#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ock s ILE 2 N 0.00 5.17 -0.29 2.02 1.01 -1.26 -4.98 121.20 122.86 1ock s ILE 2 Ca 0.00 0.94 -0.18 0.00 0.00 0.00 0.00 60.65 61.41 1ock s ILE 2 Cb 0.00 -3.81 -0.02 0.00 0.01 0.00 0.00 42.46 38.64 1ock s ILE 2 CO 0.00 0.35 0.51 -0.55 0.00 0.00 0.00 174.94 175.26 1ock s SER 3 N 0.45 6.39 0.12 3.58 0.15 -1.26 -4.23 113.70 118.89 1ock s SER 3 Ca 0.26 0.32 -0.20 0.00 0.70 0.00 0.00 55.95 57.03 1ock s SER 3 Cb -0.15 -2.28 -0.07 0.00 -1.71 0.00 0.00 66.02 61.81 1ock s SER 3 CO 0.11 -0.36 1.77 0.25 1.20 0.00 0.00 173.24 176.21 1ock h LEU 4 N 8.90 0.20 -1.23 3.45 6.46 -1.91 -1.42 115.31 129.76 1ock h LEU 4 Ca -0.29 -0.00 0.01 0.00 -0.12 0.00 0.00 57.88 57.48 1ock h LEU 4 Cb 1.14 -0.05 -0.04 0.00 -0.73 0.00 0.00 40.66 40.98 1ock h LEU 4 CO 0.73 0.15 0.52 0.00 -0.62 0.00 0.00 178.44 179.22 1ock h ALA 5 N 1.07 1.45 0.01 1.25 0.00 -1.88 0.33 119.26 121.50 1ock h ALA 5 Ca 0.07 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1ock h ALA 5 Cb -0.03 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.45 1ock h ALA 5 CO -0.02 0.50 -0.01 0.22 0.00 0.00 0.00 179.25 179.95 1ock h ASP 6 N 1.05 -0.01 -0.75 0.00 -0.00 -1.88 -1.59 116.42 113.23 1ock h ASP 6 Ca 0.29 -0.20 0.04 0.00 -0.00 0.00 0.00 57.03 57.17 1ock h ASP 6 Cb -0.09 0.00 -0.05 0.00 -0.00 0.00 0.00 39.33 39.19 1ock h ASP 6 CO -0.07 0.19 0.46 -0.07 -0.00 0.00 0.00 179.24 179.75 1ock h LEU 7 N -0.22 0.73 0.51 2.28 3.38 -0.78 -1.96 115.31 119.26 1ock h LEU 7 Ca -0.00 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 1ock h LEU 7 Cb 0.21 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 1ock h LEU 7 CO 0.00 0.49 -0.50 1.56 0.09 0.00 0.00 178.44 180.08 1ock h GLN 8 N 0.87 -0.97 -0.49 1.13 4.20 -0.71 0.35 115.11 119.49 1ock h GLN 8 Ca 0.31 0.07 0.10 0.00 0.06 0.00 0.00 58.65 59.19 1ock h GLN 8 Cb 0.09 0.22 -0.09 0.00 0.30 0.00 0.00 27.48 28.01 1ock h GLN 8 CO -0.14 -0.65 -0.04 0.00 -0.67 0.00 0.00 178.83 177.33 1ock h ARG 9 N -1.01 0.07 -0.63 1.46 3.08 -1.10 0.14 114.38 116.40 1ock h ARG 9 Ca -0.07 -0.00 -0.08 0.00 0.07 0.00 0.00 59.98 59.90 1ock h ARG 9 Cb 0.87 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.88 1ock h ARG 9 CO -0.05 0.04 0.07 0.00 -1.07 0.00 0.00 179.97 178.97 1ock h ARG 10 N 0.07 1.06 -0.55 0.04 3.08 -1.24 -2.58 114.38 114.26 1ock h ARG 10 Ca 0.25 -0.30 -0.11 0.00 0.07 0.00 0.00 59.98 59.89 1ock h ARG 10 Cb 0.38 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.29 1ock h ARG 10 CO -0.45 1.00 -0.08 0.82 -1.07 0.00 0.00 179.97 180.19 1ock h ILE 11 N 0.97 1.27 -0.09 2.04 2.04 -0.27 0.17 117.51 123.64 1ock h ILE 11 Ca 0.19 -1.24 -0.04 0.00 1.00 0.00 0.00 64.86 64.76 1ock h ILE 11 Cb 0.47 0.94 -0.01 0.00 -0.74 0.00 0.00 36.82 37.49 1ock h ILE 11 CO 0.02 0.44 -0.14 -0.08 0.00 0.00 0.00 178.15 178.38 1ock h GLU 12 N 0.91 0.14 0.00 2.37 4.57 -0.59 -2.14 114.58 119.84 1ock h GLU 12 Ca 0.15 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.29 1ock h GLU 12 Cb 0.65 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.22 1ock h GLU 12 CO 0.04 0.30 -0.49 0.25 -1.18 0.00 0.00 179.01 177.94 1ock n THR 13 N -4.30 0.03 -0.61 0.32 -2.24 -0.98 -4.92 114.28 101.59 1ock n THR 13 Ca -0.01 -0.03 0.00 0.00 -2.27 0.00 0.00 64.05 61.74 1ock n THR 13 Cb 0.26 0.17 0.00 0.00 -2.10 0.00 0.00 70.33 68.65 1ock n THR 13 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ock n GLY 14 N 1.48 0.70 0.16 3.38 0.00 -0.81 -4.92 105.19 105.19 1ock n GLY 14 Ca 0.05 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.09 1ock n GLY 14 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1ock h GLU 15 N 2.26 0.00 -4.20 1.61 4.81 -0.93 -3.44 114.58 114.70 1ock h GLU 15 Ca 0.00 0.00 -0.30 0.00 -0.13 0.00 0.00 59.36 58.93 1ock h GLU 15 Cb 0.00 0.00 -0.28 0.00 0.63 0.00 0.00 28.75 29.10 1ock h GLU 15 CO 0.00 0.50 -0.74 -1.17 -0.73 0.00 0.00 179.01 176.86 1ock s LEU 16 N -7.52 2.03 0.06 1.64 2.96 -0.79 -4.96 118.68 112.11 1ock s LEU 16 Ca -0.01 -0.12 -0.15 0.00 -0.22 0.00 0.00 54.13 53.63 1ock s LEU 16 Cb 0.12 -0.19 -0.06 0.00 0.50 0.00 0.00 46.19 46.56 1ock s LEU 16 CO 0.73 0.02 0.47 -0.94 -1.32 0.00 0.00 176.35 175.31 1ock s SER 17 N -0.25 6.85 0.26 3.68 1.04 -1.26 -4.00 113.70 120.02 1ock s SER 17 Ca 0.00 1.04 -0.03 0.00 0.48 0.00 0.00 55.95 57.44 1ock s SER 17 Cb -0.02 -2.27 0.43 0.00 0.10 0.00 0.00 66.02 64.25 1ock s SER 17 CO -0.00 0.25 1.84 -0.65 0.98 0.00 0.00 173.24 175.66 1ock h PRO 18 N 4.29 0.94 -0.55 4.02 0.11 -1.92 -1.28 132.00 137.60 1ock h PRO 18 Ca -0.50 -0.06 -0.02 0.00 0.11 0.00 0.00 66.00 65.53 1ock h PRO 18 Cb 1.21 -0.21 -0.03 0.00 0.11 0.00 0.00 31.00 32.08 1ock h PRO 18 CO 0.63 0.62 0.26 -0.91 -0.21 0.00 0.00 178.00 178.39 1ock h ASN 19 N 0.96 0.69 -0.20 -2.05 2.35 -1.93 -1.03 115.58 114.38 1ock h ASN 19 Ca 0.43 -0.07 -0.05 0.00 -0.55 0.00 0.00 56.30 56.06 1ock h ASN 19 Cb 0.32 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.51 1ock h ASN 19 CO -0.22 0.60 -0.08 0.00 -1.65 0.00 0.00 177.43 176.08 1ock h ALA 20 N 1.51 0.28 -0.59 -0.83 0.00 -1.68 -0.75 119.26 117.21 1ock h ALA 20 Ca 0.19 -0.27 0.04 0.00 0.00 0.00 0.00 54.91 54.87 1ock h ALA 20 Cb 0.09 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.77 1ock h ALA 20 CO -0.02 0.09 0.34 0.00 0.00 0.00 0.00 179.25 179.65 1ock h ALA 21 N 0.71 0.76 -0.49 0.00 0.00 -0.87 -0.23 119.26 119.15 1ock h ALA 21 Ca 0.05 0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.84 1ock h ALA 21 Cb 0.55 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1ock h ALA 21 CO 0.03 0.04 -0.14 0.82 0.00 0.00 0.00 179.25 179.99 1ock h ILE 22 N 0.65 1.27 -0.58 0.00 1.08 -1.16 -2.62 117.51 116.16 1ock h ILE 22 Ca 0.25 -1.29 0.01 0.00 -0.39 0.00 0.00 64.86 63.44 1ock h ILE 22 Cb 0.08 1.09 -0.03 0.00 -3.07 0.00 0.00 36.82 34.89 1ock h ILE 22 CO -0.13 0.45 0.38 0.00 -0.69 0.00 0.00 178.15 178.16 1ock h ALA 23 N 0.88 1.59 -0.49 1.87 0.00 -0.58 -1.68 119.26 120.86 1ock h ALA 23 Ca 0.12 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 1ock h ALA 23 Cb 0.70 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 1ock h ALA 23 CO 0.05 0.38 0.00 1.96 0.00 0.00 0.00 179.25 181.64 1ock h GLN 24 N 0.78 0.81 -0.25 0.00 4.20 -0.70 -1.95 115.11 118.01 1ock h GLN 24 Ca 0.21 -0.22 -0.09 0.00 0.06 0.00 0.00 58.65 58.61 1ock h GLN 24 Cb -0.09 -0.09 -0.00 0.00 0.30 0.00 0.00 27.48 27.60 1ock h GLN 24 CO -0.05 0.82 -0.22 0.77 -0.67 0.00 0.00 178.83 179.48 1ock h SER 25 N 0.76 0.62 -0.73 1.46 0.02 -1.03 -0.54 113.55 114.10 1ock h SER 25 Ca 0.15 -0.46 0.06 0.00 -0.84 0.00 0.00 61.79 60.70 1ock h SER 25 Cb 0.46 -0.17 -0.05 0.00 0.14 0.00 0.00 62.40 62.78 