81 2aml s LEU 86 Ca 0.35 2.31 0.10 0.00 -1.03 0.00 0.00 54.13 55.87 2aml s LEU 86 Cb 0.21 -3.62 -0.15 0.00 0.03 0.00 0.00 46.19 42.66 2aml s LEU 86 CO 0.20 -0.36 0.22 0.47 0.23 0.00 0.00 176.35 177.11 2aml n ASP 87 N 2.06 2.69 -3.64 2.29 8.00 0.00 -4.92 116.55 123.04 2aml n ASP 87 Ca 0.03 -0.01 -0.10 0.00 0.71 0.00 0.00 54.79 55.42 2aml n ASP 87 Cb 0.44 1.44 -0.07 0.00 -0.02 0.00 0.00 41.12 42.91 2aml n ASP 87 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2aml s LEU 88 N -3.66 -0.82 -0.10 0.64 2.96 -1.06 -4.36 118.68 112.27 2aml s LEU 88 Ca -0.03 1.43 0.03 0.00 -0.22 0.00 0.00 54.13 55.33 2aml s LEU 88 Cb 0.06 2.37 -0.01 0.00 0.50 0.00 0.00 46.19 49.11 2aml s LEU 88 CO 0.41 -0.23 -0.19 -0.69 -1.32 0.00 0.00 176.35 174.33 2aml s VAL 89 N 1.04 2.52 -0.18 1.68 1.01 -0.45 -0.80 120.40 125.22 2aml s VAL 89 Ca -0.05 -0.87 -0.00 0.00 0.00 0.00 0.00 61.98 61.06 2aml s VAL 89 Cb -0.05 -2.00 0.01 0.00 0.00 0.00 0.00 36.38 34.34 2aml s VAL 89 CO -0.10 0.55 -0.16 -0.63 0.00 0.00 0.00 175.10 174.76 2aml s ILE 90 N 0.18 2.46 -0.16 2.22 1.01 0.43 -0.82 121.20 126.52 2aml s ILE 90 Ca -0.11 -0.82 -0.10 0.00 0.00 0.00 0.00 60.65 59.62 2aml s ILE 90 Cb -0.16 -2.05 -0.05 0.00 0.01 0.00 0.00 42.46 40.21 2aml s ILE 90 CO 0.06 0.51 0.18 -0.83 0.00 0.00 0.00 174.94 174.86 2aml s GLY 91 N 1.18 2.13 -0.09 6.18 0.00 0.28 -0.84 107.32 116.16 2aml s GLY 91 Ca 0.02 -0.61 0.02 0.00 0.00 0.00 0.00 44.72 44.15 2aml s GLY 91 CO -0.07 0.03 -0.13 -0.42 0.00 0.00 0.00 173.10 172.51 2aml s ILE 92 N -0.12 1.25 -0.20 0.90 1.01 -0.60 -0.51 121.20 122.92 2aml s ILE 92 Ca 0.12 -0.51 -0.07 0.00 0.00 0.00 0.00 60.65 60.19 2aml s ILE 92 Cb -0.12 -1.15 0.09 0.00 0.01 0.00 0.00 42.46 41.29 2aml s ILE 92 CO 0.02 0.39 0.43 -0.55 0.00 0.00 0.00 174.94 175.22 2aml s SER 93 N 0.92 -0.29 0.09 3.58 0.15 -0.64 -4.38 113.70 113.12 2aml s SER 93 Ca -0.09 1.01 -0.23 0.00 0.70 0.00 0.00 55.95 57.33 2aml s SER 93 Cb -0.15 1.35 -0.15 0.00 -1.71 0.00 0.00 66.02 65.36 2aml s SER 93 CO 0.00 -0.23 1.72 -0.61 1.20 0.00 0.00 173.24 175.33 2aml h GLN 94 N 8.12 -0.02 0.00 5.44 4.15 -1.95 -2.55 115.11 128.31 2aml h GLN 94 Ca -0.17 0.00 -0.10 0.00 0.77 0.00 0.00 58.65 59.15 2aml h GLN 94 Cb 1.11 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.79 2aml h GLN 94 CO 0.13 0.01 -0.50 0.66 -1.93 0.00 0.00 178.83 177.19 2aml h SER 95 N -0.03 0.00 -0.10 -0.69 4.64 -1.96 -0.11 113.55 115.29 2aml h SER 95 Ca -0.00 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.27 2aml h SER 95 Cb 0.03 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.10 2aml h SER 95 CO 0.00 0.50 -0.04 0.61 -0.87 0.00 0.00 176.83 177.03 2aml n GLY 96 N 0.30 0.52 0.00 -0.77 0.00 -0.96 -4.63 105.19 99.65 2aml n GLY 96 Ca -0.01 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.78 2aml n GLY 96 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2aml n GLN 97 N -2.05 2.29 -2.59 1.61 6.02 -1.26 -2.28 117.38 119.12 2aml n GLN 97 Ca -0.02 -1.31 -0.43 0.00 -0.01 0.00 0.00 57.00 55.23 2aml n GLN 97 Cb 0.18 -0.98 -0.02 0.00 1.02 0.00 0.00 30.24 30.44 2aml n GLN 97 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 2aml s SER 98 N -0.81 6.76 0.42 1.08 0.01 -1.26 -1.32 113.70 118.57 2aml s SER 98 Ca 0.00 0.80 0.12 0.00 1.31 0.00 0.00 55.95 58.19 2aml s SER 98 Cb 0.00 -2.55 0.91 0.00 0.21 0.00 0.00 66.02 64.59 2aml s SER 98 CO 0.00 -1.08 1.96 0.71 0.41 0.00 0.00 173.24 175.24 2aml h THR 99 N 6.00 1.15 0.33 1.44 1.35 -1.52 -1.83 112.91 119.83 2aml h THR 99 Ca -0.22 -0.68 -0.02 0.00 -0.55 0.00 0.00 66.41 64.94 2aml h THR 99 Cb 1.07 1.26 0.00 0.00 -1.73 0.00 0.00 68.15 68.75 2aml h THR 99 CO 1.08 0.20 -0.16 0.77 -0.25 0.00 0.00 175.52 177.16 2aml h SER 100 N 0.11 -0.38 -0.74 5.36 4.64 -1.88 0.75 113.55 121.41 2aml h SER 100 Ca 0.02 -0.02 -0.02 0.00 -0.47 0.00 0.00 61.79 61.31 2aml h SER 100 Cb 0.33 0.10 -0.03 0.00 -0.31 0.00 0.00 62.40 62.49 2aml h SER 100 CO 0.02 -0.23 0.40 0.74 -0.87 0.00 0.00 176.83 176.89 2aml h THR 101 N -0.49 1.23 0.07 2.95 2.02 -1.82 -0.98 112.91 115.89 2aml h THR 101 Ca -0.05 -0.58 -0.00 0.00 0.77 0.00 0.00 66.41 66.55 2aml h THR 101 Cb 0.37 0.25 0.00 0.00 -1.74 0.00 0.00 68.15 67.04 2aml h THR 101 CO 0.07 0.25 -0.03 0.40 0.37 0.00 0.00 175.52 176.58 2aml h ILE 102 N 1.03 0.97 -0.05 3.11 2.04 -1.27 -2.02 117.51 121.33 2aml h ILE 102 Ca 0.26 -0.15 -0.07 0.00 1.00 0.00 0.00 64.86 65.90 2aml h ILE 102 Cb 0.05 1.07 -0.01 0.00 -0.74 0.00 0.00 36.82 37.19 2aml h ILE 102 CO -0.04 0.04 -0.29 0.77 0.00 0.00 0.00 178.15 178.63 2aml h SER 103 N -0.16 0.08 -0.28 1.72 4.64 -0.64 -1.54 113.55 117.37 2aml h SER 103 Ca -0.01 -0.02 -0.14 0.00 -0.47 0.00 0.00 61.79 61.15 2aml h SER 103 Cb 0.14 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 62.19 2aml h SER 103 CO 0.02 0.37 -0.32 0.00 -0.87 0.00 0.00 176.83 176.02 2aml h ALA 104 N 1.64 0.75 -0.49 5.18 0.00 -0.99 -2.20 119.26 123.14 2aml h ALA 104 Ca 0.01 -0.42 -0.12 0.00 0.00 0.00 0.00 54.91 54.38 2aml h ALA 104 Cb 0.55 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 2aml h ALA 104 CO 0.04 0.66 -0.16 -0.07 0.00 0.00 0.00 179.25 179.71 2aml h LEU 105 N 0.67 0.99 -0.69 0.00 3.38 -1.10 -2.49 115.31 116.08 2aml h LEU 105 Ca 0.07 -0.38 0.11 0.00 0.09 0.00 0.00 57.88 57.77 2aml h LEU 105 Cb 0.87 -0.27 -0.08 0.00 0.09 0.00 0.00 40.66 41.27 2aml h LEU 105 CO 0.08 1.14 0.29 -0.08 0.09 0.00 0.00 178.44 179.96 2aml h GLU 106 N 0.83 0.47 -0.61 1.13 4.81 -1.13 0.12 114.58 120.20 2aml h GLU 106 Ca 0.12 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.32 2aml h GLU 106 Cb 0.73 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.98 2aml h GLU 106 CO 0.06 0.31 0.39 -0.09 -0.73 0.00 0.00 179.01 178.94 2aml h ARG 107 N 0.48 0.81 -0.61 1.92 1.12 -1.13 -0.49 114.38 116.48 2aml h ARG 107 Ca 0.35 -0.06 -0.04 0.00 -1.11 0.00 0.00 59.98 59.13 2aml h ARG 107 Cb 0.45 -0.18 -0.03 0.00 -0.01 0.00 0.00 29.97 30.21 2aml h ARG 107 CO -0.32 0.55 0.23 0.28 -3.11 0.00 0.00 179.97 177.60 2aml h VAL 108 N 0.82 1.23 -0.58 0.20 2.07 -0.90 -0.49 116.25 118.60 2aml h VAL 108 Ca 0.22 -0.75 -0.06 0.00 0.82 0.00 0.00 66.70 66.94 2aml h VAL 108 Cb -0.07 0.58 -0.03 0.00 -1.52 0.00 0.00 31.29 30.26 2aml h VAL 108 CO -0.05 0.29 0.13 0.11 0.02 0.00 0.00 177.57 178.07 2aml h LYS 109 N 0.85 0.91 -0.02 1.57 1.79 -0.29 -1.49 116.57 119.88 2aml h LYS 109 Ca 0.20 -0.20 -0.18 0.00 -2.18 0.00 0.00 60.65 58.29 2aml h LYS 109 Cb 0.22 -0.13 -0.01 0.00 -1.58 0.00 0.00 32.23 30.73 2aml h LYS 109 CO -0.01 0.82 -0.78 0.87 -1.08 0.00 0.00 179.45 179.27 2aml h LYS 110 N 0.87 0.19 0.00 3.15 1.57 -0.79 -3.38 116.57 118.18 2aml h LYS 110 Ca 0.19 -0.18 -0.03 0.00 -1.87 0.00 0.00 60.65 58.76 2aml h LYS 110 Cb 0.34 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.69 2aml h LYS 110 CO 0.00 0.88 -1.87 0.39 -0.57 0.00 0.00 179.45 178.27 2aml n GLU 111 N -3.72 0.61 -4.25 3.15 1.02 -0.22 -5.03 120.64 112.20 2aml n GLU 111 Ca -0.03 -0.15 -0.14 0.00 -0.02 0.00 0.00 57.16 56.82 2aml n GLU 111 Cb 0.74 -1.44 -0.10 0.00 -0.02 0.00 0.00 31.44 30.62 2aml n GLU 111 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2aml s ALA 112 N -3.21 1.43 -1.93 0.62 0.00 -0.57 -5.04 121.76 113.05 2aml s ALA 112 Ca -0.07 -1.59 0.19 0.00 0.00 0.00 0.00 51.96 50.48 2aml s ALA 112 Cb 0.11 0.44 0.37 0.00 0.00 0.00 0.00 23.12 24.04 2aml s ALA 112 CO 0.76 -0.27 1.30 -1.13 0.00 0.00 0.00 175.76 176.42 2aml n SER 113 N -0.26 3.18 -4.78 0.00 3.41 -1.26 -4.64 113.62 109.28 2aml n SER 113 Ca -0.07 -1.92 -0.41 0.00 -0.26 0.00 0.00 58.87 56.21 2aml n SER 113 Cb 0.63 -0.23 -0.01 0.00 -0.26 0.00 0.00 64.21 64.34 2aml n SER 113 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2aml s VAL 114 N -1.25 2.23 0.53 -3.33 0.11 -1.26 -4.93 120.40 112.51 2aml s VAL 114 Ca 0.33 0.23 -0.21 0.00 -2.93 0.00 0.00 61.98 59.40 2aml s VAL 114 Cb 0.19 -3.15 -0.05 0.00 -1.53 0.00 0.00 36.38 31.84 2aml s VAL 114 CO 0.26 0.05 1.25 -2.16 -3.33 0.00 0.00 175.10 171.18 2aml s PRO 115 N -2.04 3.27 -0.08 1.54 0.04 -1.26 -4.86 135.00 131.60 2aml s PRO 115 Ca 0.52 1.97 0.02 0.00 0.04 0.00 0.00 61.00 63.55 2aml s PRO 115 Cb -0.44 -2.20 0.01 0.00 0.04 0.00 0.00 34.50 31.91 2aml s PRO 115 CO 0.60 -1.00 -0.13 0.08 0.04 0.00 0.00 177.00 176.59 2aml s VAL 116 N -1.46 1.25 -0.08 -0.36 1.01 -1.26 -1.35 120.40 118.16 2aml s VAL 116 Ca 0.71 -0.52 0.01 0.00 0.00 0.00 0.00 61.98 62.18 2aml s VAL 116 Cb -0.34 -1.15 -0.03 0.00 0.00 0.00 0.00 36.38 34.86 2aml s VAL 116 CO 0.39 0.39 -0.09 -0.69 0.00 0.00 0.00 175.10 175.10 2aml s VAL 117 N 0.84 3.50 -0.08 2.92 1.01 -0.01 -0.19 120.40 128.39 2aml s VAL 117 Ca -0.11 -0.55 0.01 0.00 0.00 0.00 0.00 61.98 61.33 2aml s VAL 117 Cb -0.15 -2.43 -0.03 0.00 0.00 0.00 0.00 36.38 33.77 2aml s VAL 117 CO 0.02 0.58 -0.07 0.00 0.00 0.00 0.00 175.10 175.62 2aml s ALA 118 N -0.56 2.94 -0.14 5.51 0.00 -0.44 -0.56 121.76 128.51 2aml s ALA 118 Ca 0.08 -0.89 0.02 0.00 0.00 0.00 0.00 51.96 51.17 2aml s ALA 118 Cb -0.12 -1.24 0.01 0.00 0.00 0.00 0.00 23.12 21.77 2aml s ALA 118 CO 0.02 0.52 -0.21 -0.51 0.00 0.00 0.00 175.76 175.58 2aml s LEU 119 N -0.63 2.17 0.20 0.00 1.43 0.33 0.08 118.68 122.26 2aml s LEU 119 Ca 0.09 -0.59 -0.18 0.00 -1.03 0.00 0.00 54.13 52.43 2aml s LEU 119 Cb -0.12 -1.46 0.03 0.00 0.03 0.00 0.00 46.19 44.67 2aml s LEU 119 CO 0.02 0.08 0.54 0.28 0.23 0.00 0.00 176.35 177.50 2aml s THR 120 N 0.84 0.02 -0.81 5.49 -1.32 -0.67 -1.63 115.64 117.57 2aml s THR 120 Ca -0.06 -0.76 0.26 0.00 -1.21 0.00 0.00 61.69 59.93 2aml s THR 120 Cb -0.15 -1.59 0.18 0.00 -1.51 0.00 0.00 72.50 69.43 2aml s THR 120 CO -0.02 -0.10 1.66 -1.54 -2.21 0.00 0.00 174.62 172.41 2aml n SER 121 N -0.35 0.54 -3.69 8.08 3.41 -0.05 -0.99 113.62 120.56 2aml n SER 121 Ca -0.10 0.34 -0.30 0.00 -0.26 0.00 0.00 58.87 58.55 2aml n SER 121 Cb 0.62 -0.35 -0.14 0.00 -0.26 0.00 0.00 64.21 64.08 2aml n SER 121 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2aml s ASP 122 N -3.87 3.75 0.15 4.04 2.15 -1.25 -4.64 116.67 117.00 2aml s ASP 122 Ca 0.10 -2.06 0.19 0.00 0.43 0.00 0.00 52.55 51.21 2aml s ASP 122 Cb 0.15 -0.86 0.80 0.00 -0.30 0.00 0.00 42.92 42.71 2aml s ASP 122 CO 0.62 -0.35 1.57 1.33 -0.17 0.00 0.00 175.17 178.18 2aml n VAL 123 N 4.28 0.97 1.44 1.11 0.24 -1.26 -1.78 118.33 123.33 2aml n VAL 123 Ca 0.04 0.29 0.14 0.00 -2.04 0.00 0.00 64.34 62.76 2aml n VAL 123 Cb 0.39 -1.16 0.50 0.00 -1.47 0.00 0.00 33.84 32.09 2aml n VAL 123 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 2aml n THR 124 N -1.92 0.00 -1.56 3.34 -2.24 -1.26 -4.71 114.28 105.93 2aml n THR 124 Ca 0.02 -0.20 -0.29 0.00 -2.27 0.00 0.00 64.05 61.31 2aml n THR 124 Cb 0.18 0.43 0.17 0.00 -2.10 0.00 0.00 70.33 69.01 2aml n THR 124 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2aml s SER 125 N -2.16 2.89 0.48 3.42 1.04 -0.73 -4.92 113.70 113.71 2aml s SER 125 Ca 0.34 0.70 0.15 0.00 0.48 0.00 0.00 55.95 57.61 2aml s SER 125 Cb 0.20 -1.05 1.15 0.00 0.10 0.00 0.00 66.02 66.42 2aml s SER 125 CO 0.39 -2.91 2.09 -0.33 0.98 0.00 0.00 173.24 173.46 2aml h GLU 126 N -1.75 0.19 -0.16 4.02 3.07 -1.87 -2.18 114.58 115.90 2aml h GLU 126 Ca -0.47 -0.01 -0.01 0.00 -0.50 0.00 0.00 59.36 58.36 2aml h GLU 126 Cb 1.30 -0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 29.16 2aml h GLU 126 CO 0.50 0.13 0.05 0.97 -1.40 0.00 0.00 179.01 179.26 2aml h ILE 127 N 0.20 1.07 0.00 3.13 2.10 -1.82 -2.35 117.51 119.84 2aml h ILE 127 Ca 0.10 -0.24 -0.00 0.00 1.08 0.00 0.00 64.86 65.80 2aml h ILE 127 Cb 0.17 0.90 -0.00 0.00 -1.09 0.00 0.00 36.82 36.80 2aml h ILE 127 CO -0.02 0.09 -0.01 0.00 -1.08 0.00 0.00 178.15 177.13 2aml h ALA 128 N 1.84 1.39 -0.18 0.18 0.00 -1.67 -2.46 119.26 118.37 2aml h ALA 128 Ca 0.06 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 2aml h ALA 128 Cb 0.07 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 2aml h ALA 128 CO -0.00 0.01 0.00 1.49 0.00 0.00 0.00 179.25 180.75 2aml h GLU 129 N 0.00 0.25 -0.51 0.00 4.81 -1.61 -3.08 114.58 114.45 2aml h GLU 129 Ca -0.00 -0.04 -0.21 0.00 -0.13 0.00 0.00 59.36 58.99 2aml h GLU 129 Cb 0.02 -0.05 -0.12 0.00 0.63 0.00 0.00 28.75 29.23 2aml h GLU 129 CO 0.00 0.28 0.12 1.19 -0.73 0.00 0.00 179.01 179.87 2aml n PHE 130 N -4.39 1.62 -4.21 0.92 3.72 -0.92 -4.93 117.46 109.27 2aml n PHE 130 Ca -0.00 -1.44 -0.18 0.00 -0.05 0.00 0.00 57.45 55.78 2aml n PHE 130 Cb 0.17 -0.57 -0.12 0.00 -0.94 0.00 0.00 39.48 38.02 2aml n PHE 130 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2aml s ALA 131 N -3.13 1.10 0.16 4.37 0.00 -1.17 -4.66 121.76 118.43 2aml s ALA 131 Ca 0.48 -0.92 -0.07 0.00 0.00 0.00 0.00 51.96 51.45 2aml s ALA 131 Cb 0.41 -0.11 0.00 0.00 0.00 0.00 0.00 23.12 23.43 2aml s ALA 131 CO 0.06 0.16 1.44 -0.44 0.00 0.00 0.00 175.76 176.98 2aml h ASP 132 N 4.51 0.77 -4.42 0.00 3.32 -0.89 -3.45 116.42 116.27 2aml h ASP 132 Ca -0.39 -0.44 -0.20 0.00 0.02 0.00 0.00 57.03 56.02 2aml h ASP 132 Cb 1.19 -0.22 -0.24 0.00 0.22 0.00 0.00 39.33 40.27 2aml h ASP 132 CO 0.41 1.19 -0.71 0.27 -1.72 0.00 0.00 179.24 178.69 2aml s ILE 133 N -3.97 0.06 -0.17 0.35 -4.36 -1.14 -5.06 121.20 106.92 2aml s ILE 133 Ca -0.09 -0.50 0.00 0.00 -0.26 0.00 0.00 60.65 59.81 2aml s ILE 133 Cb 0.10 -0.15 0.03 0.00 1.25 0.00 0.00 42.46 43.70 2aml s ILE 133 CO 0.87 -0.28 -0.12 -0.89 0.24 0.00 0.00 174.94 174.76 2aml s THR 134 N -0.80 1.55 -0.08 8.37 2.01 -1.26 -1.32 115.64 124.11 2aml s THR 134 Ca -0.09 -0.75 -0.03 0.00 0.31 0.00 0.00 61.69 61.13 2aml s THR 134 Cb -0.06 -1.53 -0.04 0.00 0.01 0.00 0.00 72.50 70.88 2aml s THR 134 CO -0.01 0.33 0.07 -0.76 -0.69 0.00 0.00 174.62 173.57 2aml s LEU 135 N 1.47 3.92 -0.15 4.42 1.43 0.11 -4.96 118.68 124.92 2aml s LEU 135 Ca 0.03 0.25 -0.20 0.00 -1.03 0.00 0.00 54.13 53.17 2aml s LEU 135 Cb -0.14 -2.02 -0.03 0.00 0.03 0.00 0.00 46.19 44.03 2aml s LEU 135 CO -0.10 0.36 0.60 -0.62 0.23 0.00 0.00 176.35 176.82 2aml s ASP 136 N -1.15 6.73 0.30 2.29 -1.08 -1.26 -1.66 116.67 120.84 2aml s ASP 136 Ca 0.16 0.88 0.25 0.00 -0.52 0.00 0.00 52.55 53.32 2aml s ASP 136 Cb -0.12 -2.34 1.05 0.00 -1.46 0.00 0.00 42.92 40.05 2aml s ASP 136 CO 0.06 -0.17 1.75 0.16 0.52 0.00 0.00 175.17 177.49 2aml h ILE 137 N 4.98 0.00 0.00 4.11 3.07 -1.40 -3.47 117.51 124.80 2aml h ILE 137 Ca -0.36 -0.26 0.00 0.00 1.55 0.00 0.00 64.86 65.80 2aml h ILE 137 Cb 1.16 1.01 0.00 0.00 -0.27 0.00 0.00 36.82 38.73 2aml h ILE 137 CO 0.76 0.00 0.00 0.61 -1.05 0.00 0.00 178.15 178.47 2aml n GLY 138 N -0.06 0.84 0.09 0.16 0.00 -1.26 -4.63 105.19 100.33 2aml n GLY 138 Ca 0.02 -0.01 -0.03 0.00 0.00 0.00 0.00 46.02 46.00 2aml n GLY 138 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2aml h SER 139 N 0.00 0.00 -2.68 1.61 4.64 -1.90 -3.47 113.55 111.74 2aml h SER 139 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2aml h SER 139 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2aml h SER 139 CO 0.00 0.74 0.00 0.61 -0.87 0.00 0.00 176.83 177.31 2aml n GLY 140 N 1.39 -1.60 3.66 -0.77 0.00 -1.26 -4.79 105.19 101.81 2aml n GLY 140 Ca -0.07 -1.27 -0.41 0.00 0.00 0.00 0.00 46.02 44.28 2aml n GLY 140 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2aml s LYS 141 N 0.00 4.23 -0.37 1.61 2.20 -1.26 -4.91 119.74 121.23 2aml s LYS 141 Ca 0.00 0.82 -0.11 0.00 -0.36 0.00 0.00 55.97 56.32 2aml s LYS 141 Cb 0.00 -3.60 0.03 0.00 -1.51 0.00 0.00 37.83 32.75 2aml s LYS 141 CO 0.00 -0.34 0.20 -2.00 -0.36 0.00 0.00 175.35 172.85 2aml s GLU 142 N 2.23 2.83 -0.33 4.03 2.12 -1.26 -4.97 118.70 123.36 2aml s GLU 142 Ca 0.33 -1.07 0.07 0.00 0.36 0.00 0.00 54.97 54.66 2aml s GLU 142 Cb -0.16 -3.72 0.65 0.00 0.26 0.00 0.00 34.13 31.17 2aml s GLU 142 CO 0.10 -0.69 1.74 0.54 -0.54 0.00 0.00 175.26 176.42 2aml n ARG 143 N 4.99 3.06 -5.21 4.30 1.74 -1.26 -4.74 116.66 119.54 2aml n ARG 143 Ca -0.12 -2.75 -0.32 0.00 -0.77 0.00 0.00 57.85 53.90 2aml n ARG 143 Cb 0.46 -2.11 -0.17 0.00 -1.02 0.00 0.00 32.46 29.62 2aml n ARG 143 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2aml s VAL 144 N -2.81 2.04 0.37 1.55 1.01 -1.26 -0.65 120.40 120.65 2aml s VAL 144 Ca 0.50 -1.01 0.23 0.00 0.00 0.00 0.00 61.98 61.69 2aml s VAL 144 Cb 0.41 -1.76 0.23 0.00 0.00 0.00 0.00 36.38 35.25 2aml s VAL 144 CO 0.12 0.56 1.98 1.23 0.00 0.00 0.00 175.10 178.98 2aml h GLY 145 N 6.66 0.00 -7.78 4.51 0.00 -1.93 -3.35 103.07 101.18 2aml h GLY 145 Ca -0.20 0.00 -0.71 0.00 0.00 0.00 0.00 47.33 46.42 2aml h GLY 145 CO 0.47 0.00 1.82 -1.72 0.00 0.00 0.00 176.54 177.11 2aml n TYR 146 N -3.77 4.80 -2.07 5.60 4.01 -1.26 -4.97 117.16 119.50 2aml n TYR 146 Ca -0.02 -3.08 -0.40 0.00 -0.16 0.00 0.00 57.90 54.24 2aml n TYR 146 Cb 0.30 -2.43 -0.01 0.00 -0.31 0.00 0.00 39.34 36.89 2aml n TYR 146 CO 0.00 0.00 0.00 0.14 -0.46 0.00 0.00 176.86 176.54 2aml s VAL 147 N 2.98 2.64 0.00 -0.72 -7.23 -1.26 -4.92 120.40 111.90 2aml s VAL 147 Ca 0.49 0.61 0.00 0.00 -1.81 0.00 0.00 61.98 61.27 2aml s VAL 147 Cb 0.01 -3.37 0.00 0.00 0.56 0.00 0.00 36.38 33.57 2aml s VAL 147 CO 0.04 0.12 0.00 0.35 -0.31 0.00 0.00 175.10 175.30 2aml n THR 148 N 0.44 0.00 -0.21 5.32 -2.24 -1.26 -4.71 114.28 111.62 2aml n THR 148 Ca 0.02 0.00 0.06 0.00 -2.27 0.00 0.00 64.05 61.86 2aml n THR 148 Cb 0.43 -0.50 0.33 0.00 -2.10 0.00 0.00 70.33 68.49 2aml n THR 148 CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 2aml h LYS 149 N 0.00 0.78 -0.48 -0.78 2.10 -1.92 -1.98 116.57 114.29 2aml h LYS 149 Ca 0.00 -0.05 -0.07 0.00 -2.00 0.00 0.00 60.65 58.53 2aml h LYS 149 Cb 0.00 -0.18 -0.02 0.00 -0.90 0.00 0.00 32.23 31.13 2aml h LYS 149 CO 0.00 0.51 0.01 0.78 -2.00 0.00 0.00 179.45 178.75 2aml h GLY 150 N 0.80 0.86 0.85 0.07 0.00 -1.92 0.64 103.07 104.37 2aml h GLY 150 Ca 0.33 -0.57 -0.01 0.00 0.00 0.00 0.00 47.33 47.09 2aml h GLY 150 CO -0.12 0.53 -0.06 -2.75 0.00 0.00 0.00 176.54 174.15 2aml h PHE 151 N 0.75 -0.14 -0.67 5.60 3.57 -1.66 -1.62 116.94 122.75 2aml h PHE 151 Ca 0.15 -0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.67 2aml h PHE 151 Cb 0.44 0.05 -0.04 0.00 2.79 0.00 0.00 35.95 39.19 2aml h PHE 151 CO 0.02 0.04 0.42 1.15 -2.23 0.00 0.00 178.31 177.72 2aml h THR 152 N -0.31 1.09 -0.91 4.41 2.02 -1.22 -1.29 112.91 116.71 2aml h THR 152 Ca -0.02 -0.28 0.01 0.00 0.77 0.00 0.00 66.41 66.89 2aml h THR 152 Cb 0.25 0.20 -0.05 0.00 -1.74 0.00 0.00 68.15 66.81 2aml h THR 152 CO 0.03 0.15 0.60 0.00 0.37 0.00 0.00 175.52 176.67 2aml h ALA 153 N 1.29 1.36 -0.18 6.16 0.00 -0.81 -0.80 119.26 126.27 2aml h ALA 153 Ca 0.27 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 55.06 2aml h ALA 153 Cb 0.01 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 17.43 2aml h ALA 153 CO -0.10 0.59 -0.12 1.15 0.00 0.00 0.00 179.25 180.77 2aml h THR 154 N 1.22 1.32 -0.25 0.00 2.02 -0.51 0.83 112.91 117.54 2aml h THR 154 Ca 0.33 -1.21 -0.00 0.00 0.77 0.00 0.00 66.41 66.30 2aml h THR 154 Cb -0.13 