1ock h SER 25 CO 0.02 0.95 0.48 0.45 -1.14 0.00 0.00 176.83 177.59 1ock h HIS 26 N 0.29 0.78 -0.14 3.45 3.86 -1.21 0.22 115.15 122.41 1ock h HIS 26 Ca 0.04 0.02 -0.12 0.00 -1.16 0.00 0.00 60.37 59.15 1ock h HIS 26 Cb 0.76 -0.26 0.00 0.00 1.06 0.00 0.00 27.41 28.98 1ock h HIS 26 CO 0.07 0.42 -0.40 0.00 0.86 0.00 0.00 177.93 178.88 1ock h ALA 27 N 1.60 0.23 -0.58 2.45 0.00 -1.13 -2.55 119.26 119.28 1ock h ALA 27 Ca 0.31 -0.46 -0.04 0.00 0.00 0.00 0.00 54.91 54.72 1ock h ALA 27 Cb 0.24 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 1ock h ALA 27 CO -0.10 0.34 0.20 0.00 0.00 0.00 0.00 179.25 179.68 1ock h ALA 28 N 0.52 1.25 0.37 0.00 0.00 -0.53 0.32 119.26 121.19 1ock h ALA 28 Ca -0.01 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 1ock h ALA 28 Cb 1.02 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.58 1ock h ALA 28 CO 0.09 0.54 -0.18 0.82 0.00 0.00 0.00 179.25 180.52 1ock h ILE 29 N 0.85 0.64 0.00 0.00 2.04 -0.95 -2.93 117.51 117.16 1ock h ILE 29 Ca 0.20 -0.30 -0.03 0.00 1.00 0.00 0.00 64.86 65.72 1ock h ILE 29 Cb 0.22 0.79 -0.00 0.00 -0.74 0.00 0.00 36.82 37.09 1ock h ILE 29 CO -0.01 0.06 -0.16 -0.33 0.00 0.00 0.00 178.15 177.71 1ock h GLU 30 N -0.67 0.00 -0.21 2.37 4.39 -1.30 0.11 114.58 119.27 1ock h GLU 30 Ca -0.05 0.00 -0.05 0.00 0.34 0.00 0.00 59.36 59.60 1ock h GLU 30 Cb 0.48 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.11 1ock h GLU 30 CO 0.08 0.16 -0.10 0.00 -1.16 0.00 0.00 179.01 177.99 1ock h ALA 31 N 1.84 1.46 0.00 3.43 0.00 -0.76 -3.35 119.26 121.88 1ock h ALA 31 Ca -0.00 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1ock h ALA 31 Cb 0.28 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1ock h ALA 31 CO 0.02 0.38 0.00 0.54 0.00 0.00 0.00 179.25 180.19 1ock n ARG 32 N -4.27 0.92 -0.18 0.00 1.74 -1.04 -4.84 116.66 108.98 1ock n ARG 32 Ca -0.00 -0.78 -0.09 0.00 -0.77 0.00 0.00 57.85 56.21 1ock n ARG 32 Cb 0.27 -0.68 0.01 0.00 -1.02 0.00 0.00 32.46 31.03 1ock n ARG 32 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 1ock h GLU 33 N 0.00 0.86 0.00 5.56 4.39 -0.93 0.12 114.58 124.58 1ock h GLU 33 Ca 0.00 -0.23 0.00 0.00 0.34 0.00 0.00 59.36 59.47 1ock h GLU 33 Cb 0.76 -0.10 0.00 0.00 -0.10 0.00 0.00 28.75 29.31 1ock h GLU 33 CO 0.00 0.84 0.00 1.63 -1.16 0.00 0.00 179.01 180.32 1ock n LYS 34 N -4.39 0.14 -0.09 2.33 5.02 -1.26 0.07 118.16 119.97 1ock n LYS 34 Ca 0.02 0.19 -0.12 0.00 -2.02 0.00 0.00 58.31 56.38 1ock n LYS 34 Cb 0.25 -1.50 -0.08 0.00 -0.02 0.00 0.00 35.03 33.68 1ock n LYS 34 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 1ock n GLU 35 N -1.28 0.43 -0.08 1.97 2.13 -0.71 -4.79 120.64 118.31 1ock n GLU 35 Ca 0.04 0.10 -0.13 0.00 0.66 0.00 0.00 57.16 57.84 1ock n GLU 35 Cb 0.07 -1.33 -0.15 0.00 0.27 0.00 0.00 31.44 30.31 1ock n GLU 35 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 1ock n VAL 36 N -3.05 1.49 -3.61 6.31 0.31 0.33 -4.72 118.33 115.39 1ock n VAL 36 Ca -0.31 -0.76 -0.21 0.00 -0.01 0.00 0.00 64.34 63.05 1ock n VAL 36 Cb 0.82 -0.91 0.06 0.00 -0.91 0.00 0.00 33.84 32.89 1ock n VAL 36 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 1ock n HIS 37 N -2.99 -2.13 0.27 3.52 8.25 0.11 -0.76 115.22 121.48 1ock n HIS 37 Ca -0.33 0.90 0.12 0.00 -0.26 0.00 0.00 57.72 58.15 1ock n HIS 37 Cb 1.09 -4.67 0.13 0.00 1.12 0.00 0.00 29.99 27.66 1ock n HIS 37 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1ock h ALA 38 N 0.90 0.76 -3.35 -1.41 0.00 -1.89 -3.33 119.26 110.94 1ock h ALA 38 Ca -0.60 0.00 -0.66 0.00 0.00 0.00 0.00 54.91 53.66 1ock h ALA 38 Cb 1.35 0.00 -0.18 0.00 0.00 0.00 0.00 17.79 18.97 1ock h ALA 38 CO 0.55 0.00 -0.64 -0.06 0.00 0.00 0.00 179.25 179.10 1ock s PHE 39 N -3.25 3.10 0.11 0.00 0.40 -1.26 -1.14 117.98 115.93 1ock s PHE 39 Ca 0.04 -0.01 -0.08 0.00 -0.60 0.00 0.00 56.93 56.28 1ock s PHE 39 Cb 0.09 -1.87 -0.15 0.00 0.51 0.00 0.00 43.02 41.60 1ock s PHE 39 CO 0.71 0.24 1.26 0.28 0.70 0.00 0.00 175.22 178.42 1ock h VAL 40 N 4.60 1.34 -2.19 -0.44 2.07 -0.97 -3.46 116.25 117.20 1ock h VAL 40 Ca -0.42 -2.33 -0.03 0.00 0.82 0.00 0.00 66.70 64.74 1ock h VAL 40 Cb 1.19 2.37 -0.23 0.00 -1.52 0.00 0.00 31.29 33.10 1ock h VAL 40 CO 0.59 0.71 -0.06 0.00 0.02 0.00 0.00 177.57 178.83 1ock s ARG 41 N -3.32 0.63 -0.26 1.57 1.70 -1.17 -5.01 118.95 113.09 1ock s ARG 41 Ca -0.08 1.07 -0.07 0.00 -0.47 0.00 0.00 55.73 56.19 1ock s ARG 41 Cb 0.08 0.13 -0.01 0.00 -0.57 0.00 0.00 34.95 34.57 1ock s ARG 41 CO 0.89 -0.14 0.06 -1.58 -1.08 0.00 0.00 175.30 173.45 1ock s HIS 42 N 1.41 3.09 -0.91 5.89 5.65 -1.26 -1.62 115.29 127.54 1ock s HIS 42 Ca -0.09 -0.64 -0.21 0.00 0.25 0.00 0.00 55.06 54.37 1ock s HIS 42 Cb -0.06 -2.23 0.09 0.00 -1.18 0.00 0.00 32.58 29.20 1ock s HIS 42 CO -0.15 -0.45 1.21 0.34 -0.65 0.00 0.00 174.74 175.04 1ock s ASP 43 N 1.57 6.51 0.63 9.88 2.15 -0.39 -4.84 116.67 132.18 1ock s ASP 43 Ca 0.05 -1.66 0.39 0.00 0.43 0.00 0.00 52.55 51.76 1ock s ASP 43 Cb -0.16 -2.46 2.13 0.00 -0.30 0.00 0.00 42.92 42.13 1ock s ASP 43 CO 0.03 -1.28 2.30 0.11 -0.17 0.00 0.00 175.17 176.15 1ock h LYS 44 N 9.27 0.00 -0.00 4.34 1.79 -1.97 -2.14 116.57 127.86 1ock h LYS 44 Ca 0.09 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.56 1ock h LYS 44 Cb 1.03 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.68 1ock h LYS 44 CO 1.22 0.01 -0.26 -1.13 -1.08 0.00 0.00 179.45 178.21 1ock n SER 45 N -3.35 0.35 -4.69 0.86 3.41 -1.26 -4.91 113.62 104.02 1ock n SER 45 Ca -0.03 -0.07 -0.44 0.00 -0.26 0.00 0.00 58.87 58.07 1ock n SER 45 Cb 0.10 -0.06 -0.03 0.00 -0.26 0.00 0.00 64.21 63.96 1ock n SER 45 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ock n ALA 46 N -1.38 1.83 -2.40 7.33 0.00 -0.81 -5.00 120.51 120.08 1ock n ALA 46 Ca 0.08 0.42 -0.20 0.00 0.00 0.00 0.00 53.44 53.73 1ock n ALA 46 Cb 0.33 -2.39 -0.10 0.00 0.00 0.00 0.00 19.45 17.28 1ock n ALA 46 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1ock s ARG 47 N 0.51 1.48 0.52 0.00 0.52 -1.26 -4.99 118.95 115.74 1ock s ARG 47 Ca 0.74 -1.71 -0.21 0.00 -0.52 0.00 0.00 55.73 54.03 1ock s ARG 47 Cb -0.61 -1.19 -0.06 0.00 0.52 0.00 0.00 34.95 33.62 1ock s ARG 47 CO 0.40 0.11 1.18 0.00 0.02 0.00 0.00 175.30 177.01 1ock s ALA 48 N -2.96 2.77 0.58 2.13 0.00 -1.26 -4.81 121.76 118.22 1ock s ALA 48 Ca 0.27 0.94 -0.06 0.00 0.00 0.00 0.00 51.96 53.11 1ock s ALA 48 Cb 0.01 -3.40 0.00 0.00 0.00 0.00 0.00 23.12 19.73 1ock s ALA 48 CO 0.10 -0.85 0.89 -0.65 0.00 0.00 0.00 175.76 175.25 1ock s GLN 49 N -3.06 3.00 0.29 0.00 -0.21 -1.26 -4.94 119.66 113.49 1ock s GLN 49 Ca 0.70 0.04 0.24 0.00 0.02 0.00 0.00 55.36 56.37 1ock s GLN 49 Cb -0.28 -2.28 0.45 0.00 1.00 