1.72 -0.01 0.00 -1.74 0.00 0.00 68.15 67.99 2aml h THR 154 CO -0.07 0.36 0.14 0.58 0.37 0.00 0.00 175.52 176.90 2aml h VAL 155 N 0.08 1.11 -0.22 3.16 2.07 -0.99 -0.71 116.25 120.75 2aml h VAL 155 Ca 0.04 -0.29 -0.01 0.00 0.82 0.00 0.00 66.70 67.25 2aml h VAL 155 Cb 0.62 0.86 -0.01 0.00 -1.52 0.00 0.00 31.29 31.24 2aml h VAL 155 CO 0.03 0.11 0.09 0.25 0.02 0.00 0.00 177.57 178.07 2aml h LEU 156 N 0.29 0.31 -0.68 2.57 5.85 -1.09 -2.82 115.31 119.75 2aml h LEU 156 Ca 0.09 -0.17 0.05 0.00 0.84 0.00 0.00 57.88 58.69 2aml h LEU 156 Cb 0.06 -0.08 -0.05 0.00 0.37 0.00 0.00 40.66 40.95 2aml h LEU 156 CO -0.01 0.40 0.39 0.74 -0.34 0.00 0.00 178.44 179.61 2aml h THR 157 N 0.20 0.99 0.00 1.05 2.02 -0.70 0.18 112.91 116.65 2aml h THR 157 Ca 0.07 -0.25 0.00 0.00 0.77 0.00 0.00 66.41 67.01 2aml h THR 157 Cb 0.19 0.21 0.00 0.00 -1.74 0.00 0.00 68.15 66.81 2aml h THR 157 CO -0.01 0.13 0.00 0.18 0.37 0.00 0.00 175.52 176.20 2aml n LEU 158 N -4.76 0.37 0.00 2.58 4.77 -0.29 -1.14 117.00 118.53 2aml n LEU 158 Ca 0.08 -0.18 0.00 0.00 -0.03 0.00 0.00 56.01 55.88 2aml n LEU 158 Cb 0.16 -0.13 0.00 0.00 -2.33 0.00 0.00 43.42 41.12 2aml n LEU 158 CO 0.30 0.08 0.00 0.18 -1.33 0.00 0.00 177.39 176.62 2aml n LEU 160 N 0.48 0.00 -0.11 2.23 4.77 0.05 -1.04 117.00 123.38 2aml n LEU 160 Ca 0.00 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.89 2aml n LEU 160 Cb 0.08 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.15 2aml n LEU 160 CO 0.00 0.00 0.92 0.74 -1.33 0.00 0.00 177.39 177.72 2aml h THR 161 N 0.00 1.18 -0.60 -5.08 2.02 -1.35 -1.03 112.91 108.04 2aml h THR 161 Ca 0.00 -0.53 -0.08 0.00 0.77 0.00 0.00 66.41 66.57 2aml h THR 161 Cb 0.00 0.88 -0.02 0.00 -1.74 0.00 0.00 68.15 67.26 2aml h THR 161 CO 0.00 0.19 0.08 1.23 0.37 0.00 0.00 175.52 177.39 2aml h GLY 162 N 0.42 1.07 0.79 2.16 0.00 -1.33 -0.43 103.07 105.76 2aml h GLY 162 Ca 0.12 -0.70 0.02 0.00 0.00 0.00 0.00 47.33 46.76 2aml h GLY 162 CO -0.01 0.65 -0.06 -2.00 0.00 0.00 0.00 176.54 175.12 2aml h LEU 163 N 0.93 -0.19 -0.73 3.11 5.85 -1.77 -0.18 115.31 122.33 2aml h LEU 163 Ca 0.18 0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.92 2aml h LEU 163 Cb 0.43 0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.52 2aml h LEU 163 CO 0.01 -0.09 0.39 -0.74 -0.34 0.00 0.00 178.44 177.67 2aml h HIS 164 N -0.10 1.01 -0.30 1.25 2.76 -1.03 -1.30 115.15 117.43 2aml h HIS 164 Ca 0.04 -0.03 0.03 0.00 -2.20 0.00 0.00 60.37 58.21 2aml h HIS 164 Cb 0.15 -0.32 -0.03 0.00 1.55 0.00 0.00 27.41 28.75 2aml h HIS 164 CO -0.15 0.72 0.10 0.35 -1.30 0.00 0.00 177.93 177.65 2aml h PHE 165 N 1.00 0.18 -0.62 5.26 3.57 -0.82 0.27 116.94 125.78 2aml h PHE 165 Ca 0.25 0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.81 2aml h PHE 165 Cb 0.06 -0.03 -0.05 0.00 2.79 0.00 0.00 35.95 38.71 2aml h PHE 165 CO 0.00 0.07 0.36 0.00 -2.23 0.00 0.00 178.31 176.51 2aml h ALA 166 N 1.20 0.82 -0.16 2.41 0.00 -0.74 -1.66 119.26 121.13 2aml h ALA 166 Ca 0.14 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.98 2aml h ALA 166 Cb 0.11 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.75 2aml h ALA 166 CO -0.15 0.06 -0.18 -0.92 0.00 0.00 0.00 179.25 178.07 2aml h TYR 167 N 0.69 0.48 -0.90 0.00 3.20 -0.80 0.12 116.97 119.75 2aml h TYR 167 Ca 0.27 -0.15 0.02 0.00 3.14 0.00 0.00 58.73 62.00 2aml h TYR 167 Cb 0.10 -0.10 -0.05 0.00 1.54 0.00 0.00 36.73 38.23 2aml h TYR 167 CO -0.07 0.79 0.60 -0.22 -1.64 0.00 0.00 178.16 177.62 2aml h LYS 168 N 0.03 1.16 -0.17 1.82 1.63 -0.39 -0.91 116.57 119.75 2aml h LYS 168 Ca 0.02 -0.07 0.00 0.00 -0.85 0.00 0.00 60.65 59.75 2aml h LYS 168 Cb 0.72 -0.26 0.00 0.00 -0.60 0.00 0.00 32.23 32.09 2aml h LYS 168 CO 0.04 0.77 0.00 0.25 -3.45 0.00 0.00 179.45 177.06 2aml n THR 169 N -4.41 0.22 -2.06 1.00 -2.24 -0.63 -4.92 114.28 101.24 2aml n THR 169 Ca 0.11 -0.27 -0.14 0.00 -2.27 0.00 0.00 64.05 61.48 2aml n THR 169 Cb 0.04 0.15 -0.02 0.00 -2.10 0.00 0.00 70.33 68.41 2aml n THR 169 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2aml n VAL 170 N 0.06 -0.51 0.11 2.28 0.31 -0.35 -4.90 118.33 115.34 2aml n VAL 170 Ca 0.12 0.00 0.05 0.00 -0.01 0.00 0.00 64.34 64.50 2aml n VAL 170 Cb 0.22 -2.00 0.01 0.00 -0.91 0.00 0.00 33.84 31.16 2aml n VAL 170 CO 0.00 0.00 0.00 1.56 -1.32 0.00 0.00 176.83 177.07 2aml h GLN 171 N 0.00 0.00 -5.50 5.55 4.20 -1.20 -3.46 115.11 114.70 2aml h GLN 171 Ca -0.32 0.00 -0.43 0.00 0.06 0.00 0.00 58.65 57.96 2aml h GLN 171 Cb 1.17 0.00 -0.16 0.00 0.30 0.00 0.00 27.48 28.79 2aml h GLN 171 CO 0.40 0.27 -0.74 0.96 -0.67 0.00 0.00 178.83 179.05 2aml s ILE 172 N -3.06 1.55 0.70 2.54 -4.36 -1.14 -4.96 121.20 112.48 2aml s ILE 172 Ca 0.01 -2.02 -0.02 0.00 -0.26 0.00 0.00 60.65 58.37 2aml s ILE 172 Cb 0.08 -1.85 0.11 0.00 1.25 0.00 0.00 42.46 42.04 2aml s ILE 172 CO 0.76 -0.53 0.98 1.51 0.24 0.00 0.00 174.94 177.90 2aml s ASP 173 N -2.97 4.49 0.26 4.36 1.47 -1.26 -4.62 116.67 118.40 2aml s ASP 173 Ca 0.17 -0.14 -0.03 0.00 1.18 0.00 0.00 52.55 53.73 2aml s ASP 173 Cb -0.02 -0.35 0.33 0.00 -0.34 0.00 0.00 42.92 42.53 2aml s ASP 173 CO 0.05 -1.75 1.79 -0.08 0.68 0.00 0.00 175.17 175.85 2aml h GLU 174 N -0.51 0.89 -0.31 2.11 4.81 -1.99 -1.59 114.58 117.99 2aml h GLU 174 Ca -0.39 -0.20 0.02 0.00 -0.13 0.00 0.00 59.36 58.66 2aml h GLU 174 Cb 1.28 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 30.51 2aml h GLU 174 CO 0.45 0.81 0.17 1.15 -0.73 0.00 0.00 179.01 180.87 2aml h THR 175 N 0.85 1.02 -0.58 0.32 2.02 -1.99 -1.02 112.91 113.53 2aml h THR 175 Ca 0.18 -0.12 -0.03 0.00 0.77 0.00 0.00 66.41 67.21 2aml h THR 175 Cb 0.34 0.63 -0.03 0.00 -1.74 0.00 0.00 68.15 67.35 2aml h THR 175 CO 0.00 0.07 0.24 -0.09 0.37 0.00 0.00 175.52 176.10 2aml h ARG 176 N 0.36 0.86 -0.09 6.66 9.65 -1.85 -0.11 114.38 129.86 2aml h ARG 176 Ca 0.13 -0.15 0.01 0.00 -1.10 0.00 0.00 59.98 58.86 2aml h ARG 176 Cb 0.01 -0.14 -0.01 0.00 -1.39 0.00 0.00 29.97 28.44 2aml h ARG 176 CO -0.07 0.74 0.01 0.35 2.80 0.00 0.00 179.97 183.80 2aml h PHE 177 N 0.80 0.01 -0.30 2.20 3.57 -1.06 0.32 116.94 122.48 2aml h PHE 177 Ca 0.19 0.01 -0.10 0.00 3.53 0.00 0.00 57.97 61.60 2aml h PHE 177 Cb 0.19 0.01 -0.01 0.00 2.79 0.00 0.00 35.95 38.93 2aml h PHE 177 CO 0.01 -0.00 -0.22 -0.91 -2.23 0.00 0.00 178.31 174.95 2aml h ASN 178 N 0.04 0.56 -0.19 0.41 2.35 -1.04 -1.81 115.58 115.89 2aml h ASN 178 Ca 0.04 -0.19 -0.09 0.00 -0.55 0.00 0.00 56.30 55.51 2aml h ASN 178 Cb 0.04 -0.15 -0.02 0.00 0.05 0.00 0.00 38.32 38.24 2aml h ASN 178 CO -0.06 0.78 -0.18 0.78 -1.65 0.00 0.00 177.43 177.10 2aml h ASN 179 N 0.50 0.62 -0.41 5.81 2.35 -0.60 -1.28 115.58 122.56 2aml h ASN 179 Ca 0.08 -0.19 -0.07 0.00 -0.55 0.00 0.00 56.30 55.56 2aml h ASN 179 Cb 0.66 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 38.85 2aml h ASN 179 CO 0.05 0.80 -0.03 -0.33 -1.65 0.00 0.00 177.43 176.27 2aml h GLU 180 N 0.56 0.75 -0.46 0.81 4.39 -0.62 -1.28 114.58 118.74 2aml h GLU 180 Ca 0.09 -0.25 0.03 0.00 0.34 0.00 0.00 59.36 59.56 2aml h GLU 180 Cb 0.62 -0.06 -0.04 0.00 -0.10 0.00 0.00 28.75 29.18 2aml h GLU 180 CO 0.04 0.85 0.25 0.82 -1.16 0.00 0.00 179.01 179.81 2aml h ILE 181 N 0.58 1.00 -0.64 3.13 2.04 -1.05 -1.69 117.51 120.89 2aml h ILE 181 Ca 0.11 -0.17 -0.00 0.00 1.00 0.00 0.00 64.86 65.80 2aml h ILE 181 Cb 0.53 0.46 -0.03 0.00 -0.74 0.00 0.00 36.82 37.04 2aml h ILE 181 CO 0.03 0.09 0.40 0.28 0.00 0.00 0.00 178.15 178.94 2aml h SER 182 N 0.50 0.75 -0.28 1.72 0.02 -1.10 -0.34 113.55 114.82 2aml h SER 182 Ca 0.19 -0.03 -0.03 0.00 -0.84 0.00 0.00 61.79 61.08 2aml h SER 182 Cb 0.06 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.40 2aml h SER 182 CO -0.11 0.57 0.07 0.00 -1.14 0.00 0.00 176.83 176.21 2aml h ALA 183 N 1.57 0.37 -0.37 3.77 0.00 -0.53 -1.12 119.26 122.94 2aml h ALA 183 Ca 0.23 -0.16 -0.09 0.00 0.00 0.00 0.00 54.91 54.88 2aml h ALA 183 Cb -0.06 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 2aml h ALA 183 CO -0.05 0.02 -0.16 0.74 0.00 0.00 0.00 179.25 179.81 2aml h PHE 184 N 0.28 0.74 -0.59 0.00 0.04 -1.03 -1.35 116.94 115.03 2aml h PHE 184 Ca 0.09 -0.14 -0.01 0.00 2.80 0.00 0.00 57.97 60.70 2aml h PHE 184 Cb 0.28 -0.19 -0.03 0.00 2.20 0.00 0.00 35.95 38.22 2aml h PHE 184 CO 0.01 0.79 0.31 0.77 -0.60 0.00 0.00 178.31 179.59 2aml h SER 185 N 0.60 0.74 -0.68 2.17 0.02 -0.84 0.02 113.55 115.58 2aml h SER 185 Ca 0.10 -0.10 -0.06 0.00 -0.84 0.00 0.00 61.79 60.88 2aml h SER 185 Cb 0.61 -0.19 -0.03 0.00 0.14 0.00 0.00 62.40 62.93 2aml h SER 185 CO 0.04 0.63 0.18 -0.09 -1.14 0.00 0.00 176.83 176.45 2aml h ARG 186 N 0.79 1.09 -0.52 3.45 2.43 -1.06 -1.20 114.38 119.37 2aml h ARG 186 Ca 0.20 -0.25 -0.08 0.00 -0.81 0.00 0.00 59.98 59.04 2aml h ARG 186 Cb 0.06 -0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 29.44 2aml h ARG 186 CO -0.03 0.96 0.02 0.00 -1.51 0.00 0.00 179.97 179.40 2aml h ALA 187 N 1.15 0.70 -0.48 2.80 0.00 -0.78 -0.96 119.26 121.70 2aml h ALA 187 Ca 0.22 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 2aml h ALA 187 Cb 0.35 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 2aml h ALA 187 CO -0.00 0.51 0.29 0.82 0.00 0.00 0.00 179.25 180.87 2aml h ILE 188 N 0.79 1.14 0.00 0.00 2.04 -0.74 -2.25 117.51 118.50 2aml h ILE 188 Ca 0.15 -0.32 -0.02 0.00 1.00 0.00 0.00 64.86 65.68 2aml h ILE 188 Cb 0.50 0.50 -0.00 0.00 -0.74 0.00 0.00 36.82 37.08 2aml h ILE 188 CO 0.02 0.15 -0.08 0.44 0.00 0.00 