0.00 0.00 33.01 31.91 1ock s GLN 49 CO 0.32 -0.65 1.55 0.00 -2.12 0.00 0.00 175.29 174.40 1ock h ALA 50 N -0.14 0.87 -2.81 6.09 0.00 -1.96 -3.41 119.26 117.91 1ock h ALA 50 Ca -0.46 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.40 1ock h ALA 50 Cb 1.25 0.00 -0.10 0.00 0.00 0.00 0.00 17.79 18.94 1ock h ALA 50 CO 0.61 0.00 -0.12 -1.54 0.00 0.00 0.00 179.25 178.20 1ock s SER 51 N -5.25 -0.11 0.00 0.00 1.04 -1.26 -5.07 113.70 103.05 1ock s SER 51 Ca 0.07 -0.82 0.00 0.00 0.48 0.00 0.00 55.95 55.68 1ock s SER 51 Cb 0.09 0.56 0.00 0.00 0.10 0.00 0.00 66.02 66.77 1ock s SER 51 CO 0.67 -1.08 0.00 0.61 0.98 0.00 0.00 173.24 174.41 1ock n GLY 52 N -0.35 2.63 0.32 7.32 0.00 -1.26 -4.06 105.19 109.79 1ock n GLY 52 Ca -0.04 -1.84 0.21 0.00 0.00 0.00 0.00 46.02 44.34 1ock n GLY 52 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ock h PRO 53 N 0.00 0.00 -0.47 1.61 0.13 -1.82 -2.37 132.00 129.08 1ock h PRO 53 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1ock h PRO 53 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1ock h PRO 53 CO 0.00 0.01 0.00 1.28 -0.23 0.00 0.00 178.00 179.06 1ock n LEU 54 N -3.13 4.16 -4.75 1.56 4.77 -0.25 -4.90 117.00 114.46 1ock n LEU 54 Ca -0.02 -2.53 -0.41 0.00 -0.03 0.00 0.00 56.01 53.01 1ock n LEU 54 Cb 0.14 -0.50 -0.02 0.00 -2.33 0.00 0.00 43.42 40.71 1ock n LEU 54 CO 0.22 0.75 1.19 0.00 -1.33 0.00 0.00 177.39 178.22 1ock s ARG 55 N -1.98 4.19 0.00 3.23 1.70 -0.89 -1.46 118.95 123.74 1ock s ARG 55 Ca 0.42 2.45 0.00 0.00 -0.47 0.00 0.00 55.73 58.13 1ock s ARG 55 Cb 0.29 -3.07 0.00 0.00 -0.57 0.00 0.00 34.95 31.60 1ock s ARG 55 CO 0.18 -0.54 0.00 0.41 -1.08 0.00 0.00 175.30 174.27 1ock n GLY 56 N 2.27 0.59 3.33 3.88 0.00 -1.26 -4.87 105.19 109.13 1ock n GLY 56 Ca 0.08 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.73 1ock n GLY 56 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ock s ILE 57 N -2.15 3.94 -0.01 -0.61 -1.09 -0.53 -4.10 121.20 116.64 1ock s ILE 57 Ca 0.00 -0.77 -0.26 0.00 -2.23 0.00 0.00 60.65 57.39 1ock s ILE 57 Cb 0.00 -3.07 -0.04 0.00 -1.58 0.00 0.00 42.46 37.77 1ock s ILE 57 CO 0.00 0.03 0.81 0.00 -1.23 0.00 0.00 174.94 174.56 1ock s ALA 58 N 1.48 3.29 -0.07 9.38 0.00 -1.26 -1.26 121.76 133.32 1ock s ALA 58 Ca 0.02 0.31 0.04 0.00 0.00 0.00 0.00 51.96 52.33 1ock s ALA 58 Cb -0.18 -3.10 0.00 0.00 0.00 0.00 0.00 23.12 19.85 1ock s ALA 58 CO 0.02 -0.10 -0.19 0.08 0.00 0.00 0.00 175.76 175.58 1ock s VAL 59 N 0.62 1.64 -0.06 0.00 1.01 0.48 -3.51 120.40 120.58 1ock s VAL 59 Ca 0.43 -0.79 -0.12 0.00 0.00 0.00 0.00 61.98 61.50 1ock s VAL 59 Cb -0.20 -1.43 -0.05 0.00 0.00 0.00 0.00 36.38 34.71 1ock s VAL 59 CO 0.23 0.47 0.30 -0.83 0.00 0.00 0.00 175.10 175.26 1ock s GLY 60 N 0.31 2.34 -0.18 4.51 0.00 -0.69 -1.78 107.32 111.83 1ock s GLY 60 Ca -0.12 -0.39 0.01 0.00 0.00 0.00 0.00 44.72 44.21 1ock s GLY 60 CO 0.05 -0.03 -0.20 -0.42 0.00 0.00 0.00 173.10 172.50 1ock s ILE 61 N -0.95 2.08 0.15 0.90 -1.09 -0.64 -0.96 121.20 120.70 1ock s ILE 61 Ca 0.20 -0.93 -0.34 0.00 -2.23 0.00 0.00 60.65 57.34 1ock s ILE 61 Cb -0.15 -1.87 -0.15 0.00 -1.58 0.00 0.00 42.46 38.71 1ock s ILE 61 CO 0.09 0.54 1.33 1.17 -1.23 0.00 0.00 174.94 176.84 1ock n LYS 62 N 4.61 1.43 0.00 2.79 4.81 -0.94 -0.63 118.16 130.23 1ock n LYS 62 Ca -0.21 0.51 0.00 0.00 -0.87 0.00 0.00 58.31 57.74 1ock n LYS 62 Cb 0.50 -2.13 0.00 0.00 0.02 0.00 0.00 35.03 33.42 1ock n LYS 62 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 1ock n ASP 63 N 2.45 1.52 -0.22 3.14 2.03 -0.17 -1.51 116.55 123.78 1ock n ASP 63 Ca 0.16 -1.15 0.03 0.00 0.52 0.00 0.00 54.79 54.34 1ock n ASP 63 Cb 0.24 -0.29 0.03 0.00 -0.72 0.00 0.00 41.12 40.38 1ock n ASP 63 CO 0.00 0.00 0.00 2.30 -1.92 0.00 0.00 177.20 177.58 1ock n ILE 64 N 0.62 0.15 -3.76 5.18 -5.35 -1.26 -1.11 119.36 113.83 1ock n ILE 64 Ca 0.00 -0.58 -0.36 0.00 -0.27 0.00 0.00 62.75 61.54 1ock n ILE 64 Cb 0.26 1.02 -0.11 0.00 -1.74 0.00 0.00 39.64 39.07 1ock n ILE 64 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 1ock s ILE 65 N -0.52 4.80 0.26 7.28 1.01 -0.57 -0.86 121.20 132.60 1ock s ILE 65 Ca 0.07 -0.01 -0.31 0.00 0.00 0.00 0.00 60.65 60.40 1ock s ILE 65 Cb 0.05 -3.24 -0.12 0.00 0.01 0.00 0.00 42.46 39.15 1ock s ILE 65 CO 0.07 0.34 1.53 0.47 0.00 0.00 0.00 174.94 177.35 1ock n ASP 66 N 4.58 3.42 -3.99 3.58 8.00 0.23 -4.91 116.55 127.47 1ock n ASP 66 Ca -0.16 1.14 -0.17 0.00 0.71 0.00 0.00 54.79 56.31 1ock n ASP 66 Cb 0.52 -1.52 -0.14 0.00 -0.02 0.00 0.00 41.12 39.95 1ock n ASP 66 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1ock s THR 67 N 0.08 0.54 -0.22 -3.53 -4.23 -1.25 -1.29 115.64 105.75 1ock s THR 67 Ca 0.67 -0.32 0.20 0.00 -1.18 0.00 0.00 61.69 61.06 1ock s THR 67 Cb -0.56 -0.46 0.01 0.00 1.34 0.00 0.00 72.50 72.82 1ock s THR 67 CO 0.48 0.13 1.09 0.00 -0.54 0.00 0.00 174.62 175.78 1ock h ALA 68 N 5.92 0.63 -0.02 3.99 0.00 -1.78 -3.36 119.26 124.64 1ock h ALA 68 Ca -0.29 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.31 1ock h ALA 68 Cb 1.19 0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1ock h ALA 68 CO 0.50 0.35 -0.20 0.27 0.00 0.00 0.00 179.25 180.16 1ock n ASN 69 N -2.85 2.24 -3.90 0.00 6.94 -1.26 -4.88 115.26 111.55 1ock n ASN 69 Ca -0.02 -1.62 -0.11 0.00 -0.02 0.00 0.00 54.58 52.81 1ock n ASN 69 Cb 0.66 0.24 -0.11 0.00 -2.36 0.00 0.00 39.78 38.20 1ock n ASN 69 CO 0.00 0.00 0.00 -0.04 -1.03 0.00 0.00 177.26 176.19 1ock s MET 70 N -1.92 0.33 0.84 -3.83 -1.94 -1.26 -5.15 119.30 106.37 1ock s MET 70 Ca 0.20 -0.35 -0.12 0.00 -1.71 0.00 0.00 55.69 53.70 1ock s MET 70 Cb 0.16 0.13 0.11 0.00 2.01 0.00 0.00 34.83 37.24 1ock s MET 70 CO 0.37 -0.07 1.17 -2.14 -0.01 0.00 0.00 175.02 174.34 1ock s PRO 71 N -1.07 1.44 -0.34 2.03 0.02 -1.26 -4.39 135.00 131.44 1ock s PRO 71 Ca -0.12 1.63 0.00 0.00 0.02 0.00 0.00 61.00 62.54 1ock s PRO 71 Cb -0.07 -1.77 0.11 0.00 0.02 0.00 0.00 34.50 32.79 1ock s PRO 71 CO 0.00 -2.33 0.13 0.99 -0.33 0.00 0.00 177.00 175.45 1ock s THR 72 N -2.40 1.04 -2.56 0.99 2.01 -0.19 -4.84 115.64 109.69 1ock s THR 72 Ca 0.70 -1.69 0.24 0.00 0.31 0.00 0.00 61.69 61.24 1ock s THR 72 Cb -0.25 -1.77 0.41 0.00 0.01 0.00 0.00 72.50 70.89 1ock s THR 72 CO 0.54 -0.73 1.49 -0.62 -0.69 0.00 0.00 174.62 174.61 1ock n GLU 73 N 4.53 2.04 -0.99 4.92 1.02 -1.25 -4.53 120.64 126.38 1ock n GLU 73 Ca 0.01 -1.54 -0.06 0.00 -0.02 0.00 0.00 57.16 55.55 1ock n GLU 73 Cb 0.40 -1.46 -0.02 0.00 -0.02 0.00 0.00 31.44 30.34 1ock n GLU 73 CO 0.00 0.00 0.00 -1.33 1.18 0.00 0.00 177.13 176.98 1ock n MET 74 N 0.80 -1.74 -1.44 3.49 2.81 -0.27 -1.32 117.12 119.46 1ock n MET 74 Ca 0.17 0.56 -0.15 0.00 -1.81 0.00 0.00 57.70 56.47 1ock n MET 74 Cb 0.47 -4.62 -0.06 0.00 -0.71 0.00 0.00 33.22 28.29 1ock n MET 74 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1ock n GLY 75 N 0.33 1.50 3.14 3.03 0.00 -1.26 -1.36 105.19 110.57 1ock n GLY 75 Ca -0.06 -0.33 -0.21 0.00 0.00 0.00 0.00 46.02 45.42 1ock n GLY 75 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1ock s SER 76 N -2.84 1.74 0.58 1.61 0.15 -0.43 -3.53 113.70 110.97 1ock s SER 76 Ca 0.00 -0.39 0.35 0.00 0.70 0.00 0.00 55.95 56.62 1ock s SER 76 Cb 0.00 -0.14 1.71 0.00 -1.71 0.00 0.00 66.02 65.88 1ock s SER 76 CO 0.00 0.10 2.12 -0.33 1.20 0.00 0.00 173.24 176.33 1ock h GLU 77 N 5.25 0.00 -0.08 5.44 5.08 -1.84 -2.04 114.58 126.38 1ock h GLU 77 Ca -0.37 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 57.95 1ock h GLU 77 Cb 1.17 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.41 1ock h GLU 77 CO 0.46 0.04 -0.15 0.82 -1.00 0.00 0.00 179.01 179.17 1ock h ILE 78 N 0.00 1.16 -0.42 3.13 2.04 -1.89 -2.84 117.51 118.69 1ock h ILE 78 Ca -0.00 -0.71 -0.09 0.00 1.00 0.00 0.00 64.86 65.07 1ock h ILE 78 Cb 0.32 1.27 -0.05 0.00 -0.74 0.00 0.00 36.82 37.62 1ock h ILE 78 CO 0.00 0.21 0.05 -1.22 0.00 0.00 0.00 178.15 177.20 1ock n TYR 79 N -4.30 1.42 -1.68 1.37 4.02 -0.77 -4.98 117.16 112.24 1ock n TYR 79 Ca -0.01 -1.08 -0.46 0.00 -0.01 0.00 0.00 57.90 56.33 1ock n TYR 79 Cb 0.26 -0.45 -0.04 0.00 -0.02 0.00 0.00 39.34 39.08 1ock n TYR 79 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 176.86 173.72 1ock n ARG 80 N -0.47 2.23 -0.85 -0.72 0.63 -1.08 -0.92 116.66 115.48 1ock n ARG 80 Ca 0.29 0.81 0.00 0.00 -0.92 0.00 0.00 57.85 58.03 1ock n ARG 80 Cb 1.06 -2.61 0.00 0.00 0.45 0.00 0.00 32.46 31.36 1ock n ARG 80 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1ock n GLY 81 N 3.77 0.67 3.69 5.14 0.00 -1.26 -4.97 105.19 112.24 1ock n GLY 81 Ca 0.19 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.77 1ock n GLY 81 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 1ock n TRP 82 N -2.03 2.59 -4.00 1.61 -0.00 -0.10 -4.90 117.44 110.60 1ock n TRP 82 Ca 0.00 -0.02 -0.31 0.00 -0.00 0.00 0.00 57.50 57.17 1ock n TRP 82 Cb 0.01 -2.68 -0.15 0.00 -0.00 0.00 0.00 31.31 28.49 1ock n TRP 82 CO 0.00 0.00 0.00 -1.14 -0.00 0.00 0.00 177.69 176.55 1ock s GLN 83 N 2.04 1.44 0.80 5.87 2.00 -1.26 -1.03 119.66 129.53 1ock s GLN 83 Ca 0.80 -1.82 -0.13 0.00 -2.00 0.00 0.00 55.36 52.20 1ock s GLN 83 Cb -0.53 -3.13 0.08 0.00 0.80 0.00 0.00 33.01 30.23 1ock s GLN 83 CO 0.37 -0.94 1.21 -2.14 -0.50 0.00 0.00 175.29 173.29 1ock s PRO 84 N 0.95 1.65 0.07 1.67 0.02 -1.26 -4.92 135.00 133.18 1ock s PRO 84 Ca 0.11 1.78 -0.10 0.00 0.02 0.00 0.00 61.00 62.81 1ock s PRO 84 Cb -0.19 -1.77 -0.26 0.00 0.02 0.00 0.00 34.50 32.30 1ock s PRO 84 CO -0.09 -2.21 1.14 -0.09 -0.33 0.00 0.00 177.00 175.41 1ock h ARG 85 N -0.85 0.48 -5.89 5.54 9.65 -1.90 -3.40 114.38 118.00 1ock h ARG 85 Ca -0.46 -0.68 -0.60 0.00 -1.10 0.00 0.00 59.98 57.14 1ock h ARG 85 Cb 1.30 0.23 -0.14 0.00 -1.39 0.00 0.00 29.97 29.97 1ock h ARG 85 CO 0.46 1.30 -0.69 -1.54 2.80 0.00 0.00 179.97 182.30 1ock s SER 86 N -7.32 3.54 0.13 -3.80 1.04 -1.26 -4.67 113.70 101.36 1ock s SER 86 Ca -0.07 -1.18 -0.24 0.00 0.48 0.00 0.00 55.95 54.94 1ock s SER 86 Cb 0.06 -0.31 -0.07 0.00 0.10 0.00 0.00 66.02 65.80 1ock s SER 86 CO 0.91 -0.20 0.74 -1.81 0.98 0.00 0.00 173.24 173.86 1ock s ASP 87 N -3.57 7.30 0.57 7.02 1.01 -1.26 -3.63 116.67 124.12 1ock s ASP 87 Ca 0.32 1.55 -0.19 0.00 0.71 0.00 0.00 52.55 54.93 1ock s ASP 87 Cb 0.02 -2.47 -0.04 0.00 1.01 0.00 0.00 42.92 41.44 1ock s ASP 87 CO 0.15 0.19 1.21 0.00 0.21 0.00 0.00 175.17 176.94 1ock s ALA 88 N -0.97 2.62 0.30 5.23 0.00 -0.41 -4.74 121.76 123.80 1ock s ALA 88 Ca 0.35 1.02 0.06 0.00 0.00 0.00 0.00 51.96 53.38 1ock s ALA 88 Cb -0.22 -3.45 0.79 0.00 0.00 0.00 0.00 23.12 20.24 1ock s ALA 88 CO 0.24 -1.10 1.70 -1.35 0.00 0.00 0.00 175.76 175.26 1ock h PRO 89 N 1.08 0.44 0.00 0.00 0.11 -1.92 0.26 132.00 131.97 1ock h PRO 89 Ca -0.50 -0.03 -0.06 0.00 0.11 0.00 0.00 66.00 65.52 1ock h PRO 89 Cb 1.29 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 1ock h PRO 89 CO 0.56 0.29 -0.31 -0.39 -0.21 0.00 0.00 178.00 177.94 1ock h VAL 90 N 0.45 1.20 -0.34 3.15 -1.51 -1.82 -0.76 116.25 116.62 1ock h VAL 90 Ca 0.59 -1.06 -0.18 0.00 -1.23 0.00 0.00 66.70 64.82 1ock h VAL 90 Cb 1.13 1.58 -0.00 0.00 -2.13 0.00 0.00 31.29 31.86 1ock h VAL 90 CO -0.52 0.30 -0.48 0.58 -1.23 0.00 0.00 177.57 176.23 1ock h VAL 91 N 0.00 1.27 -0.06 7.19 2.07 -0.87 -2.98 116.25 122.86 1ock h VAL 91 Ca -0.00 -1.65 -0.06 0.00 0.82 0.00 0.00 66.70 65.80 1ock h VAL 91 Cb 0.55 1.51 -0.01 0.00 -1.52 0.00 0.00 31.29 31.82 1ock h VAL 91 CO 0.04 0.55 -0.26 0.24 0.02 0.00 0.00 177.57 178.16 1ock h MET 92 N 0.72 0.11 -0.76 1.57 2.86 -0.51 -0.84 114.93 118.08 1ock h MET 92 Ca 0.04 -0.03 -0.03 0.00 -2.06 0.00 0.00 59.70 57.61 1ock h MET 92 Cb 1.08 -0.01 -0.04 0.00 0.06 0.00 0.00 31.60 32.70 1ock h MET 92 CO 0.11 0.36 0.35 0.52 1.06 0.00 0.00 176.91 179.31 1ock h MET 93 N 0.10 1.09 -0.09 1.72 2.86 -1.02 0.10 114.93 119.69 1ock h MET 93 Ca 0.02 -0.16 -0.08 0.00 -2.06 0.00 0.00 59.70 57.42 1ock h MET 93 Cb 0.51 -0.20 0.00 0.00 0.06 0.00 0.00 31.60 31.98 1ock h MET 93 CO 0.04 0.85 -0.24 -0.07 1.06 0.00 0.00 176.91 178.54 1ock h LEU 94 N 1.08 0.37 -0.57 1.22 3.38 -1.28 -2.99 115.31 116.52 1ock h LEU 94 Ca 0.26 -0.59 -0.04 0.00 0.09 0.00 0.00 57.88 57.60 1ock h LEU 94 Cb 0.13 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 1ock h LEU 94 CO -0.03 0.90 0.18 0.11 0.09 0.00 0.00 178.44 179.69 1ock h LYS 95 N -0.13 0.88 0.00 1.13 1.57 -0.95 -1.41 116.57 117.66 1ock h LYS 95 Ca -0.00 -0.19 -0.02 0.00 -1.87 0.00 0.00 60.65 58.57 1ock h LYS 95 Cb 0.85 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 33.03 1ock h LYS 95 CO 0.05 0.79 -0.10 0.00 -0.57 0.00 0.00 179.45 179.63 1ock h ARG 96 N 0.80 0.00 -0.00 3.15 3.08 -0.87 -0.10 114.38 120.43 1ock h ARG 96 Ca 0.18 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.23 1ock h ARG 96 Cb 0.28 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.33 1ock h ARG 96 CO -0.01 0.10 -0.11 0.00 -1.07 0.00 0.00 179.97 178.88 1ock n ALA 97 N -2.32 2.75 0.00 0.04 0.00 -0.88 -4.92 120.51 115.18 1ock n ALA 97 Ca -0.02 -0.26 0.00 0.00 0.00 0.00 0.00 53.44 53.16 1ock n ALA 97 Cb 0.20 -1.34 0.00 0.00 0.00 0.00 0.00 19.45 18.31 1ock n ALA 97 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ock n GLY 98 N 1.28 0.72 3.76 0.00 0.00 -0.05 -1.09 105.19 109.82 1ock n GLY 98 Ca 0.14 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.86 1ock n GLY 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ock