0.00 178.15 178.67 2aml h ASP 189 N 0.64 0.00 0.01 1.72 3.32 -0.78 -1.46 116.42 119.87 2aml h ASP 189 Ca 0.17 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.22 2aml h ASP 189 Cb -0.02 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.53 2aml h ASP 189 CO -0.03 0.08 -0.00 0.00 -1.72 0.00 0.00 179.24 177.57 2aml n ALA 190 N -2.20 2.65 0.10 3.45 0.00 -0.40 -4.34 120.51 119.76 2aml n ALA 190 Ca -0.01 -0.29 -0.13 0.00 0.00 0.00 0.00 53.44 53.00 2aml n ALA 190 Cb 0.24 -1.38 -0.08 0.00 0.00 0.00 0.00 19.45 18.23 2aml n ALA 190 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 2aml h ILE 191 N 0.89 0.89 -0.84 0.00 2.04 -1.09 -0.72 117.51 118.68 2aml h ILE 191 Ca 0.00 -0.10 0.05 0.00 1.00 0.00 0.00 64.86 65.81 2aml h ILE 191 Cb 0.20 0.95 -0.06 0.00 -0.74 0.00 0.00 36.82 37.17 2aml h ILE 191 CO 0.00 0.02 0.53 -0.65 0.00 0.00 0.00 178.15 178.05 2aml h PRO 192 N -0.23 0.95 -0.07 2.37 0.11 -1.80 0.04 132.00 133.37 2aml h PRO 192 Ca -0.02 -0.06 -0.07 0.00 0.11 0.00 0.00 66.00 65.96 2aml h PRO 192 Cb 0.18 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 31.07 2aml h PRO 192 CO 0.03 0.63 -0.30 0.00 -0.21 0.00 0.00 178.00 178.14 2aml h ALA 193 N 1.39 1.38 -0.21 -0.75 0.00 -1.80 -1.20 119.26 118.06 2aml h ALA 193 Ca 0.36 -0.31 -0.20 0.00 0.00 0.00 0.00 54.91 54.76 2aml h ALA 193 Cb 0.13 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.85 2aml h ALA 193 CO -0.16 0.45 -0.66 1.15 0.00 0.00 0.00 179.25 180.03 2aml h THR 194 N 0.11 1.28 -0.15 0.00 2.02 0.10 -0.69 112.91 115.58 2aml h THR 194 Ca 0.01 -1.86 0.03 0.00 0.77 0.00 0.00 66.41 65.36 2aml h THR 194 Cb 0.59 1.81 -0.03 0.00 -1.74 0.00 0.00 68.15 68.79 2aml h THR 194 CO 0.04 0.60 -0.03 0.40 0.37 0.00 0.00 175.52 176.90 2aml h ILE 195 N 0.58 0.85 -0.87 3.11 2.04 -0.85 -1.27 117.51 121.11 2aml h ILE 195 Ca -0.02 -0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.82 2aml h ILE 195 Cb 1.27 0.85 -0.04 0.00 -0.74 0.00 0.00 36.82 38.16 2aml h ILE 195 CO 0.14 0.00 0.44 0.00 0.00 0.00 0.00 178.15 178.73 2aml h ALA 196 N 1.15 1.11 -0.63 1.87 0.00 -1.04 -0.60 119.26 121.12 2aml h ALA 196 Ca 0.07 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 54.75 2aml h ALA 196 Cb 0.11 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 2aml h ALA 196 CO -0.15 0.65 0.06 1.49 0.00 0.00 0.00 179.25 181.30 2aml h GLU 197 N 1.22 1.05 -0.58 0.00 4.57 -0.96 -1.59 114.58 118.30 2aml h GLU 197 Ca 0.30 -0.29 -0.07 0.00 -1.18 0.00 0.00 59.36 58.12 2aml h GLU 197 Cb 0.08 -0.12 -0.02 0.00 -0.16 0.00 0.00 28.75 28.53 2aml h GLU 197 CO -0.04 0.99 0.11 1.15 -1.18 0.00 0.00 179.01 180.03 2aml h THR 198 N 0.98 1.26 -0.72 0.32 2.02 -0.85 -0.19 112.91 115.72 2aml h THR 198 Ca 0.19 -0.96 0.02 0.00 0.77 0.00 0.00 66.41 66.43 2aml h THR 198 Cb 0.48 0.75 -0.04 0.00 -1.74 0.00 0.00 68.15 67.60 2aml h THR 198 CO 0.02 0.35 0.46 -0.33 0.37 0.00 0.00 175.52 176.39 2aml h GLU 199 N 0.86 0.88 -0.48 6.66 4.39 -0.82 0.12 114.58 126.18 2aml h GLU 199 Ca 0.18 -0.05 -0.06 0.00 0.34 0.00 0.00 59.36 59.76 2aml h GLU 199 Cb 0.40 -0.20 -0.02 0.00 -0.10 0.00 0.00 28.75 28.83 2aml h GLU 199 CO 0.01 0.58 0.06 0.00 -1.16 0.00 0.00 179.01 178.50 2aml h ALA 200 N 1.30 0.64 -0.35 3.43 0.00 -0.80 -0.33 119.26 123.15 2aml h ALA 200 Ca 0.28 -0.24 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 2aml h ALA 200 Cb -0.01 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 2aml h ALA 200 CO -0.10 0.39 0.01 0.35 0.00 0.00 0.00 179.25 179.90 2aml h PHE 201 N 0.68 0.65 -0.23 0.00 3.57 -0.72 -1.48 116.94 119.42 2aml h PHE 201 Ca 0.14 -0.11 -0.00 0.00 3.53 0.00 0.00 57.97 61.54 2aml h PHE 201 Cb 0.42 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 38.97 2aml h PHE 201 CO 0.03 0.70 0.14 -0.92 -2.23 0.00 0.00 178.31 176.03 2aml h TYR 202 N 0.42 0.30 -0.76 0.41 3.20 -0.56 -2.00 116.97 117.98 2aml h TYR 202 Ca 0.10 0.00 0.01 0.00 3.14 0.00 0.00 58.73 61.98 2aml h TYR 202 Cb 0.43 -0.10 -0.04 0.00 1.54 0.00 0.00 36.73 38.57 2aml h TYR 202 CO 0.03 0.22 0.50 0.93 -1.64 0.00 0.00 178.16 178.21 2aml h GLU 203 N 0.29 0.99 -0.47 1.82 4.39 -0.89 0.20 114.58 120.90 2aml h GLU 203 Ca 0.08 -0.06 -0.10 0.00 0.34 0.00 0.00 59.36 59.62 2aml h GLU 203 Cb 0.01 -0.22 -0.02 0.00 -0.10 0.00 0.00 28.75 28.42 2aml h GLU 203 CO -0.02 0.65 -0.11 -0.09 -1.16 0.00 0.00 179.01 178.29 2aml h ARG 204 N 1.02 0.86 -0.15 2.33 2.43 -0.88 -3.32 114.38 116.67 2aml h ARG 204 Ca 0.28 -0.29 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 2aml h ARG 204 Cb -0.10 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.39 2aml h ARG 204 CO -0.06 0.93 0.00 0.91 -1.51 0.00 0.00 179.97 180.23 2aml n TRP 205 N -4.16 0.20 -0.16 2.20 7.02 -0.79 -4.73 117.44 117.03 2aml n TRP 205 Ca 0.01 -0.38 0.08 0.00 -1.02 0.00 0.00 57.50 56.20 2aml n TRP 205 Cb 0.38 -0.03 0.40 0.00 -2.42 0.00 0.00 31.31 29.63 2aml n TRP 205 CO 0.00 0.00 0.00 -0.56 -2.02 0.00 0.00 177.69 175.11 2aml h GLN 206 N 1.18 0.63 0.00 -0.99 3.07 -0.71 0.16 115.11 118.45 2aml h GLN 206 Ca 0.00 -0.04 -0.02 0.00 0.09 0.00 0.00 58.65 58.68 2aml h GLN 206 Cb 0.55 -0.14 -0.00 0.00 0.08 0.00 0.00 27.48 27.96 2aml h GLN 206 CO 0.00 0.42 -0.09 0.93 0.09 0.00 0.00 178.83 180.17 2aml h GLU 207 N 0.65 0.00 0.00 0.06 3.07 -1.85 -0.28 114.58 116.23 2aml h GLU 207 Ca 0.31 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.17 2aml h GLU 207 Cb 0.37 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.28 2aml h GLU 207 CO -0.11 0.09 0.00 0.93 -1.40 0.00 0.00 179.01 178.53 2aml h GLU 208 N 0.00 0.00 0.00 2.33 5.08 -1.04 -3.32 114.58 117.63 2aml h GLU 208 Ca -0.00 0.00 -0.21 0.00 -1.00 0.00 0.00 59.36 58.15 2aml h GLU 208 Cb 0.20 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.42 2aml h GLU 208 CO 0.01 0.00 -1.67 1.19 -1.00 0.00 0.00 179.01 177.55 2aml n PHE 209 N -2.80 0.77 -0.22 4.33 3.72 -0.17 -4.22 117.46 118.87 2aml n PHE 209 Ca 0.04 0.26 0.01 0.00 -0.05 0.00 0.00 57.45 57.72 2aml n PHE 209 Cb 0.46 -1.06 0.13 0.00 -0.94 0.00 0.00 39.48 38.08 2aml n PHE 209 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2aml h ALA 210 N 1.31 0.85 -0.22 4.37 0.00 -1.50 -2.48 119.26 121.59 2aml h ALA 210 Ca -0.24 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 2aml h ALA 210 Cb 1.74 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.60 2aml h ALA 210 CO 0.05 -0.20 -0.00 0.25 0.00 0.00 0.00 179.25 179.34 2aml n THR 211 N -5.01 2.24 -1.69 0.00 -2.24 -1.26 -4.77 114.28 101.55 2aml n THR 211 Ca 0.10 -1.99 -0.43 0.00 -2.27 0.00 0.00 64.05 59.47 2aml n THR 211 Cb 0.32 -0.26 -0.03 0.00 -2.10 0.00 0.00 70.33 68.26 2aml n THR 211 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2aml n ALA 212 N -0.70 2.13 0.99 6.98 0.00 -0.94 -4.90 120.51 124.09 2aml n ALA 212 Ca 0.21 0.31 0.11 0.00 0.00 0.00 0.00 53.44 54.07 2aml n ALA 212 Cb 0.86 -2.59 0.01 0.00 0.00 0.00 0.00 19.45 17.73 2aml n ALA 212 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2aml n PRO 213 N 5.70 0.00 -3.66 0.00 -0.04 -1.26 -4.93 135.00 130.82 2aml n PRO 213 Ca 0.18 -0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.53 2aml n PRO 213 Cb 0.37 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.25 2aml n PRO 213 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 2aml s LYS 214 N -3.00 0.68 0.07 0.54 2.36 -1.26 -3.97 119.74 115.16 2aml s LYS 214 Ca 0.09 0.96 0.10 0.00 -2.55 0.00 0.00 55.97 54.57 2aml s LYS 214 Cb 0.17 0.25 -0.03 0.00 -1.05 0.00 0.00 37.83 37.16 2aml s LYS 214 CO 0.81 -0.11 -0.26 -0.06 1.55 0.00 0.00 175.35 177.27 2aml s PHE 215 N 0.83 2.28 0.00 4.03 0.08 -0.19 -2.08 117.98 122.94 2aml s PHE 215 Ca -0.04 -0.40 0.02 0.00 0.12 0.00 0.00 56.93 56.63 2aml s PHE 215 Cb -0.05 -1.32 -0.01 0.00 -0.57 0.00 0.00 43.02 41.07 2aml s PHE 215 CO -0.07 0.20 -0.06 0.99 -0.10 0.00 0.00 175.22 176.18 2aml s THR 216 N -0.90 0.46 -0.08 0.64 2.01 -0.28 -1.25 115.64 116.24 2aml s THR 216 Ca 0.12 -0.38 0.04 0.00 0.31 0.00 0.00 61.69 61.78 2aml s THR 216 Cb -0.10 -0.41 0.00 0.00 0.01 0.00 0.00 72.50 72.00 2aml s THR 216 CO 0.03 0.04 -0.19 0.00 -0.69 0.00 0.00 174.62 173.81 2aml s ALA 217 N -0.34 1.79 -0.12 7.40 0.00 -0.16 -0.38 121.76 129.95 2aml s ALA 217 Ca 0.00 -0.76 0.02 0.00 0.00 0.00 0.00 51.96 51.23 2aml s ALA 217 Cb -0.03 -0.68 -0.00 0.00 0.00 0.00 0.00 23.12 22.40 2aml s ALA 217 CO -0.00 0.24 -0.20 0.42 0.00 0.00 0.00 175.76 176.22 2aml s ILE 218 N 0.37 2.33 0.04 0.00 1.01 -0.04 -0.93 121.20 123.99 2aml s ILE 218 Ca -0.15 -0.91 0.00 0.00 0.00 0.00 0.00 60.65 59.60 2aml s ILE 218 Cb -0.16 -1.93 -0.00 0.00 0.01 0.00 0.00 42.46 40.37 2aml s ILE 218 CO 0.06 0.54 0.05 0.61 0.00 0.00 0.00 174.94 176.20 2aml n GLY 219 N 3.73 3.47 3.56 6.18 0.00 -0.75 -0.99 105.19 120.39 2aml n GLY 219 Ca -0.19 -1.55 -0.15 0.00 0.00 0.00 0.00 46.02 44.13 2aml n GLY 219 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2aml s TYR 220 N -3.45 -0.61 0.00 1.61 1.13 -1.26 -0.64 117.35 114.12 2aml s TYR 220 Ca 0.04 1.15 0.00 0.00 -1.41 0.00 0.00 57.07 56.85 2aml s TYR 220 Cb 0.00 0.39 0.00 0.00 -1.10 0.00 0.00 41.96 41.25 2aml s TYR 220 CO 0.03 -0.50 0.00 0.41 -2.51 0.00 0.00 175.55 172.98 2aml n GLY 221 N 1.23 3.48 0.40 5.49 0.00 -1.26 -1.87 105.19 112.65 2aml n GLY 221 Ca -0.16 -0.03 0.19 0.00 0.00 0.00 0.00 46.02 46.03 2aml n GLY 221 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2aml h PRO 222 N 0.00 0.43 -0.00 1.61 0.11 -1.91 -2.13 132.00 130.11 