s ALA 99 N -2.00 2.10 -0.21 4.61 0.00 -0.58 -3.25 121.76 122.42 1ock s ALA 99 Ca 0.00 0.19 -0.05 0.00 0.00 0.00 0.00 51.96 52.10 1ock s ALA 99 Cb 0.00 -3.25 -0.02 0.00 0.00 0.00 0.00 23.12 19.84 1ock s ALA 99 CO 0.00 -1.90 0.00 0.99 0.00 0.00 0.00 175.76 174.85 1ock s THR 100 N -2.91 3.88 -0.68 0.00 2.01 -0.39 -4.57 115.64 112.98 1ock s THR 100 Ca 0.62 -0.33 -0.24 0.00 0.31 0.00 0.00 61.69 62.04 1ock s THR 100 Cb -0.17 -2.77 0.05 0.00 0.01 0.00 0.00 72.50 69.63 1ock s THR 100 CO 0.56 0.41 1.08 -0.63 -0.69 0.00 0.00 174.62 175.35 1ock s ILE 101 N 1.22 4.11 -0.66 1.82 -1.09 -1.26 -0.39 121.20 124.96 1ock s ILE 101 Ca 0.03 -0.04 0.25 0.00 -2.23 0.00 0.00 60.65 58.67 1ock s ILE 101 Cb -0.15 -4.76 0.22 0.00 -1.58 0.00 0.00 42.46 36.20 1ock s ILE 101 CO 0.01 -1.57 1.61 -0.29 -1.23 0.00 0.00 174.94 173.47 1ock h ILE 102 N 6.00 0.00 0.00 2.92 2.10 -1.70 -3.47 117.51 123.36 1ock h ILE 102 Ca -0.28 -0.56 0.00 0.00 1.08 0.00 0.00 64.86 65.10 1ock h ILE 102 Cb 1.06 1.43 0.00 0.00 -1.09 0.00 0.00 36.82 38.22 1ock h ILE 102 CO 1.21 0.00 0.00 0.61 -1.08 0.00 0.00 178.15 178.89 1ock n GLY 103 N 1.29 0.15 3.54 8.18 0.00 -1.25 -1.26 105.19 115.84 1ock n GLY 103 Ca 0.05 -1.09 -0.36 0.00 0.00 0.00 0.00 46.02 44.62 1ock n GLY 103 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ock s LYS 104 N -2.00 3.82 0.32 1.61 -0.14 -0.64 -1.61 119.74 121.10 1ock s LYS 104 Ca 0.00 -0.40 -0.14 0.00 -1.36 0.00 0.00 55.97 54.07 1ock s LYS 104 Cb 0.00 -3.33 -0.08 0.00 -1.68 0.00 0.00 37.83 32.73 1ock s LYS 104 CO 0.00 -0.01 0.72 0.95 -0.76 0.00 0.00 175.35 176.24 1ock s THR 105 N 1.16 4.72 0.59 2.17 -4.23 0.20 -0.37 115.64 119.89 1ock s THR 105 Ca 0.05 0.85 -0.20 0.00 -1.18 0.00 0.00 61.69 61.21 1ock s THR 105 Cb -0.14 -3.62 -0.03 0.00 1.34 0.00 0.00 72.50 70.04 1ock s THR 105 CO 0.04 -0.21 1.28 0.42 -0.54 0.00 0.00 174.62 175.60 1ock s THR 106 N -2.01 2.29 0.02 3.99 -4.23 -0.29 -1.00 115.64 114.41 1ock s THR 106 Ca 0.53 0.19 0.01 0.00 -1.18 0.00 0.00 61.69 61.24 1ock s THR 106 Cb -0.10 -3.09 -0.02 0.00 1.34 0.00 0.00 72.50 70.63 1ock s THR 106 CO 0.20 -0.03 -0.04 0.28 -0.54 0.00 0.00 174.62 174.48 1ock s THR 107 N -1.44 0.26 0.75 3.99 -1.32 -1.26 -1.66 115.64 114.97 1ock s THR 107 Ca 0.77 -0.83 -0.12 0.00 -1.21 0.00 0.00 61.69 60.30 1ock s THR 107 Cb -0.36 -0.36 0.05 0.00 -1.51 0.00 0.00 72.50 70.33 1ock s THR 107 CO 0.40 -0.37 1.11 0.42 -2.21 0.00 0.00 174.62 173.97 1ock s THR 108 N -1.19 3.05 -0.17 5.08 -4.23 -1.14 -4.29 115.64 112.74 1ock s THR 108 Ca -0.11 0.40 -0.36 0.00 -1.18 0.00 0.00 61.69 60.43 1ock s THR 108 Cb -0.08 -2.84 -0.13 0.00 1.34 0.00 0.00 72.50 70.79 1ock s THR 108 CO -0.00 -0.39 1.87 0.00 -0.54 0.00 0.00 174.62 175.55 1ock n ALA 109 N -3.21 0.55 -2.12 3.99 0.00 -1.23 -0.76 120.51 117.73 1ock n ALA 109 Ca 0.10 0.28 -0.13 0.00 0.00 0.00 0.00 53.44 53.69 1ock n ALA 109 Cb 0.52 -2.42 -0.02 0.00 0.00 0.00 0.00 19.45 17.53 1ock n ALA 109 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1ock n PHE 110 N 6.55 -1.07 -2.74 0.00 3.01 -0.46 -1.66 117.46 121.09 1ock n PHE 110 Ca 0.25 0.00 -0.18 0.00 1.01 0.00 0.00 57.45 58.53 1ock n PHE 110 Cb 0.24 -2.79 0.02 0.00 -0.01 0.00 0.00 39.48 36.94 1ock n PHE 110 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1ock n ALA 111 N -1.39 -0.73 -2.37 4.37 0.00 0.06 -4.85 120.51 115.61 1ock n ALA 111 Ca -0.15 0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.51 1ock n ALA 111 Cb 0.56 -2.96 0.00 0.00 0.00 0.00 0.00 19.45 17.06 1ock n ALA 111 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1ock n SER 112 N -1.66 0.08 0.16 0.00 2.88 -0.66 -4.73 113.62 109.67 1ock n SER 112 Ca -0.13 0.00 0.13 0.00 -1.33 0.00 0.00 58.87 57.54 1ock n SER 112 Cb 0.62 0.00 0.36 0.00 -0.75 0.00 0.00 64.21 64.44 1ock n SER 112 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 1ock h ARG 113 N 0.00 0.00 -6.14 -1.46 3.08 -1.92 -3.44 114.38 104.51 1ock h ARG 113 Ca 0.00 0.00 -0.58 0.00 0.07 0.00 0.00 59.98 59.47 1ock h ARG 113 Cb 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.04 1ock h ARG 113 CO 0.00 0.00 1.38 -0.51 -1.07 0.00 0.00 179.97 179.77 1ock s ASP 114 N -5.13 5.70 0.48 7.04 1.01 -1.26 -4.51 116.67 120.00 1ock s ASP 114 Ca 0.08 1.61 -0.23 0.00 0.71 0.00 0.00 52.55 54.73 1ock s ASP 114 Cb 0.09 -2.52 -0.08 0.00 1.01 0.00 0.00 42.92 41.42 1ock s ASP 114 CO 0.59 -1.81 1.11 -2.65 0.21 0.00 0.00 175.17 172.62 1ock n PRO 115 N 8.56 1.44 -0.34 8.23 -0.02 -1.26 -3.99 135.00 147.63 1ock n PRO 115 Ca 0.26 0.52 0.00 0.00 -2.02 0.00 0.00 63.50 62.26 1ock n PRO 115 Cb 0.46 -2.23 0.00 0.00 -0.02 0.00 0.00 33.50 31.71 1ock n PRO 115 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1ock n THR 116 N -0.78 0.00 0.55 3.45 -2.24 -1.26 -4.93 114.28 109.07 1ock n THR 116 Ca 0.10 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.99 1ock n THR 116 Cb 0.42 -1.51 0.17 0.00 -2.10 0.00 0.00 70.33 67.31 1ock n THR 116 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ock n ALA 117 N -3.00 2.43 -1.77 6.98 0.00 -1.26 -4.96 120.51 118.93 1ock n ALA 117 Ca 0.00 -0.88 -0.40 0.00 0.00 0.00 0.00 53.44 52.16 1ock n ALA 117 Cb 0.00 -0.83 -0.03 0.00 0.00 0.00 0.00 19.45 18.59 1ock n ALA 117 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1ock s THR 118 N -1.64 3.02 0.17 0.00 2.01 -1.25 -4.77 115.64 113.18 1ock s THR 118 Ca 0.34 1.01 0.09 0.00 0.31 0.00 0.00 61.69 63.44 1ock s THR 118 Cb 0.21 -3.64 -0.04 0.00 0.01 0.00 0.00 72.50 69.04 1ock s THR 118 CO 0.30 0.23 -0.10 -0.76 -0.69 0.00 0.00 174.62 173.60 1ock s LEU 119 N -1.75 2.96 0.14 4.42 1.43 0.06 -4.42 118.68 121.52 1ock s LEU 119 Ca 0.48 -0.56 -0.31 0.00 -1.03 0.00 0.00 54.13 52.71 1ock s LEU 119 Cb -0.36 -1.66 -0.08 0.00 0.03 0.00 0.00 46.19 44.11 1ock s LEU 119 CO 0.47 0.11 1.39 0.21 0.23 0.00 0.00 176.35 178.77 1ock s ASN 120 N -2.75 6.81 0.37 2.29 3.84 -0.09 -4.68 114.94 120.74 1ock s ASN 120 Ca 0.24 2.37 0.04 0.00 0.21 0.00 0.00 52.86 55.72 1ock s ASN 120 Cb -0.09 -2.59 0.71 0.00 -0.55 0.00 0.00 41.25 38.73 1ock s ASN 120 CO 0.15 -0.65 2.01 -0.65 -2.79 0.00 0.00 177.10 175.17 1ock h PRO 121 N 6.50 0.69 0.00 0.43 0.11 -1.90 -2.51 132.00 135.33 1ock h PRO 121 Ca -0.43 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 65.60 1ock h PRO 121 Cb 1.21 -0.15 -0.00 0.00 0.11 0.00 0.00 31.00 32.17 1ock h PRO 121 CO 0.85 0.48 -0.13 0.45 -0.21 0.00 0.00 178.00 179.44 1ock h HIS 122 N 0.71 0.00 -0.73 0.65 3.86 -1.90 -3.42 115.15 114.31 1ock h HIS 122 Ca 0.19 0.00 0.07 0.00 -1.16 0.00 0.00 60.37 59.46 1ock h HIS 122 Cb -0.03 0.00 -0.20 0.00 1.06 0.00 0.00 27.41 28.24 1ock h HIS 122 CO 0.00 0.13 -0.28 1.21 0.86 0.00 0.00 177.93 179.86 1ock s ASN 123 N -6.10 -1.18 0.62 2.45 3.84 -0.98 -4.90 114.94 108.70 1ock s ASN 123 Ca 0.03 -0.09 0.10 0.00 0.21 0.00 0.00 52.86 53.11 1ock s ASN 123 Cb 0.08 1.66 0.52 0.00 -0.55 0.00 0.00 41.25 42.96 1ock s ASN 123 CO 0.64 -0.19 1.27 0.74 -2.79 0.00 0.00 177.10 176.77 1ock h THR 124 N 5.14 0.00 -0.03 -5.21 2.02 -1.74 0.45 112.91 113.54 1ock h THR 124 Ca -0.02 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.16 1ock h THR 124 Cb 1.19 0.21 0.00 0.00 -1.74 0.00 0.00 68.15 67.81 1ock h THR 124 CO 0.05 0.00 0.00 0.61 0.37 0.00 0.00 175.52 176.55 1ock n GLY 125 N -1.39 -0.18 3.49 2.16 0.00 -1.26 -4.61 105.19 103.40 1ock n GLY 125 Ca -0.01 -0.39 -0.25 0.00 0.00 0.00 0.00 46.02 45.38 1ock n GLY 125 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1ock s HIS 126 N -1.98 2.37 0.44 1.61 3.76 0.16 -1.16 115.29 120.50 1ock s HIS 126 Ca 0.39 -0.31 -0.22 0.00 -0.15 0.00 0.00 55.06 54.76 1ock s HIS 126 Cb 0.21 -1.08 -0.09 0.00 1.11 0.00 0.00 32.58 32.73 1ock s HIS 126 CO 0.33 0.64 1.05 0.45 -0.85 0.00 0.00 174.74 176.36 1ock s SER 127 N -3.28 6.52 0.00 1.40 0.15 0.44 -0.91 113.70 118.02 1ock s SER 127 Ca 0.28 2.01 0.25 0.00 0.70 0.00 0.00 55.95 59.19 1ock s SER 127 Cb -0.06 -2.58 0.89 0.00 -1.71 0.00 0.00 66.02 62.56 1ock s SER 127 CO 0.14 -0.66 1.64 -0.81 1.20 0.00 0.00 173.24 174.76 1ock n PRO 128 N -0.51 1.74 0.00 5.44 -0.04 -1.26 -4.44 135.00 135.94 1ock n PRO 128 Ca 0.07 -1.10 0.00 0.00 -0.04 0.00 0.00 63.50 62.44 1ock n PRO 128 Cb 0.51 -1.45 0.00 0.00 -0.04 0.00 0.00 33.50 32.52 1ock n PRO 128 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1ock n GLY 129 N 1.18 -2.53 3.81 0.55 0.00 -1.26 -4.50 105.19 102.43 1ock n GLY 129 Ca 0.18 -1.75 -0.05 0.00 0.00 0.00 0.00 46.02 44.39 1ock n GLY 129 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ock s GLY 130 N -0.81 -0.04 0.03 -0.02 0.00 -1.24 -4.18 107.32 101.06 1ock s GLY 130 Ca 0.00 -0.19 0.25 0.00 0.00 0.00 0.00 44.72 44.78 1ock s GLY 130 CO 0.00 0.42 1.45 -1.14 0.00 0.00 0.00 173.10 173.82 1ock n SER 131 N -0.76 0.50 -2.92 1.64 3.41 -1.25 -4.08 113.62 110.16 1ock n SER 131 Ca -0.05 -0.06 -0.31 0.00 -0.26 0.00 0.00 58.87 58.19 1ock n SER 131 Cb 0.60 0.14 -0.07 0.00 -0.26 0.00 0.00 64.21 64.62 1ock n SER 131 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1ock n SER 132 N -1.68 7.55 0.16 4.04 7.64 -1.19 -2.88 113.62 127.26 1ock n SER 132 Ca 0.05 -2.69 -0.14 0.00 1.01 0.00 0.00 58.87 57.11 1ock n SER 132 Cb 0.37 -1.47 -0.06 0.00 -1.01 0.00 0.00 64.21 62.04 1ock n SER 132 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1ock h SER 133 N 4.24 -0.74 -0.13 6.43 0.02 -1.72 -2.85 113.55 118.80 1ock h SER 133 Ca 0.63 0.07 -0.08 0.00 -0.84 0.00 0.00 61.79 61.57 1ock h SER 133 Cb 0.65 0.26 -0.02 0.00 0.14 0.00 0.00 62.40 63.44 1ock h SER 133 CO 1.25 -0.38 -0.17 1.23 -1.14 0.00 0.00 176.83 177.63 1ock h GLY 134 N -0.54 0.57 0.79 -3.77 0.00 -1.51 -2.02 103.07 96.58 1ock h GLY 134 Ca 0.01 -0.42 -0.04 0.00 0.00 0.00 0.00 47.33 46.88 1ock h GLY 134 CO -0.09 0.39 -0.03 1.76 0.00 0.00 0.00 176.54 178.56 1ock h SER 135 N 0.48 0.34 -0.28 0.19 0.02 -1.76 0.80 113.55 113.34 1ock h SER 135 Ca 0.08 -0.36 -0.03 0.00 -0.84 0.00 0.00 61.79 60.65 1ock h SER 135 Cb 0.57 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 63.01 1ock h SER 135 CO 0.04 0.61 0.07 0.00 -1.14 0.00 0.00 176.83 176.41 1ock h ALA 136 N 0.73 0.37 -0.18 3.77 0.00 -1.51 -2.49 119.26 119.96 1ock h ALA 136 Ca 0.05 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 1ock h ALA 136 Cb 0.46 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1ock h ALA 136 CO 0.02 0.03 0.10 0.00 0.00 0.00 0.00 179.25 179.39 1ock h ALA 137 N 0.90 0.22 -0.51 0.00 0.00 -1.33 -0.21 119.26 118.32 1ock h ALA 137 Ca 0.09 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 55.00 1ock h ALA 137 Cb 0.28 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 17.95 1ock h ALA 137 CO 0.00 -0.25 0.25 0.00 0.00 0.00 0.00 179.25 179.25 1ock h ALA 138 N 1.01 0.66 -0.44 0.00 0.00 -0.81 0.24 119.26 119.91 1ock h ALA 138 Ca 0.06 0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.88 1ock h ALA 138 Cb 0.05 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1ock h ALA 138 CO -0.01 -0.11 -0.20 0.28 0.00 0.00 0.00 179.25 179.21 1ock h VAL 139 N 0.48 1.27 0.00 0.00 2.07 -1.33 -0.56 116.25 118.19 1ock h VAL 139 Ca 0.23 -1.35 -0.05 0.00 0.82 0.00 0.00 66.70 66.36 1ock h VAL 139 Cb 0.16 1.20 -0.01 0.00 -1.52 0.00 0.00 31.29 31.12 1ock h VAL 139 CO -0.17 0.46 -0.22 1.23 0.02 0.00 0.00 177.57 178.89 1ock h GLY 140 N 0.75 0.00 -1.90 2.17 0.00 -0.43 -2.13 103.07 101.53 1ock h GLY 140 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.43 1ock h GLY 140 CO 0.06 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.60 1ock n ALA 141 N -2.30 2.75 -2.13 3.60 0.00 0.80 -4.79 120.51 118.44 1ock n ALA 141 Ca -0.01 -0.88 -0.20 0.00 0.00 0.00 0.00 53.44 52.35 1ock n ALA 141 Cb 0.35 -1.00 -0.04 0.00 0.00 0.00 0.00 19.45 18.76 1ock n ALA 141 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ock n GLY 142 N 0.89 0.33 0.14 0.00 0.00 -0.80 -4.90 105.19 100.85 1ock n GLY 142 Ca 0.15 -0.02 -0.23 0.00 0.00 0.00 0.00 46.02 45.92 1ock n GLY 142 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1ock h MET 143 N 0.00 0.46 -3.72 1.61 2.07 -1.31 -3.42 114.93 110.61 1ock h MET 143 Ca -0.46 -0.78 -0.14 0.00 -2.07 0.00 0.00 59.70 56.24 1ock h MET 143 Cb 1.35 0.29 -0.20 0.00 -1.87 0.00 0.00 31.60 31.18 1ock h MET 143 CO 0.59 1.37 -0.55 0.96 1.07 0.00 0.00 176.91 180.34 1ock s ILE 144 N -2.60 0.11 -0.79 -1.22 -4.36 -1.23 -4.49 121.20 106.61 1ock s ILE 144 Ca -0.10 -0.89 0.27 0.00 -0.26 0.00 0.00 60.65 59.67 1ock s ILE 144 Cb 0.05 -0.55 0.27 0.00 1.25 0.00 0.00 42.46 43.48 1ock s ILE 144 CO 0.91 -0.49 1.81 -0.81 0.24 0.00 0.00 174.94 176.60 1ock n PRO 145 N 1.25 0.19 -3.59 0.37 -0.04 -1.25 -4.47 135.00 127.46 1ock n PRO 145 Ca -0.22 0.17 -0.16 0.00 -0.04 0.00 0.00 63.50 63.25 1ock n PRO 145 Cb 0.56 -1.73 -0.07 0.00 -0.04 0.00 0.00 33.50 32.23 1ock n PRO 145 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1ock s LEU 146 N -4.11 -0.27 -0.07 1.53 2.96 -1.23 -4.30 118.68 113.19 1ock s LEU 146 Ca 0.11 0.64 -0.18 0.00 -0.22 0.00 0.00 54.13 54.49 1ock s LEU 146 Cb 0.14 2.19 0.04 0.00 0.50 0.00 0.00 46.19 49.06 1ock s LEU 146 CO 0.56 -0.52 0.42 0.00 -1.32 0.00 0.00 176.35 175.49 1ock s ALA 147 N -1.02 -1.06 -0.02 5.97 0.00 -0.92 -1.71 121.76 123.00 1ock s ALA 147 Ca -0.10 0.80 -0.02 0.00 0.00 0.00 0.00 51.96 52.64 1ock s ALA 147 Cb -0.02 -0.19 -0.04 0.00 0.00 0.00 0.00 23.12 22.87 1ock s ALA 147 