2aml h PRO 222 Ca 0.00 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.08 2aml h PRO 222 Cb 0.00 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 31.01 2aml h PRO 222 CO 0.00 0.29 -0.03 0.25 -0.21 0.00 0.00 178.00 178.30 2aml n THR 223 N -4.56 0.00 -0.37 -1.15 -2.24 -0.78 -2.72 114.28 102.46 2aml n THR 223 Ca 0.21 -0.02 -0.00 0.00 -2.27 0.00 0.00 64.05 61.97 2aml n THR 223 Cb 0.73 -0.38 0.14 0.00 -2.10 0.00 0.00 70.33 68.72 2aml n THR 223 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 2aml h VAL 224 N 0.18 1.20 -0.91 2.28 2.07 -1.51 -0.87 116.25 118.69 2aml h VAL 224 Ca 0.00 -0.44 0.10 0.00 0.82 0.00 0.00 66.70 67.18 2aml h VAL 224 Cb 0.25 -0.20 -0.08 0.00 -1.52 0.00 0.00 31.29 29.75 2aml h VAL 224 CO 0.00 0.23 0.55 1.23 0.02 0.00 0.00 177.57 179.60 2aml h GLY 225 N 1.28 1.44 1.02 2.17 0.00 -1.71 -0.34 103.07 106.94 2aml h GLY 225 Ca 0.39 -0.37 -0.02 0.00 0.00 0.00 0.00 47.33 47.32 2aml h GLY 225 CO -0.11 0.16 0.40 -0.84 0.00 0.00 0.00 176.54 176.16 2aml h THR 226 N 0.91 1.24 -0.76 4.70 2.02 -1.52 -1.90 112.91 117.60 2aml h THR 226 Ca 0.44 -0.63 -0.03 0.00 0.77 0.00 0.00 66.41 66.95 2aml h THR 226 Cb 0.39 0.23 -0.03 0.00 -1.74 0.00 0.00 68.15 66.99 2aml h THR 226 CO -0.25 0.27 0.34 0.00 0.37 0.00 0.00 175.52 176.25 2aml h LYS 228 N 1.08 0.80 -0.11 0.00 1.57 -0.75 -1.01 116.57 118.16 2aml h LYS 228 Ca 0.26 -0.33 -0.17 0.00 -1.87 0.00 0.00 60.65 58.54 2aml h LYS 228 Cb 0.15 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.42 2aml h LYS 228 CO -0.03 0.95 -0.65 1.49 -0.57 0.00 0.00 179.45 180.65 2aml h GLU 229 N 0.69 0.40 -0.51 3.15 4.57 -0.98 -0.63 114.58 121.27 2aml h GLU 229 Ca 0.09 -0.29 0.09 0.00 -1.18 0.00 0.00 59.36 58.07 2aml h GLU 229 Cb 0.75 0.05 -0.07 0.00 -0.16 0.00 0.00 28.75 29.31 2aml h GLU 229 CO 0.06 0.91 0.08 0.35 -1.18 0.00 0.00 179.01 179.23 2aml h PHE 230 N 0.29 0.12 -0.11 0.92 3.04 -0.68 0.32 116.94 120.85 2aml h PHE 230 Ca -0.01 0.03 -0.00 0.00 3.98 0.00 0.00 57.97 61.97 2aml h PHE 230 Cb 1.19 0.02 -0.00 0.00 2.56 0.00 0.00 35.95 39.72 2aml h PHE 230 CO 0.04 -0.04 0.05 1.49 -2.02 0.00 0.00 178.31 177.84 2aml h GLU 231 N 0.21 0.16 0.08 1.11 4.81 -0.68 0.11 114.58 120.39 2aml h GLU 231 Ca 0.26 -0.02 0.01 0.00 -0.13 0.00 0.00 59.36 59.47 2aml h GLU 231 Cb 0.37 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.71 2aml h GLU 231 CO -0.36 0.22 -0.10 1.15 -0.73 0.00 0.00 179.01 179.19 2aml h THR 232 N 0.06 0.77 -0.03 0.32 2.02 -0.91 -0.72 112.91 114.42 2aml h THR 232 Ca 0.04 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.22 2aml h THR 232 Cb 0.11 0.77 -0.00 0.00 -1.74 0.00 0.00 68.15 67.29 2aml h THR 232 CO -0.00 0.00 0.01 0.11 0.37 0.00 0.00 175.52 176.01 2aml h LYS 233 N -0.21 0.04 -0.71 6.66 1.79 -0.78 -2.18 116.57 121.20 2aml h LYS 233 Ca 0.01 -0.01 -0.03 0.00 -2.18 0.00 0.00 60.65 58.45 2aml h LYS 233 Cb 0.21 -0.01 -0.03 0.00 -1.58 0.00 0.00 32.23 30.82 2aml h LYS 233 CO -0.04 0.21 0.34 0.74 -1.08 0.00 0.00 179.45 179.62 2aml h PHE 234 N -0.13 1.01 -0.89 -1.35 -1.00 -0.76 -2.39 116.94 111.43 2aml h PHE 234 Ca 0.01 -0.05 -0.00 0.00 2.81 0.00 0.00 57.97 60.74 2aml h PHE 234 Cb 0.18 -0.31 -0.04 0.00 3.61 0.00 0.00 35.95 39.39 2aml h PHE 234 CO -0.01 0.75 0.56 0.77 -1.61 0.00 0.00 178.31 178.76 2aml h SER 235 N 0.98 1.05 0.93 2.17 0.02 -1.02 -0.14 113.55 117.55 2aml h SER 235 Ca 0.24 -0.05 -0.14 0.00 -0.84 0.00 0.00 61.79 61.00 2aml h SER 235 Cb 0.11 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.37 2aml h SER 235 CO -0.03 0.79 -0.67 -0.33 -1.14 0.00 0.00 176.83 175.46 2aml h GLU 236 N 1.22 0.00 0.00 3.45 5.08 -1.02 -3.23 114.58 120.08 2aml h GLU 236 Ca 0.32 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.68 2aml h GLU 236 Cb -0.08 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.17 2aml h GLU 236 CO -0.06 0.67 -0.19 0.25 -1.00 0.00 0.00 179.01 178.67 2aml n THR 237 N -3.51 1.28 -0.20 1.13 -2.24 -0.93 -4.70 114.28 105.12 2aml n THR 237 Ca -0.00 0.35 -0.03 0.00 -2.27 0.00 0.00 64.05 62.10 2aml n THR 237 Cb 0.71 -1.73 0.16 0.00 -2.10 0.00 0.00 70.33 67.37 2aml n THR 237 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 2aml h VAL 238 N -0.19 1.23 -1.95 2.28 2.07 -1.48 -3.44 116.25 114.77 2aml h VAL 238 Ca 0.00 -0.74 -0.32 0.00 0.82 0.00 0.00 66.70 66.46 2aml h VAL 238 Cb 0.19 0.46 -0.04 0.00 -1.52 0.00 0.00 31.29 30.38 2aml h VAL 238 CO 0.00 0.30 -0.39 0.54 0.02 0.00 0.00 177.57 178.04 2aml n ARG 239 N -4.30 -1.25 -4.24 1.57 1.74 -0.16 -4.89 116.66 105.13 2aml n ARG 239 Ca 0.06 0.84 -0.24 0.00 -0.77 0.00 0.00 57.85 57.74 2aml n ARG 239 Cb 0.18 -5.19 -0.07 0.00 -1.02 0.00 0.00 32.46 26.36 2aml n ARG 239 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 2aml s VAL 240 N -2.76 3.66 0.06 1.55 -7.23 -1.26 -5.05 120.40 109.36 2aml s VAL 240 Ca 0.00 -1.66 -0.34 0.00 -1.81 0.00 0.00 61.98 58.17 2aml s VAL 240 Cb 0.00 -2.91 -0.13 0.00 0.56 0.00 0.00 36.38 33.90 2aml s VAL 240 CO 0.00 -0.26 1.71 -2.65 -0.31 0.00 0.00 175.10 173.59 2aml n PRO 241 N -0.60 2.18 -3.72 4.82 -0.02 -1.25 -4.53 135.00 131.88 2aml n PRO 241 Ca -0.08 0.79 -0.16 0.00 -2.02 0.00 0.00 63.50 62.03 2aml n PRO 241 Cb 0.57 -2.60 -0.16 0.00 -0.02 0.00 0.00 33.50 31.30 2aml n PRO 241 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 2aml s SER 242 N 2.29 0.41 -0.04 2.55 0.01 -1.26 -1.02 113.70 116.63 2aml s SER 242 Ca 0.85 0.17 0.03 0.00 1.31 0.00 0.00 55.95 58.31 2aml s SER 242 Cb -0.68 0.04 0.00 0.00 0.21 0.00 0.00 66.02 65.60 2aml s SER 242 CO 0.44 -0.18 -0.14 -1.58 0.41 0.00 0.00 173.24 172.18 2aml s GLN 243 N 1.59 1.59 -0.19 12.44 0.74 -0.38 -4.75 119.66 130.69 2aml s GLN 243 Ca -0.03 -0.50 -0.05 0.00 0.05 0.00 0.00 55.36 54.83 2aml s GLN 243 Cb -0.12 -1.38 -0.02 0.00 1.10 0.00 0.00 33.01 32.59 2aml s GLN 243 CO -0.04 0.17 -0.01 0.20 -0.55 0.00 0.00 175.29 175.06 2aml s GLY 244 N 0.20 1.72 0.01 2.59 0.00 -1.25 -0.99 107.32 109.59 2aml s GLY 244 Ca -0.06 -0.95 0.03 0.00 0.00 0.00 0.00 44.72 43.73 2aml s GLY 244 CO 0.02 0.17 -0.09 1.08 0.00 0.00 0.00 173.10 174.29 2aml s LEU 245 N 0.86 2.08 0.31 0.66 1.43 -0.11 -4.71 118.68 119.21 2aml s LEU 245 Ca 0.00 -0.26 -0.29 0.00 -1.03 0.00 0.00 54.13 52.55 2aml s LEU 245 Cb -0.14 -0.38 -0.11 0.00 0.03 0.00 0.00 46.19 45.59 2aml s LEU 245 CO 0.02 0.03 1.49 -0.62 0.23 0.00 0.00 176.35 177.50 2aml s ASP 246 N -0.57 6.50 0.20 2.29 -1.08 -1.26 -1.81 116.67 120.94 2aml s ASP 246 Ca 0.00 2.86 -0.15 0.00 -0.52 0.00 0.00 52.55 54.75 2aml s ASP 246 Cb -0.05 -2.64 0.20 0.00 -1.46 0.00 0.00 42.92 38.97 2aml s ASP 246 CO 0.00 -0.79 1.63 0.25 0.52 0.00 0.00 175.17 176.78 2aml h LEU 247 N 4.26 -0.60 0.13 -1.34 5.85 -1.24 -1.10 115.31 121.27 2aml h LEU 247 Ca -0.48 0.18 -0.28 0.00 0.84 0.00 0.00 57.88 58.14 2aml h LEU 247 Cb 1.22 0.38 0.00 0.00 0.37 0.00 0.00 40.66 42.64 2aml h LEU 247 CO 0.73 -0.21 -1.29 -0.33 -0.34 0.00 0.00 178.44 177.01 2aml h GLU 248 N -0.02 0.27 -0.84 1.25 4.39 -1.93 -3.21 114.58 114.50 2aml h GLU 248 Ca 0.28 -0.47 0.10 0.00 0.34 0.00 0.00 59.36 59.61 2aml h GLU 248 Cb 0.44 0.17 -0.06 0.00 -0.10 0.00 0.00 28.75 29.21 2aml h GLU 248 CO -0.61 1.21 0.55 0.00 -1.16 0.00 0.00 179.01 178.99 2aml h ALA 249 N 0.56 1.72 0.00 3.43 0.00 -1.83 -3.30 119.26 119.84 2aml h ALA 249 Ca -0.15 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.76 2aml h ALA 249 Cb 1.98 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 19.59 2aml h ALA 249 CO 0.20 0.10 0.00 0.34 0.00 0.00 0.00 179.25 179.89 2aml n PHE 250 N -4.52 0.00 -0.20 0.00 7.35 -0.46 -3.95 117.46 115.68 2aml n PHE 250 Ca 0.14 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.83 2aml n PHE 250 Cb 0.33 -0.17 0.00 0.00 0.35 0.00 0.00 39.48 40.00 2aml n PHE 250 CO 0.00 0.00 0.00 0.72 -0.76 0.00 0.00 176.76 176.72 2aml n HIS 252 N 1.53 0.00 0.00 -5.13 8.25 -1.25 -1.40 115.22 117.23 2aml n HIS 252 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2aml n HIS 252 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 2aml n HIS 252 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2aml n GLY 253 N 0.00 -0.67 0.34 -1.41 0.00 -1.25 -5.01 105.19 97.19 2aml n GLY 253 Ca 0.00 0.33 0.12 0.00 0.00 0.00 0.00 46.02 46.46 2aml n GLY 253 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2aml h PRO 254 N 0.00 0.31 -0.31 1.61 0.11 -1.75 -1.75 132.00 130.22 2aml h PRO 254 Ca 0.00 -0.02 0.09 0.00 0.11 0.00 0.00 66.00 66.18 2aml h PRO 254 Cb 0.00 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 31.03 2aml h PRO 254 CO 0.00 0.21 0.27 0.10 -0.21 0.00 0.00 178.00 178.37 2aml h TYR 255 N 0.32 0.00 0.00 0.65 -0.00 -1.58 -1.21 116.97 115.15 2aml h TYR 255 Ca 0.22 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.95 2aml h TYR 255 Cb 0.47 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.20 2aml h TYR 255 CO -0.00 0.00 0.00 1.28 -0.00 0.00 0.00 178.16 179.44 2aml n LEU 256 N -4.09 0.57 0.13 0.10 4.77 -0.66 -2.61 117.00 115.22 2aml n LEU 256 Ca 0.05 0.56 0.12 0.00 -0.03 0.00 0.00 56.01 56.71 2aml n LEU 256 Cb 0.43 -0.39 0.14 0.00 -2.33 0.00 0.00 43.42 41.27 2aml n LEU 256 CO 0.32 -0.17 0.46 -0.08 -1.33 0.00 0.00 177.39 176.58 2aml h GLU 257 N 0.00 0.00 -6.50 3.23 4.81 -1.35 -3.47 114.58 111.30 2aml h GLU 257 Ca 0.00 0.00 -0.60 0.00 -0.13 0.00 0.00 59.36 58.63 2aml h GLU 257 Cb 0.63 0.00 0.07 0.00 0.63 0.00 0.00 28.75 30.08 2aml h GLU 257 CO 0.00 0.00 0.58 0.28 -0.73 0.00 0.00 179.01 179.14 2aml n VAL 258 N -2.65 0.65 -4.23 0.32 0.31 -1.07 -4.99 118.33 106.67 2aml n VAL 258 Ca 0.03 -0.16 -0.13 0.00 -0.01 0.00 0.00 64.34 64.07 2aml n VAL 258 Cb 0.51 -1.32 -0.10 0.00 -0.91 0.00 0.00 33.84 32.02 2aml n VAL 258 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2aml s ASN 259 N 0.39 0.56 0.00 4.52 2.20 -1.26 -5.05 114.94 116.31 2aml s ASN 259 Ca 0.73 -1.33 0.06 0.00 -0.94 0.00 0.00 52.86 51.38 2aml s ASN 259 Cb -0.72 0.28 0.36 0.00 -2.00 0.00 0.00 41.25 39.17 2aml s ASN 259 CO 0.47 -0.76 0.95 -2.65 -2.94 0.00 0.00 177.10 172.17 2aml n PRO 260 N -0.29 0.15 0.00 3.55 -0.02 -1.25 -1.59 135.00 135.55 2aml n PRO 260 Ca -0.01 0.11 0.11 0.00 -2.02 0.00 0.00 63.50 61.70 2aml n PRO 260 Cb 0.65 -1.50 0.09 0.00 -0.02 0.00 0.00 33.50 32.72 2aml n PRO 260 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2aml n GLN 261 N -1.14 0.83 -2.08 -0.52 1.13 -1.26 -4.40 117.38 109.94 2aml n GLN 261 Ca 0.04 -0.64 -0.42 0.00 -1.94 0.00 0.00 57.00 54.05 2aml n GLN 261 Cb 0.04 -1.49 -0.03 0.00 0.11 0.00 0.00 30.24 28.87 2aml n GLN 261 CO 0.00 0.00 0.00 -1.01 -1.44 0.00 0.00 177.06 174.61 2aml s HIS 262 N -2.61 3.15 -0.35 1.08 3.76 -0.62 -4.48 115.29 115.22 2aml s HIS 262 Ca 0.18 0.92 -0.13 0.00 -0.15 0.00 0.00 55.06 55.88 2aml s HIS 262 Cb 0.18 -3.77 -0.01 0.00 1.11 0.00 0.00 32.58 30.09 2aml s HIS 262 CO 0.62 -2.65 0.24 1.03 -0.85 0.00 0.00 174.74 173.14 2aml s ARG 263 N 0.61 3.44 -0.18 1.40 3.00 -0.88 -4.37 118.95 121.96 2aml s ARG 263 Ca 0.64 -0.68 0.01 0.00 0.00 0.00 0.00 55.73 55.69 2aml s ARG 263 Cb -0.40 -3.82 0.02 0.00 0.00 0.00 0.00 34.95 30.76 2aml s ARG 263 CO 0.34 -0.47 -0.18 0.42 0.00 0.00 0.00 175.30 175.41 2aml s ILE 264 N 1.72 1.99 -0.10 1.52 1.01 -0.33 -1.13 121.20 125.88 2aml s ILE 264 Ca 0.06 -0.97 -0.16 0.00 0.00 0.00 0.00 60.65 59.58 2aml s ILE 264 Cb -0.18 -1.85 -0.05 0.00 0.01 0.00 0.00 42.46 40.40 2aml s ILE 264 CO 0.10 0.46 0.41 -0.36 0.00 0.00 0.00 174.94 175.55 2aml s PHE 265 N 1.30 3.55 -0.23 3.97 0.40 0.49 -1.30 117.98 126.17 2aml s PHE 265 Ca 0.03 0.83 -0.06 0.00 -0.60 0.00 0.00 56.93 57.14 2aml s PHE 265 Cb -0.14 -2.43 -0.02 0.00 0.51 0.00 0.00 43.02 40.95 2aml s PHE 265 CO -0.12 0.31 0.02 -0.06 0.70 0.00 0.00 175.22 176.07 2aml s PHE 266 N 0.16 3.03 -0.34 0.36 0.08 0.41 -0.86 117.98 120.83 2aml s PHE 266 Ca 0.23 -0.60 -0.19 0.00 0.12 0.00 0.00 56.93 56.49 2aml s PHE 266 Cb -0.15 -2.17 -0.01 0.00 -0.57 0.00 0.00 43.02 40.13 2aml s PHE 266 CO 0.09 -0.40 0.56 -0.51 -0.10 0.00 0.00 175.22 174.86 2aml s LEU 267 N 1.47 4.26 -0.21 -0.37 1.02 -0.16 -1.28 118.68 123.42 2aml s LEU 267 Ca 0.05 0.13 -0.04 0.00 0.02 0.00 0.00 54.13 54.30 2aml s LEU 267 Cb -0.15 -2.67 -0.01 0.00 0.02 0.00 0.00 46.19 43.38 2aml s LEU 267 CO 0.01 -0.49 -0.05 -0.70 0.02 0.00 0.00 176.35 175.14 2aml s GLU 268 N 2.50 3.42 0.14 1.70 2.12 -0.30 -4.68 118.70 123.60 2aml s GLU 268 Ca 0.21 -0.61 0.07 0.00 0.36 0.00 0.00 54.97 55.00 2aml s GLU 268 Cb -0.15 -2.98 -0.04 0.00 0.26 0.00 0.00 34.13 31.22 2aml s GLU 268 CO 0.13 -0.12 -0.16 0.95 -0.54 0.00 0.00 175.26 175.52 2aml s THR 269 N 1.27 1.57 0.03 -1.70 -4.23 -1.26 -4.18 115.64 107.14 2aml s THR 269 Ca 0.03 -1.78 -0.30 0.00 -1.18 0.00 0.00 61.69 58.46 2aml s THR 269 Cb -0.14 -1.66 -0.05 0.00 1.34 0.00 0.00 72.50 71.99 2aml s THR 269 CO -0.02 -0.33 1.20 0.00 -0.54 0.00 0.00 174.62 174.93 2aml s ALA 270 N -1.99 3.42 0.22 3.99 0.00 -1.26 -4.68 121.76 121.46 2aml s ALA 270 Ca 0.11 0.79 -0.21 0.00 0.00 0.00 0.00 51.96 52.65 2aml s ALA 270 Cb -0.06 -3.47 0.07 0.00 0.00 0.00 0.00 23.12 19.66 2aml s ALA 270 CO 0.05 -0.53 0.96 0.45 0.00 0.00 0.00 175.76 176.69 2aml s SER 271 N 1.20 -0.04 0.46 0.00 0.15 -1.26 -4.33 113.70 109.87 2aml s SER 271 Ca 0.58 -0.72 0.31 0.00 0.70 0.00 0.00 55.95 56.82 2aml s SER 271 Cb -0.28 0.58 1.36 0.00 -1.71 0.00 0.00 66.02 65.97 2aml s SER 271 CO 0.27 -1.14 1.93 0.00 1.20 0.00 0.00 173.24 175.50 2aml h ALA 272 N 2.00 1.00 0.00 5.45 0.00 -2.05 -3.26 119.26 122.40 2aml h ALA 272 Ca -0.28 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.63 2aml h ALA 272 Cb 1.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.02 2aml h ALA 272 CO 0.34 0.00 -0.00 1.33 0.00 0.00 0.00 179.25 180.92 2aml n VAL 273 N -2.78 0.88 -0.02 0.00 0.24 -1.26 -4.76 118.33 110.64 2aml n VAL 273 Ca 0.01 -0.89 0.05 0.00 -2.04 0.00 0.00 64.34 61.47 2aml n VAL 273 Cb 0.24 0.55 0.44 0.00 -1.47 0.00 0.00 33.84 33.60 2aml n VAL 273 CO 0.00 0.00 0.00 0.74 -2.14 0.00 0.00 176.83 175.43 2aml h THR 274 N 0.49 1.06 -0.48 3.34 2.02 -1.83 -0.53 112.91 116.98 2aml h THR 274 Ca 0.00 -0.18 0.12 0.00 0.77 0.00 0.00 66.41 67.12 2aml h THR 274 Cb 0.60 0.49 -0.02 0.00 -1.74 0.00 0.00 68.15 67.48 2aml h THR 274 CO 0.00 0.10 0.34 -0.33 0.37 0.00 0.00 175.52 175.99 2aml h GLU 275 N 0.53 0.08 -0.32 6.66 4.39 -1.87 -0.26 114.58 123.77 2aml h GLU 275 Ca 0.17 -0.00 -0.11 0.00 0.34 0.00 0.00 59.36 59.76 2aml h GLU 275 Cb 0.05 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.67 2aml h GLU 275 CO -0.04 0.05 -0.24 0.00 -1.16 0.00 0.00 179.01 177.62 2aml h ARG 276 N 0.08 0.64 -0.23 2.33 2.47 -1.46 -1.62 114.38 116.59 2aml h ARG 276 Ca 0.23 -0.25 -0.08 0.00 -1.26 0.00 0.00 59.98 58.61 2aml h ARG 276 Cb 0.80 -0.03 -0.00 0.00 -1.65 0.00 0.00 29.97 29.08 2aml h ARG 276 CO -0.02 0.83 -0.19 1.25 0.56 0.00 0.00 179.97 182.40 2aml h LEU 277 N 0.56 0.56 -0.43 3.04 5.85 -1.13 -2.62 115.31 121.14 2aml h LEU 277 Ca 0.08 -0.46 0.04 0.00 0.84 0.00 0.00 57.88 58.38 2aml h LEU 277 Cb 0.71 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.55 2aml h LEU 277 CO 0.05 0.90 0.20 0.58 -0.34 0.00 0.00 178.44 179.83 2aml h VAL 278 N 0.22 0.94 -0.76 1.05 2.07 -1.12 0.30 116.25 118.95 2aml h VAL 278 Ca 0.04 -0.14 0.06 0.00 0.82 0.00 0.00 66.70 67.49 2aml h VAL 278 Cb 0.72 0.50 -0.06 0.00 -1.52 0.00 0.00 31.29 30.94 2aml h VAL 278 CO 0.05 0.07 0.45 -0.07 0.02 0.00 0.00 177.57 178.09 2aml h LEU 279 N 0.40 0.69 -0.19 2.57 3.38 -1.28 -1.16 115.31 119.72 2aml h LEU 279 Ca 0.19 0.03 -0.18 0.00 0.09 0.00 0.00 57.88 58.01 2aml h LEU 279 Cb 0.12 -0.11 0.01 0.00 0.09 0.00 0.00 40.66 40.76 2aml h LEU 279 CO -0.15 0.44 -0.58 0.25 0.09 0.00 0.00 178.44 178.48 2aml h LEU 280 N 0.82 0.84 -0.51 1.67 5.85 -0.99 -1.27 115.31 121.72 2aml h LEU 280 Ca 0.34 -0.59 -0.01 0.00 0.84 0.00 0.00 57.88 58.46 2aml h LEU 280 Cb 0.19 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 40.95 2aml h LEU 280 CO -0.18 1.29 0.30 -0.09 -0.34 0.00 0.00 178.44 179.41 2aml h ARG 281 N 0.45 0.70 -0.69 1.25 2.43 -0.70 0.44 114.38 118.25 2aml h ARG 281 Ca -0.02 -0.07 -0.06 0.00 -0.81 0.00 0.00 59.98 59.02 2aml h ARG 281 Cb 1.21 -0.14 -0.03 0.00 -0.42 0.00 0.00 29.97 30.58 2aml h ARG 281 CO 0.12 0.53 0.19 -0.44 -1.51 0.00 0.00 179.97 178.86 2aml h ASP 282 N 0.68 1.03 0.00 -3.80 3.32 -1.12 -1.19 116.42 115.34 2aml h ASP 282 Ca 0.18 -0.22 -0.00 0.00 0.02 0.00 0.00 57.03 57.01 2aml h ASP 282 Cb 0.02 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 39.30 2aml h ASP 282 CO -0.03 0.98 -0.00 0.22 -1.72 0.00 0.00 179.24 178.69 2aml h TYR 283 N 1.03 -0.00 0.00 4.55 5.03 -0.89 -3.17 116.97 123.52 2aml h TYR 283 Ca 0.22 -0.00 -0.04 0.00 2.58 0.00 0.00 58.73 61.49 2aml h TYR 283 Cb 0.34 0.00 -0.01 0.00 1.55 0.00 0.00 36.73 38.61 2aml h TYR 283 CO 0.03 0.26 -0.19 0.93 -1.32 0.00 0.00 178.16 177.87 2aml h GLU 284 N -0.27 0.00 0.00 1.82 4.39 -0.84 -2.54 114.58 117.15 2aml h GLU 284 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2aml h GLU 284 Cb 0.26 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.91 2aml h GLU 284 CO 0.00 0.19 0.00 0.77 -1.16 0.00 0.00 179.01 178.81 2aml h SER 285 N 0.00 0.00 1.66 1.42 0.02 -1.18 0.63 113.55 116.10 2aml h SER 285 Ca -0.00 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2aml h SER 285 Cb 0.71 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.25 2aml h SER 285 CO 0.02 0.00 -0.00 0.11 -1.14 0.00 0.00 176.83 175.82 2aml h LYS 286 N 0.00 0.00 0.00 3.45 1.57 -1.53 -3.37 116.57 116.69 2aml h LYS 286 Ca 0.00 0.00 -0.28 0.00 -1.87 0.00 0.00 60.65 58.50 2aml h LYS 286 Cb 0.22 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.48 2aml h LYS 286 CO 0.00 0.00 -2.06 0.66 -0.57 0.00 0.00 179.45 177.48 2aml n TYR 287 N -3.10 0.00 -4.59 -1.35 4.01 0.12 -4.96 117.16 107.29 2aml n TYR 287 Ca 0.03 0.00 -0.23 0.00 -0.16 0.00 0.00 57.90 57.54 2aml n TYR 287 Cb 0.45 -0.75 -0.15 0.00 -0.31 0.00 0.00 39.34 38.58 2aml n TYR 287 CO 0.00 0.00 0.00 -0.08 -0.46 0.00 0.00 176.86 176.32 2aml s THR 288 N -2.37 1.06 -1.33 -0.72 -1.32 -0.62 -3.83 115.64 106.51 2aml s THR 288 Ca -0.15 -0.53 0.29 0.00 -1.21 0.00 0.00 61.69 60.10 2aml s THR 288 Cb 0.05 -0.91 0.42 0.00 -1.51 0.00 0.00 72.50 70.55 2aml s THR 288 CO 0.56 0.31 1.96 -0.81 -2.21 0.00 0.00 174.62 174.43 2aml n PRO 289 N 3.07 0.34 -2.89 7.08 -0.04 -1.26 -4.40 135.00 136.89 2aml n PRO 289 Ca -0.17 -0.04 -0.42 0.00 -0.04 0.00 0.00 63.50 62.83 2aml n PRO 289 Cb 0.54 -1.50 0.01 0.00 -0.04 0.00 0.00 33.50 32.52 2aml n PRO 289 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2aml n PHE 290 N -1.30 2.39 -4.50 0.54 3.72 -1.26 -4.98 117.46 112.08 2aml n PHE 290 Ca 0.12 -2.57 -0.30 0.00 -0.05 0.00 0.00 57.45 54.64 2aml n PHE 290 Cb 0.28 -1.23 -0.12 0.00 -0.94 0.00 0.00 39.48 37.47 2aml n PHE 290 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 2aml s THR 291 N -3.28 2.90 0.01 4.37 -4.23 -1.26 -1.18 115.64 112.97 2aml s THR 291 Ca 0.34 -1.27 -0.08 0.00 -1.18 0.00 0.00 61.69 59.49 2aml s THR 291 Cb 0.09 -2.27 0.00 0.00 1.34 0.00 0.00 72.50 71.67 2aml s THR 291 CO 0.04 0.25 0.16 -0.31 -0.54 0.00 0.00 174.62 174.22 2aml s TYR 292 N -1.02 0.04 0.01 3.99 1.51 -0.42 -4.95 117.35 116.52 2aml s TYR 292 Ca 0.16 -0.16 0.07 0.00 -1.01 0.00 0.00 57.07 56.14 2aml s TYR 292 Cb -0.11 -0.04 -0.02 0.00 -0.11 0.00 0.00 41.96 41.68 2aml s TYR 292 CO 0.08 -0.34 -0.22 0.99 -1.11 0.00 0.00 175.55 174.95 2aml s THR 293 N -1.75 1.72 -0.15 -0.71 2.01 -0.43 -0.44 115.64 115.89 2aml s THR 293 Ca -0.12 -1.08 0.01 0.00 0.31 0.00 0.00 61.69 60.82 2aml s THR 293 Cb -0.05 -1.46 0.01 0.00 0.01 0.00 0.00 72.50 71.00 2aml s THR 293 CO 0.00 0.35 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.41 2aml s VAL 294 N -0.65 2.34 0.22 3.82 1.01 -0.40 -0.41 120.40 126.32 2aml s VAL 294 Ca 0.08 -0.88 -0.12 0.00 0.00 0.00 0.00 61.98 61.06 2aml s VAL 294 Cb -0.09 -1.96 -0.00 0.00 0.00 0.00 0.00 36.38 34.33 2aml s VAL 294 CO 0.01 0.53 0.42 -1.59 0.00 0.00 0.00 175.10 174.47 2aml s LYS 295 N 0.85 1.42 0.04 2.72 -2.85 -0.61 -1.15 119.74 120.17 2aml s LYS 295 Ca -0.06 -1.21 -0.04 0.00 -1.00 0.00 0.00 55.97 53.67 2aml s LYS 295 Cb -0.15 0.45 -0.05 0.00 -2.06 0.00 0.00 37.83 36.02 2aml s LYS 295 CO -0.02 -0.57 0.26 -0.06 0.10 0.00 0.00 175.35 175.06 2aml s PHE 296 N -4.00 3.54 0.00 1.78 0.40 -1.26 -0.56 117.98 117.88 2aml s PHE 296 Ca 0.21 0.46 0.00 0.00 -0.60 0.00 0.00 56.93 57.00 2aml s PHE 296 Cb 0.01 -1.92 0.00 0.00 0.51 0.00 0.00 43.02 41.62 2aml s PHE 296 CO 0.06 0.58 0.00 0.41 0.70 0.00 0.00 175.22 176.96 2aml n GLY 297 N 0.69 1.96 3.29 4.36 0.00 -0.36 -4.86 105.19 110.27 2aml n GLY 297 Ca -0.08 -0.53 -0.11 0.00 0.00 0.00 0.00 46.02 45.30 2aml n GLY 297 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2aml s LYS 298 N 0.00 0.93 0.07 1.61 0.00 -1.26 -4.87 119.74 116.22 2aml s LYS 298 Ca 0.00 -0.59 0.01 0.00 0.00 0.00 0.00 55.97 55.38 2aml s LYS 298 Cb 0.00 0.41 -0.04 0.00 0.00 0.00 0.00 37.83 38.20 2aml s LYS 298 CO 0.00 -0.33 -0.05 0.20 0.00 0.00 0.00 175.35 175.17 2aml s GLY 299 N -2.40 0.59 0.13 0.59 0.00 -1.26 -4.95 107.32 100.02 2aml s GLY 299 Ca -0.01 -1.19 -0.10 0.00 0.00 0.00 0.00 44.72 43.42 2aml s GLY 299 CO -0.07 -1.29 1.41 0.83 0.00 0.00 0.00 173.10 173.98 2aml h GLU 300 N 3.30 0.81 0.00 2.90 5.08 -2.00 -3.49 114.58 121.19 2aml h GLU 300 Ca -0.35 -0.54 0.02 0.00 -1.00 0.00 0.00 59.36 57.49 2aml h GLU 300 Cb 1.16 0.07 -0.00 0.00 0.50 0.00 0.00 28.75 30.48 2aml h GLU 300 CO 0.61 1.16 0.29 -0.40 -1.00 0.00 0.00 179.01 179.68 2aml n ASP 301 N -3.99 -1.76 0.00 1.42 5.68 -1.26 -5.05 116.55 111.59 2aml n ASP 301 Ca -0.05 -2.16 0.10 0.00 -0.50 0.00 0.00 54.79 52.19 2aml n ASP 301 Cb 0.64 2.92 0.59 0.00 -1.14 0.00 0.00 41.12 44.13 2aml n ASP 301 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 2aml n ASP 302 N -1.37 0.00 -0.82 -1.12 5.68 -1.26 -1.80 116.55 115.87 2aml n ASP 302 Ca -0.06 -1.27 0.11 0.00 -0.50 0.00 0.00 54.79 53.08 2aml n ASP 302 Cb 0.48 0.00 0.30 0.00 -1.14 0.00 0.00 41.12 40.76 2aml n ASP 302 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 2aml n ARG 303 N -0.83 2.07 -4.34 0.11 1.74 -1.26 -4.83 116.66 109.32 2aml n ARG 303 Ca 0.15 -1.61 -0.34 0.00 -0.77 0.00 0.00 57.85 55.28 2aml n ARG 303 Cb 0.07 -1.44 -0.11 0.00 -1.02 0.00 0.00 32.46 29.95 2aml n ARG 303 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 2aml s THR 304 N -1.67 4.08 -0.33 0.55 2.01 -0.75 -1.31 115.64 118.22 2aml s THR 304 Ca 0.35 -0.30 -0.16 0.00 0.31 0.00 0.00 61.69 61.89 2aml s THR 304 Cb 0.19 -2.78 -0.01 0.00 0.01 0.00 0.00 72.50 69.91 2aml s THR 304 CO 0.28 0.50 0.40 -0.22 -0.69 0.00 0.00 174.62 174.89 2aml s LEU 305 N 0.21 4.36 -0.41 4.42 0.20 0.45 -4.89 118.68 123.01 2aml s LEU 305 Ca -0.01 -0.11 -0.15 0.00 0.69 0.00 0.00 54.13 54.56 2aml s LEU 305 Cb -0.13 -2.41 0.02 0.00 -0.43 0.00 0.00 46.19 43.23 2aml s LEU 305 CO 0.02 -0.35 0.30 -0.69 -0.29 0.00 0.00 176.35 175.34 2aml s VAL 306 N 2.12 5.26 -0.27 1.68 1.01 -1.26 -1.57 120.40 127.36 2aml s VAL 306 Ca 0.14 -0.65 -0.28 0.00 0.00 0.00 0.00 61.98 61.18 2aml s VAL 306 Cb -0.16 -3.93 0.01 0.00 0.00 0.00 0.00 36.38 32.30 2aml s VAL 306 CO 0.12 -0.30 1.03 -0.63 0.00 0.00 0.00 175.10 175.31 2aml s ILE 307 N 1.68 4.62 -1.22 2.22 1.01 0.27 -4.87 121.20 124.91 2aml s ILE 307 Ca 0.05 1.83 -0.06 0.00 0.00 0.00 0.00 60.65 62.47 2aml s ILE 307 Cb -0.19 -4.34 0.06 0.00 0.01 0.00 0.00 42.46 38.00 2aml s ILE 307 CO 0.10 -0.31 2.58 -0.81 0.00 0.00 0.00 174.94 176.50 2aml n PRO 308 N 6.54 4.09 -3.97 2.79 -0.04 -1.26 -1.22 135.00 141.93 2aml n PRO 308 Ca 0.11 -3.02 -0.09 0.00 -0.04 0.00 0.00 63.50 60.46 2aml n PRO 308 Cb 0.47 -2.58 -0.05 0.00 -0.04 0.00 0.00 33.50 31.30 2aml n PRO 308 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 2aml s THR 309 N -0.63 0.00 -0.50 0.52 -1.32 -1.26 -4.93 115.64 107.52 2aml s THR 309 Ca 0.58 -1.34 -0.09 0.00 -1.21 0.00 0.00 61.69 59.62 2aml s THR 309 Cb 0.21 -2.15 0.13 0.00 -1.51 0.00 0.00 72.50 69.18 2aml s THR 309 CO -0.10 -0.01 0.38 -0.62 -2.21 0.00 0.00 174.62 172.06 2aml s ASP 310 N -3.00 5.76 -0.01 8.08 2.15 -1.26 -3.53 116.67 124.86 2aml s ASP 310 Ca 0.21 -2.00 0.05 0.00 0.43 0.00 0.00 52.55 51.24 2aml s ASP 310 Cb -0.01 -2.02 -0.03 0.00 -0.30 0.00 0.00 42.92 40.56 2aml s ASP 310 CO 0.08 -0.68 -0.16 -0.76 -0.17 0.00 0.00 175.17 173.48 2aml s LEU 311 N 1.23 2.66 0.96 -1.34 1.43 -1.26 -5.00 118.68 117.36 2aml s LEU 311 Ca 0.07 -0.31 -0.15 0.00 -1.03 0.00 0.00 54.13 52.71 2aml s LEU 311 Cb -0.25 -1.55 0.18 0.00 0.03 0.00 0.00 46.19 44.60 2aml s LEU 311 CO -0.01 0.30 1.21 1.51 0.23 0.00 0.00 176.35 179.59 2aml s ASP 312 N -1.07 3.13 0.37 2.29 1.47 -1.26 -4.74 116.67 116.86 2aml s ASP 312 Ca 0.13 0.60 0.07 0.00 1.18 0.00 0.00 52.55 54.53 2aml s ASP 312 Cb -0.11 -0.89 0.73 0.00 -0.34 0.00 0.00 42.92 42.31 2aml s ASP 312 CO 0.03 -2.75 1.93 1.05 0.68 0.00 0.00 175.17 176.10 2aml h GLU 313 N -1.65 0.40 -0.19 2.11 4.11 -1.96 0.76 114.58 118.16 2aml h GLU 313 Ca -0.46 -0.07 -0.15 0.00 0.07 0.00 0.00 59.36 58.74 2aml h GLU 313 Cb 1.29 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.47 2aml h GLU 313 CO 0.49 0.44 -0.52 1.88 0.07 0.00 0.00 179.01 181.36 2aml h TYR 314 N 0.39 0.66 0.00 2.06 0.05 -1.93 -3.20 116.97 115.00 2aml h TYR 314 Ca 0.09 -0.23 -0.18 0.00 0.05 0.00 0.00 58.73 58.46 2aml h TYR 314 Cb 0.28 -0.13 -0.03 0.00 1.01 0.00 0.00 36.73 37.86 2aml h TYR 314 CO 0.01 0.95 -0.85 1.96 -1.05 0.00 0.00 178.16 179.17 2aml h GLN 315 N 0.42 0.00 -0.87 4.88 4.20 -1.81 -3.39 115.11 118.54 2aml h GLN 315 Ca 0.01 0.00 0.23 0.00 0.06 0.00 0.00 58.65 58.95 2aml h GLN 315 Cb 1.06 0.00 -0.14 0.00 0.30 0.00 0.00 27.48 28.70 2aml h GLN 315 CO 0.10 0.82 0.26 0.00 -0.67 0.00 0.00 178.83 179.34 2aml h ALA 316 N 1.17 1.28 0.00 3.87 0.00 -0.85 -1.84 119.26 122.88 2aml h ALA 316 Ca -0.01 0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.10 2aml h ALA 316 Cb 1.64 0.28 0.00 0.00 0.00 0.00 0.00 17.79 19.71 2aml h ALA 316 CO 0.11 -0.43 0.04 -1.35 0.00 0.00 0.00 179.25 177.61 2aml h PRO 317 N 0.25 0.00 -0.36 0.00 0.11 -1.76 -1.91 132.00 128.32 2aml h PRO 317 Ca 0.54 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.65 2aml h PRO 317 Cb 1.07 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.16 2aml h PRO 317 CO -0.62 0.00 0.23 0.35 -0.21 0.00 0.00 178.00 177.75 2aml h PHE 318 N 0.00 0.46 -2.06 0.65 3.57 -1.65 -3.32 116.94 114.60 2aml h PHE 318 Ca 0.00 0.01 -0.77 0.00 3.53 0.00 0.00 57.97 60.74 2aml h PHE 318 Cb 0.07 -0.16 -0.28 0.00 2.79 0.00 0.00 35.95 38.37 2aml h PHE 318 CO 0.00 0.31 0.91 -0.11 -2.23 0.00 0.00 178.31 177.19 2aml n LEU 319 N -4.82 7.24 0.00 0.59 7.94 -0.72 -4.67 117.00 122.56 2aml n LEU 319 Ca -0.00 -5.06 0.00 0.00 -1.11 0.00 0.00 56.01 49.84 2aml n LEU 319 Cb 0.04 -1.05 0.00 0.00 0.53 0.00 0.00 43.42 42.93 2aml n LEU 319 CO 0.35 1.89 0.00 0.00 -1.11 0.00 0.00 177.39 178.52 2aml n ILE 321 N -0.38 0.00 -0.13 1.96 0.13 -1.25 -4.30 119.36 115.40 2aml n ILE 321 Ca 0.50 0.00 -0.07 0.00 -1.10 0.00 0.00 62.75 62.09 2aml n ILE 321 Cb 0.27 0.00 0.02 0.00 -0.84 0.00 0.00 39.64 39.08 2aml n ILE 321 CO 0.00 0.00 0.00 0.25 2.80 0.00 0.00 176.55 179.60 2aml h LEU 322 N 0.00 0.34 -1.51 9.51 5.85 -1.90 -0.64 115.31 126.96 2aml h LEU 322 Ca 0.00 0.01 0.09 0.00 0.84 0.00 0.00 57.88 58.82 2aml h LEU 322 Cb 0.00 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 40.93 2aml h LEU 322 CO 0.00 0.25 0.44 -0.65 -0.34 0.00 0.00 178.44 178.14 2aml h PRO 323 N 0.45 0.55 -0.01 5.25 0.11 -1.90 -1.99 132.00 134.46 2aml h PRO 323 Ca 0.17 -0.03 -0.16 0.00 0.11 0.00 0.00 66.00 66.09 2aml h PRO 323 Cb 0.04 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 31.01 2aml h PRO 323 CO -0.10 0.37 -0.73 0.74 -0.21 0.00 0.00 178.00 178.07 2aml h PHE 324 N 0.57 0.06 -0.35 0.65 0.04 -1.54 0.52 116.94 116.90 2aml h PHE 324 Ca 0.30 -0.03 -0.01 0.00 2.80 0.00 0.00 57.97 61.02 2aml h PHE 324 Cb 0.43 -0.01 -0.02 0.00 2.20 0.00 0.00 35.95 38.55 2aml h PHE 324 CO -0.00 0.76 0.16 1.96 -0.60 0.00 0.00 178.31 180.59 2aml h GLN 325 N 0.03 0.50 -0.10 1.51 4.20 -0.57 0.34 115.11 121.02 2aml h GLN 325 Ca -0.01 -0.08 -0.01 0.00 0.06 0.00 0.00 58.65 58.61 2aml h GLN 325 Cb 1.29 -0.09 -0.00 0.00 0.30 0.00 0.00 27.48 28.98 2aml h GLN 325 CO 0.10 0.46 0.03 0.82 -0.67 0.00 0.00 178.83 179.57 2aml h ILE 326 N 0.42 1.17 -0.81 2.54 2.04 -1.33 -2.67 117.51 118.87 2aml h ILE 326 Ca 0.12 -0.52 -0.01 0.00 1.00 0.00 0.00 64.86 65.45 2aml h ILE 326 Cb 0.13 1.33 -0.04 0.00 -0.74 0.00 0.00 36.82 37.50 2aml h ILE 326 CO -0.01 0.15 0.48 -0.07 0.00 0.00 0.00 178.15 178.70 2aml h LEU 327 N -0.02 0.98 0.01 1.44 3.38 -0.81 0.08 115.31 120.37 2aml h LEU 327 Ca 0.03 -0.06 0.01 0.00 0.09 0.00 0.00 57.88 57.95 2aml h LEU 327 Cb 0.21 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 2aml h LEU 327 CO -0.00 0.76 -0.06 0.00 0.09 0.00 0.00 178.44 179.23 2aml h ALA 328 N 1.41 -0.07 0.18 1.53 0.00 -0.86 0.18 119.26 121.63 2aml h ALA 328 Ca 0.29 0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.21 2aml h ALA 328 Cb -0.03 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 2aml h ALA 328 CO -0.05 -0.55 -0.26 1.25 0.00 0.00 0.00 179.25 179.63 2aml h HIS 329 N -0.10 -0.69 -0.47 0.00 -0.00 -1.16 -1.05 115.15 111.67 2aml h HIS 329 Ca 0.02 0.01 -0.07 0.00 -0.00 0.00 0.00 60.37 60.33 2aml h HIS 329 Cb 0.13 0.28 -0.02 0.00 -0.00 0.00 0.00 27.41 27.80 2aml h HIS 329 CO -0.12 -0.37 0.01 0.45 -0.00 0.00 0.00 177.93 177.90 2aml h HIS 330 N -0.51 0.88 -0.36 5.26 -0.00 -0.82 -1.29 115.15 118.32 2aml h HIS 330 Ca 0.01 -0.15 -0.15 0.00 -0.00 0.00 0.00 60.37 60.09 2aml h HIS 330 Cb 0.50 -0.23 -0.01 0.00 -0.00 0.00 0.00 27.41 27.67 2aml h HIS 330 CO -0.21 0.85 -0.37 0.82 -0.00 0.00 0.00 177.93 179.02 2aml h ILE 331 N 0.67 1.28 -0.54 2.45 2.04 -0.98 0.10 117.51 122.53 2aml h ILE 331 Ca 0.13 -1.54 -0.00 0.00 1.00 0.00 0.00 64.86 64.45 2aml h ILE 331 Cb 0.48 1.39 -0.03 0.00 -0.74 0.00 0.00 36.82 37.93 2aml h ILE 331 CO 0.02 0.51 0.32 0.00 0.00 0.00 0.00 178.15 179.00 2aml h ALA 332 N 0.88 0.68 -0.27 1.87 0.00 -0.95 -1.09 119.26 120.38 2aml h ALA 332 Ca 0.06 -0.07 -0.14 0.00 0.00 0.00 0.00 54.91 54.76 2aml h ALA 332 Cb 0.94 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 2aml h ALA 332 CO 0.09 0.17 -0.42 0.93 0.00 0.00 0.00 179.25 180.03 2aml h GLU 333 N 0.72 0.66 -1.01 0.00 4.39 -1.09 -1.19 114.58 117.07 2aml h GLU 333 Ca 0.19 -0.35 0.06 0.00 0.34 0.00 0.00 59.36 59.60 2aml h GLU 333 Cb -0.00 0.01 -0.07 0.00 -0.10 0.00 0.00 28.75 28.60 2aml h GLU 333 CO -0.03 0.96 0.65 1.25 -1.16 0.00 0.00 179.01 180.67 2aml h LEU 334 N 0.54 1.06 0.00 1.33 5.85 -0.61 -1.38 115.31 122.10 2aml h LEU 334 Ca 0.04 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.77 2aml h LEU 334 Cb 0.95 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 41.75 2aml h LEU 334 CO 0.09 0.69 0.00 0.29 -0.34 0.00 0.00 178.44 179.16 2aml n LYS 335 N -4.49 0.61 -1.07 1.25 5.02 -0.45 -4.88 118.16 114.15 2aml n LYS 335 Ca 0.15 0.02 0.00 0.00 -2.02 0.00 0.00 58.31 56.46 2aml n LYS 335 Cb 0.16 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.67 2aml n LYS 335 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2aml n GLY 336 N 0.63 0.48 0.03 0.72 0.00 -0.52 -4.95 105.19 101.58 2aml n GLY 336 Ca 0.16 -0.92 0.15 0.00 0.00 0.00 0.00 46.02 45.40 2aml n GLY 336 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2aml n ASN 337 N 1.75 0.11 -3.60 1.61 3.02 -0.48 -4.96 115.26 112.71 2aml n ASN 337 Ca 0.00 -0.31 -0.20 0.00 -0.03 0.00 0.00 54.58 54.04 2aml n ASN 337 Cb 0.10 -0.21 0.01 0.00 -0.61 0.00 0.00 39.78 39.06 2aml n ASN 337 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2aml n LYS 338 N -1.19 -1.37 0.16 3.52 5.02 -1.26 -4.83 118.16 118.21 2aml n LYS 338 Ca 0.15 0.89 0.12 0.00 -2.02 0.00 0.00 58.31 57.45 2aml n LYS 338 Cb 0.24 -3.45 0.57 0.00 -0.02 0.00 0.00 35.03 32.36 2aml n LYS 338 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 2aml h LEU 339 N -0.39 0.00 -0.00 -0.35 3.38 -1.92 -0.29 115.31 115.73 2aml h LEU 339 Ca -0.47 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.50 2aml h LEU 339 Cb 1.29 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.04 2aml h LEU 339 CO 0.37 0.00 0.00 0.35 0.09 0.00 0.00 178.44 179.25 2aml n THR 340 N -2.34 0.12 -2.82 0.22 -2.24 -1.26 -4.59 114.28 101.36 2aml n THR 340 Ca 0.01 -0.05 -0.43 0.00 -2.27 0.00 0.00 64.05 61.31 2aml n THR 340 Cb 0.16 -0.52 -0.04 0.00 -2.10 0.00 0.00 70.33 67.83 2aml n THR 340 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2aml s GLU 341 N -3.02 3.42 0.39 -0.78 2.02 -0.12 -5.03 118.70 115.57 2aml s GLU 341 Ca 0.13 -0.08 -0.26 0.00 0.02 0.00 0.00 54.97 54.79 2aml s GLU 341 Cb 0.18 -4.00 -0.09 0.00 0.10 0.00 0.00 34.13 30.32 2aml s GLU 341 CO 0.54 -1.38 1.16 1.03 0.02 0.00 0.00 175.26 176.63 2aml s ARG 342 N 3.90 4.11 0.13 1.61 0.52 -1.26 -5.01 118.95 122.95 2aml s ARG 342 Ca 0.33 1.83 0.07 0.00 -0.52 0.00 0.00 55.73 57.45 2aml s ARG 342 Cb -0.11 -2.72 -0.04 0.00 0.52 0.00 0.00 34.95 32.60 2aml s ARG 342 CO 0.22 -0.26 -0.17 0.96 0.02 0.00 0.00 175.30 176.06 2aml s ILE 343 N -1.40 1.60 -1.54 1.52 -4.36 -1.26 -4.84 121.20 110.91 2aml s ILE 343 Ca 0.56 -1.71 -0.11 0.00 -0.26 0.00 0.00 60.65 59.12 2aml s ILE 343 Cb -0.30 -1.62 0.08 0.00 1.25 0.00 0.00 42.46 41.87 2aml s ILE 343 CO 0.38 -0.27 0.77 -1.22 0.24 0.00 0.00 174.94 174.84 2aml n TYR 344 N 0.64 -1.93 0.57 1.37 4.01 -1.26 -4.84 117.16 115.72 2aml n TYR 344 Ca -0.16 0.83 0.13 0.00 -0.16 0.00 0.00 57.90 58.53 2aml n TYR 344 Cb 0.56 -3.62 0.44 0.00 -0.31 0.00 0.00 39.34 36.41 2aml n TYR 344 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 2aml n THR 345 N -4.48 0.65 0.99 -0.72 -2.24 -1.26 -2.07 114.28 105.15 2aml n THR 345 Ca -0.06 -0.08 0.13 0.00 -2.27 0.00 0.00 64.05 61.77 2aml n THR 345 Cb 0.56 -0.79 0.44 0.00 -2.10 0.00 0.00 70.33 68.45 2aml n THR 345 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2aml n ASP 346 N -2.19 0.25 0.18 3.42 5.75 -1.26 -4.52 116.55 118.18 2aml n ASP 346 Ca 0.04 0.15 -0.14 0.00 -0.01 0.00 0.00 54.79 54.83 2aml n ASP 346 Cb 0.35 -0.15 -0.08 0.00 -1.03 0.00 0.00 41.12 40.21 2aml n ASP 346 CO 0.00 0.00 0.00 0.15 -0.11 0.00 0.00 177.20 177.24 2aml h PHE 347 N 0.00 -0.35 -0.61 2.11 3.04 -1.80 -1.64 116.94 117.70 2aml h PHE 347 Ca 0.00 -0.01 0.04 0.00 3.98 0.00 0.00 57.97 61.98 2aml h PHE 347 Cb 0.51 0.12 -0.05 0.00 2.56 0.00 0.00 35.95 39.09 2aml h PHE 347 CO 0.00 -0.20 0.35 0.78 -2.02 0.00 0.00 178.31 177.22 2aml h GLY 348 N -0.40 0.87 0.79 2.40 0.00 -1.81 -2.70 103.07 102.22 2aml h GLY 348 Ca -0.04 -0.25 -0.12 0.00 0.00 0.00 0.00 47.33 46.92 2aml h GLY 348 CO 0.06 0.18 -0.40 -2.08 0.00 0.00 0.00 176.54 174.30 2aml h VAL 349 N 0.66 1.39 0.00 4.60 2.07 -1.74 -1.19 116.25 122.04 2aml h VAL 349 Ca 0.26 -1.75 0.00 0.00 0.82 0.00 0.00 66.70 66.02 2aml h VAL 349 Cb 0.10 2.23 0.00 0.00 -1.52 0.00 0.00 31.29 32.10 2aml h VAL 349 CO -0.14 0.52 0.00 0.00 0.02 0.00 0.00 177.57 177.97 2aml n ALA 350 N -2.52 1.35 -1.80 1.67 0.00 -0.62 -4.64 120.51 113.95 2aml n ALA 350 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.36 2aml n ALA 350 Cb 0.54 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.99 2aml n ALA 350 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2aml n LYS 352 N 0.75 0.00 0.06 0.00 5.02 -0.99 -5.08 118.16 117.92 2aml n LYS 352 Ca 0.00 0.00 0.12 0.00 -2.02 0.00 0.00 58.31 56.41 2aml n LYS 352 Cb 0.02 0.00 0.09 0.00 -0.02 0.00 0.00 35.03 35.13 2aml n LYS 352 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 2aml n SER 353 N 0.00 0.71 -4.14 4.39 3.41 -0.53 -4.69 113.62 112.77 2aml n SER 353 Ca 0.00 0.10 -0.20 0.00 -0.26 0.00 0.00 58.87 58.51 2aml n SER 353 Cb 0.40 0.38 -0.13 0.00 -0.26 0.00 0.00 64.21 64.60 2aml n SER 353 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2aml s LYS 354 N -3.22 0.93 0.39 4.33 -0.14 -0.70 -1.43 119.74 119.90 2aml s LYS 354 Ca 0.04 -0.75 0.21 0.00 -1.36 0.00 0.00 55.97 54.12 2aml s LYS 354 Cb 0.13 -0.94 0.54 0.00 -1.68 0.00 0.00 37.83 35.88 2aml s LYS 354 CO 0.76 0.23 1.66 1.79 -0.76 0.00 0.00 175.35 179.03 2aml h THR 355 N 4.52 0.54 -3.69 2.17 1.35 -1.51 -3.38 112.91 112.90 2aml h THR 355 Ca -0.38 -1.45 -0.08 0.00 -0.55 0.00 0.00 66.41 63.95 2aml h THR 355 Cb 1.18 2.02 -0.13 0.00 -1.73 0.00 0.00 68.15 69.49 2aml h THR 355 CO 0.44 0.27 -0.25 -0.54 -0.25 0.00 0.00 175.52 175.18 2aml s LYS 356 N -3.33 1.03 0.57 4.72 1.02 -1.26 -5.04 119.74 117.45 2aml s LYS 356 Ca 0.03 -0.95 -0.20 0.00 0.02 0.00 0.00 55.97 54.87 2aml s LYS 356 Cb 0.08 0.40 -0.05 0.00 -0.52 0.00 0.00 37.83 37.73 2aml s LYS 356 CO 0.68 -0.37 1.04 -2.30 -0.92 0.00 0.00 175.35 173.48 2aml n PRO 357 N -0.16 1.09 -1.99 -1.68 -0.02 -1.26 -4.69 135.00 126.28 2aml n PRO 357 Ca -0.13 0.41 -0.40 0.00 -2.02 0.00 0.00 63.50 61.37 2aml n PRO 357 Cb 0.63 -2.23 0.00 0.00 -0.02 0.00 0.00 33.50 31.88 2aml n PRO 357 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 2aml s GLY 358 N -1.13 2.92 -1.05 -1.23 0.00 -1.26 -4.95 107.32 100.62 2aml s GLY 358 Ca 0.74 1.29 -0.16 0.00 0.00 0.00 0.00 44.72 46.59 2aml s GLY 358 CO 0.48 1.89 1.24 -0.35 0.00 0.00 0.00 173.10 176.36 2aml s ASP 359 N -0.68 6.86 -0.05 1.64 2.15 -1.26 -4.99 116.67 120.34 2aml s ASP 359 Ca 0.58 -2.56 0.05 0.00 0.43 0.00 0.00 52.55 51.05 2aml s ASP 359 Cb -0.39 -2.38 -0.01 0.00 -0.30 0.00 0.00 42.92 39.84 2aml s ASP 359 CO 0.51 -0.87 -0.21 -0.31 -0.17 0.00 0.00 175.17 174.13 2aml s TYR 360 N 1.89 2.01 -2.00 -5.34 2.02 -1.26 -4.39 117.35 110.28 2aml s TYR 360 Ca 0.36 -0.57 0.11 0.00 -0.37 0.00 0.00 57.07 56.60 2aml s TYR 360 Cb -0.04 -1.33 0.63 0.00 -0.40 0.00 0.00 41.96 40.81 2aml s TYR 360 CO -0.05 -0.17 1.07 0.00 -1.57 0.00 0.00 175.55 174.82