CO 0.07 -0.26 0.11 -0.51 0.00 0.00 0.00 175.76 175.17 1ock s LEU 148 N -0.81 4.07 0.00 0.00 1.43 -0.13 -0.70 118.68 122.54 1ock s LEU 148 Ca -0.09 0.23 0.00 0.00 -1.03 0.00 0.00 54.13 53.25 1ock s LEU 148 Cb -0.04 -2.34 0.00 0.00 0.03 0.00 0.00 46.19 43.84 1ock s LEU 148 CO 0.04 0.28 0.00 0.61 0.23 0.00 0.00 176.35 177.52 1ock n GLY 149 N 1.21 3.65 3.17 -3.19 0.00 -0.23 -2.21 105.19 107.59 1ock n GLY 149 Ca -0.13 -1.44 -0.09 0.00 0.00 0.00 0.00 46.02 44.36 1ock n GLY 149 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ock s THR 150 N -2.16 0.15 -0.02 2.61 -4.23 -1.26 -0.94 115.64 109.79 1ock s THR 150 Ca 0.00 -1.22 0.00 0.00 -1.18 0.00 0.00 61.69 59.30 1ock s THR 150 Cb 0.00 -1.23 0.02 0.00 1.34 0.00 0.00 72.50 72.63 1ock s THR 150 CO 0.00 -0.67 0.00 -1.58 -0.54 0.00 0.00 174.62 171.83 1ock s GLN 151 N -3.47 0.20 0.00 3.99 0.74 0.55 -3.58 119.66 118.09 1ock s GLN 151 Ca 0.02 0.08 0.00 0.00 0.05 0.00 0.00 55.36 55.51 1ock s GLN 151 Cb 0.03 -0.38 0.00 0.00 1.10 0.00 0.00 33.01 33.76 1ock s GLN 151 CO -0.09 -0.12 0.00 2.41 -0.55 0.00 0.00 175.29 176.94 1ock n THR 152 N 3.99 0.00 0.00 -0.34 -1.04 -1.26 -1.24 114.28 114.39 1ock n THR 152 Ca -0.25 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.76 1ock n THR 152 Cb 0.51 -0.39 0.00 0.00 -1.82 0.00 0.00 70.33 68.63 1ock n THR 152 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1ock n GLY 153 N 2.96 -0.03 1.19 3.41 0.00 -1.26 -4.81 105.19 106.65 1ock n GLY 153 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.02 1ock n GLY 153 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ock n GLY 154 N 3.38 0.79 0.00 -0.02 0.00 -1.26 -2.74 105.19 105.33 1ock n GLY 154 Ca 0.00 -0.44 0.03 0.00 0.00 0.00 0.00 46.02 45.62 1ock n GLY 154 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1ock n SER 155 N 0.26 0.00 -0.02 1.61 7.64 -1.26 -1.60 113.62 120.25 1ock n SER 155 Ca -0.07 -0.03 -0.06 0.00 1.01 0.00 0.00 58.87 59.73 1ock n SER 155 Cb 0.92 -0.14 -0.02 0.00 -1.01 0.00 0.00 64.21 63.96 1ock n SER 155 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 1ock n VAL 156 N -1.14 1.02 -0.20 0.44 0.31 -1.23 -3.16 118.33 114.37 1ock n VAL 156 Ca 0.04 0.15 -0.08 0.00 -0.01 0.00 0.00 64.34 64.44 1ock n VAL 156 Cb 0.04 -1.76 0.02 0.00 -0.91 0.00 0.00 33.84 31.23 1ock n VAL 156 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 1ock h ILE 157 N -0.34 1.22 0.29 2.52 1.08 -1.92 -2.84 117.51 117.51 1ock h ILE 157 Ca -0.09 -0.67 -0.01 0.00 -0.39 0.00 0.00 64.86 63.70 1ock h ILE 157 Cb 0.67 0.60 0.00 0.00 -3.07 0.00 0.00 36.82 35.03 1ock h ILE 157 CO -0.06 0.26 -0.14 -0.09 -0.69 0.00 0.00 178.15 177.44 1ock h ARG 158 N 0.77 -0.37 0.00 2.37 2.43 -1.42 -2.04 114.38 116.12 1ock h ARG 158 Ca 0.19 0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.36 1ock h ARG 158 Cb 0.18 0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 29.81 1ock h ARG 158 CO -0.02 -0.08 -0.14 -1.00 -1.51 0.00 0.00 179.97 177.22 1ock h PRO 159 N -0.65 0.00 -0.32 0.20 0.13 -1.74 -0.88 132.00 128.74 1ock h PRO 159 Ca -0.04 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 65.03 1ock h PRO 159 Cb 0.46 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.58 1ock h PRO 159 CO 0.06 0.14 -0.04 0.00 -0.23 0.00 0.00 178.00 177.93 1ock h ALA 160 N 1.86 0.44 -0.66 -0.56 0.00 -1.44 -0.82 119.26 118.07 1ock h ALA 160 Ca -0.00 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.60 1ock h ALA 160 Cb 0.28 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 1ock h ALA 160 CO 0.02 0.23 0.25 0.00 0.00 0.00 0.00 179.25 179.75 1ock h ALA 161 N 0.82 0.86 -0.58 0.00 0.00 -0.64 0.58 119.26 120.30 1ock h ALA 161 Ca 0.09 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 54.75 1ock h ALA 161 Cb 0.51 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 1ock h ALA 161 CO 0.02 0.49 0.13 1.88 0.00 0.00 0.00 179.25 181.77 1ock h TYR 162 N 0.94 0.94 -0.23 0.00 0.99 -1.00 -2.93 116.97 115.67 1ock h TYR 162 Ca 0.22 -0.10 0.00 0.00 2.00 0.00 0.00 58.73 60.85 1ock h TYR 162 Cb 0.23 -0.27 0.00 0.00 1.00 0.00 0.00 36.73 37.69 1ock h TYR 162 CO 0.02 0.79 0.00 0.00 -0.00 0.00 0.00 178.16 178.96 1ock n GLY 164 N 1.36 -0.17 3.73 0.00 0.00 0.04 -4.60 105.19 105.54 1ock n GLY 164 Ca 0.17 -0.19 -0.23 0.00 0.00 0.00 0.00 46.02 45.77 1ock n GLY 164 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ock s THR 165 N -2.90 2.99 0.47 2.61 -4.23 -0.30 -4.85 115.64 109.43 1ock s THR 165 Ca 0.15 -1.71 -0.10 0.00 -1.18 0.00 0.00 61.69 58.85 1ock s THR 165 Cb -0.07 -2.97 -0.06 0.00 1.34 0.00 0.00 72.50 70.75 1ock s THR 165 CO 0.18 -0.18 0.85 0.00 -0.54 0.00 0.00 174.62 174.93 1ock s ALA 166 N -2.43 3.28 -0.15 3.99 0.00 0.05 -4.49 121.76 122.01 1ock s ALA 166 Ca 0.38 -0.19 -0.30 0.00 0.00 0.00 0.00 51.96 51.85 1ock s ALA 166 Cb -0.02 -2.80 0.13 0.00 0.00 0.00 0.00 23.12 20.42 1ock s ALA 166 CO 0.22 -0.23 1.00 0.00 0.00 0.00 0.00 175.76 176.76 1ock s ALA 167 N -2.62 -1.93 -0.02 0.00 0.00 -1.23 -1.61 121.76 114.35 1ock s ALA 167 Ca 0.52 1.55 0.01 0.00 0.00 0.00 0.00 51.96 54.04 1ock s ALA 167 Cb -0.10 -0.63 0.01 0.00 0.00 0.00 0.00 23.12 22.40 1ock s ALA 167 CO 0.38 -0.34 -0.05 -1.50 0.00 0.00 0.00 175.76 174.25 1ock s ILE 168 N -1.29 0.45 -0.45 0.00 2.07 -0.60 -0.84 121.20 120.54 1ock s ILE 168 Ca -0.01 -0.16 -0.08 0.00 -1.41 0.00 0.00 60.65 58.99 1ock s ILE 168 Cb -0.01 -0.43 0.10 0.00 0.13 0.00 0.00 42.46 42.26 1ock s ILE 168 CO 0.01 0.17 0.30 -0.75 -1.91 0.00 0.00 174.94 172.75 1ock s LYS 169 N 0.39 2.46 1.30 3.50 2.20 0.37 -1.73 119.74 128.23 1ock s LYS 169 Ca -0.05 -1.67 -0.18 0.00 -0.36 0.00 0.00 55.97 53.71 1ock s LYS 169 Cb -0.08 -3.83 0.33 0.00 -1.51 0.00 0.00 37.83 32.73 1ock s LYS 169 CO -0.00 -1.10 0.99 -2.14 -0.36 0.00 0.00 175.35 172.73 1ock s PRO 170 N 1.36 -1.95 0.35 4.03 0.02 -1.26 -1.04 135.00 136.51 1ock s PRO 170 Ca 0.05 0.39 -0.28 0.00 0.02 0.00 0.00 61.00 61.18 1ock s PRO 170 Cb -0.25 -1.47 -0.12 0.00 0.02 0.00 0.00 34.50 32.68 1ock s PRO 170 CO -0.00 -4.29 1.31 0.43 -0.33 0.00 0.00 177.00 174.12 1ock n SER 171 N -5.25 2.89 -4.60 2.53 7.64 -1.26 -4.55 113.62 111.02 1ock n SER 171 Ca 0.08 1.21 -0.48 0.00 1.01 0.00 0.00 58.87 60.69 1ock n SER 171 Cb 0.58 -1.50 -0.04 0.00 -1.01 0.00 0.00 64.21 62.24 1ock n SER 171 CO 0.00 0.00 0.00 0.33 -3.01 0.00 0.00 175.04 172.36 1ock n PHE 172 N 0.32 1.53 -0.96 1.43 7.35 -0.44 -2.08 117.46 124.60 1ock n PHE 172 Ca 0.04 0.61 0.00 0.00 -0.76 0.00 0.00 57.45 57.34 1ock n PHE 172 Cb 0.37 -2.33 0.00 0.00 0.35 0.00 0.00 39.48 37.87 1ock n PHE 172 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 1ock n ARG 173 N 1.88 -1.14 0.02 -4.13 1.74 -1.26 -4.88 116.66 108.89 1ock n ARG 173 Ca 0.14 0.28 -0.13 0.00 -0.77 0.00 0.00 57.85 57.38 1ock n ARG 173 Cb 0.26 -4.24 -0.09 0.00 -1.02 0.00 0.00 32.46 27.37 1ock n ARG 173 CO 0.00 0.00 0.00 1.98 -1.52 0.00 0.00 177.63 178.09 1ock h MET 174 N 0.44 -0.08 -5.94 5.56 4.05 -1.78 -3.42 114.93 113.77 1ock h MET 174 Ca 0.00 0.01 -0.59 0.00 -0.28 0.00 0.00 59.70 58.84 1ock h MET 174 Cb 0.57 0.02 -0.06 0.00 -0.80 0.00 0.00 31.60 31.32 1ock h MET 174 CO 0.00 0.38 -0.14 -0.51 0.23 0.00 0.00 176.91 176.87 1ock s LEU 175 N -9.23 4.40 0.50 3.39 1.43 -1.26 -5.05 118.68 112.86 1ock s LEU 175 Ca -0.15 0.96 -0.22 0.00 -1.03 0.00 0.00 54.13 53.69 1ock s LEU 175 Cb 0.02 -2.70 -0.06 0.00 0.03 0.00 0.00 46.19 43.47 1ock s LEU 175 CO 0.63 0.17 1.20 -2.16 0.23 0.00 0.00 176.35 176.42 1ock s PRO 176 N -0.31 3.50 -0.06 1.29 0.04 -1.26 -4.69 135.00 133.51 1ock s PRO 176 Ca 0.26 1.84 0.18 0.00 0.04 0.00 0.00 61.00 63.32 1ock s PRO 176 Cb -0.17 -2.26 0.59 0.00 0.04 0.00 0.00 34.50 32.70 1ock s PRO 176 CO 0.13 -0.79 1.51 0.25 0.04 0.00 0.00 177.00 178.14 1ock n THR 177 N -0.83 1.41 -1.88 1.26 -2.24 -1.26 -4.64 114.28 106.10 1ock n THR 177 Ca 0.09 -1.14 -0.41 0.00 -2.27 0.00 0.00 64.05 60.32 1ock n THR 177 Cb 0.48 0.31 -0.01 0.00 -2.10 0.00 0.00 70.33 69.00 1ock n THR 177 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1ock s VAL 178 N -1.45 2.27 -0.34 2.28 1.01 -1.26 -1.40 120.40 121.52 1ock s VAL 178 Ca 0.44 0.24 0.00 0.00 0.00 0.00 0.00 61.98 62.66 1ock s VAL 178 Cb 0.26 -3.16 0.00 0.00 0.00 0.00 0.00 36.38 33.48 1ock s VAL 178 CO 0.25 0.05 0.00 0.61 0.00 0.00 0.00 175.10 176.00 1ock n GLY 179 N 1.60 0.61 3.07 4.51 0.00 -1.26 -4.01 105.19 109.70 1ock n GLY 179 Ca 0.05 -0.42 -0.32 0.00 0.00 0.00 0.00 46.02 45.34 1ock n GLY 179 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ock s VAL 180 N -1.98 1.97 -0.15 1.61 1.01 -0.49 -0.60 120.40 121.77 1ock s VAL 180 Ca 0.00 -1.19 -0.39 0.00 0.00 0.00 0.00 61.98 60.40 1ock s VAL 180 Cb 0.00 -1.96 -0.17 0.00 0.00 0.00 0.00 36.38 34.26 1ock s VAL 180 CO 0.00 0.25 1.55 1.17 0.00 0.00 0.00 175.10 178.07 1ock n LYS 181 N 4.58 0.99 -3.15 2.72 3.00 -0.04 -4.90 118.16 121.36 1ock n LYS 181 Ca -0.17 0.36 -0.39 0.00 -0.00 0.00 0.00 58.31 58.11 1ock n LYS 181 Cb 0.46 -2.00 -0.06 0.00 0.00 0.00 0.00 35.03 33.43 1ock n LYS 181 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1ock n TYR 183 N 1.81 0.00 -3.61 0.00 4.19 -1.26 -4.69 117.16 113.60 1ock n TYR 183 Ca -0.08 0.00 -0.24 0.00 3.31 0.00 0.00 57.90 60.89 1ock n TYR 183 Cb 0.50 -0.23 -0.17 0.00 0.49 0.00 0.00 39.34 39.94 1ock n TYR 183 CO 0.00 0.00 0.00 0.45 0.91 0.00 0.00 176.86 178.22 1ock s SER 184 N -5.92 1.97 0.44 2.98 0.15 -1.26 -2.82 113.70 109.24 1ock s SER 184 Ca -0.11 -0.41 0.30 0.00 0.70 0.00 0.00 55.95 56.44 1ock s SER 184 Cb 0.03 -0.14 1.38 0.00 -1.71 0.00 0.00 66.02 65.57 1ock s SER 184 CO 0.15 -0.33 1.91 4.11 1.20 0.00 0.00 173.24 180.29 1ock h TRP 185 N 8.41 0.00 0.00 3.44 0.09 -1.94 0.22 115.95 126.18 1ock h TRP 185 Ca -0.15 0.00 0.00 0.00 0.09 0.00 0.00 58.89 58.83 1ock h TRP 185 Cb 1.14 0.00 0.00 0.00 0.08 0.00 0.00 29.16 30.38 1ock h TRP 185 CO 0.22 0.00 -0.02 0.00 0.09 0.00 0.00 178.44 178.73 1ock n ALA 186 N -1.94 2.31 0.00 0.11 0.00 -1.26 -4.42 120.51 115.31 1ock n ALA 186 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.40 1ock n ALA 186 Cb 0.21 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.20 1ock n ALA 186 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1ock n LEU 187 N -2.15 2.40 -4.64 0.00 4.77 -0.59 -4.91 117.00 111.88 1ock n LEU 187 Ca 0.06 0.00 -0.61 0.00 -0.03 0.00 0.00 56.01 55.43 1ock n LEU 187 Cb 0.42 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.43 1ock n LEU 187 CO 0.30 0.40 0.97 0.47 -1.33 0.00 0.00 177.39 178.20 1ock n ASP 188 N -2.31 1.15 -3.76 -1.43 8.00 0.69 -4.58 116.55 114.31 1ock n ASP 188 Ca 0.00 1.15 -0.14 0.00 0.71 0.00 0.00 54.79 56.51 1ock n ASP 188 Cb 0.42 -1.00 -0.15 0.00 -0.02 0.00 0.00 41.12 40.37 1ock n ASP 188 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1ock s THR 189 N 1.78 -0.05 0.25 -3.53 2.01 -0.38 -4.75 115.64 110.97 1ock s THR 189 Ca 0.96 0.18 -0.30 0.00 0.31 0.00 0.00 61.69 62.84 1ock s THR 189 Cb -1.25 -0.17 -0.09 0.00 0.01 0.00 0.00 72.50 71.00 1ock s THR 189 CO 0.65 0.07 1.03 -0.69 -0.69 0.00 0.00 174.62 175.00 1ock s VAL 190 N 1.05 3.78 0.27 3.82 1.01 -1.26 -0.33 120.40 128.73 1ock s VAL 190 Ca -0.08 1.76 0.02 0.00 0.00 0.00 0.00 61.98 63.68 1ock s VAL 190 Cb -0.11 -4.12 -0.05 0.00 0.00 0.00 0.00 36.38 32.09 1ock s VAL 190 CO -0.04 0.40 0.07 -0.83 0.00 0.00 0.00 175.10 174.70 1ock s GLY 191 N -0.90 1.77 0.06 4.51 0.00 -0.11 -4.17 107.32 108.48 1ock s GLY 191 Ca 0.44 -1.89 0.08 0.00 0.00 0.00 0.00 44.72 43.35 1ock s GLY 191 CO 0.37 -1.65 -0.23 1.08 0.00 0.00 0.00 173.10 172.66 1ock s LEU 192 N -3.35 2.19 -0.06 0.66 1.02 -0.70 -1.06 118.68 117.38 1ock s LEU 192 Ca 0.36 -0.58 0.05 0.00 0.02 0.00 0.00 54.13 53.98 1ock s LEU 192 Cb 0.08 -1.07 -0.02 0.00 0.02 0.00 0.00 46.19 45.20 1ock s LEU 192 CO 0.13 0.18 -0.21 -0.36 0.02 0.00 0.00 176.35 176.11 1ock s PHE 193 N -0.86 2.52 0.32 0.29 0.40 0.13 -1.56 117.98 119.22 1ock s PHE 193 Ca 0.09 -0.53 -0.07 0.00 -0.60 0.00 0.00 56.93 55.82 1ock s PHE 193 Cb -0.09 -1.61 0.03 0.00 0.51 0.00 0.00 43.02 41.85 1ock s PHE 193 CO 0.02 -0.09 0.56 0.41 0.70 0.00 0.00 175.22 176.83 1ock n GLY 194 N 2.76 1.64 0.07 4.36 0.00 -0.63 -2.16 105.19 111.23 1ock n GLY 194 Ca -0.17 -1.39 -0.13 0.00 0.00 0.00 0.00 46.02 44.32 1ock n GLY 194 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ock h ALA 195 N 1.98 0.02 -2.60 4.61 0.00 -1.77 0.18 119.26 121.68 1ock h ALA 195 Ca -0.26 -0.33 -0.30 0.00 0.00 0.00 0.00 54.91 54.02 1ock h ALA 195 Cb 1.05 -0.00 -0.15 0.00 0.00 0.00 0.00 17.79 18.69 1ock h ALA 195 CO 0.34 -0.14 -0.59 1.03 0.00 0.00 0.00 179.25 179.89 1ock s ARG 196 N -3.68 1.34 0.19 0.00 0.52 -1.26 -3.51 118.95 112.54 1ock s ARG 196 Ca -0.16 -1.72 -0.12 0.00 -0.52 0.00 0.00 55.73 53.20 1ock s ARG 196 Cb 0.01 0.20 0.21 0.00 0.52 0.00 0.00 34.95 35.89 1ock s ARG 196 CO 0.69 -0.43 1.72 0.00 0.02 0.00 0.00 175.30 177.30 1ock h ALA 197 N 2.49 0.59 -0.90 2.13 0.00 -1.91 -1.63 119.26 120.03 1ock h ALA 197 Ca -0.34 0.11 0.16 0.00 0.00 0.00 0.00 54.91 54.83 1ock h ALA 197 Cb 1.25 0.14 -0.10 0.00 0.00 0.00 0.00 17.79 19.08 1ock h ALA 197 CO 0.51 -0.30 0.49 1.49 0.00 0.00 0.00 179.25 181.44 1ock h GLU 198 N 0.25 0.66 -0.68 0.00 4.81 -1.97 -0.82 114.58 116.82 1ock h GLU 198 Ca 0.26 -0.04 -0.03 0.00 -0.13 0.00 0.00 59.36 59.42 1ock h GLU 198 Cb 0.35 -0.15 -0.03 0.00 0.63 0.00 0.00 28.75 29.55 1ock h GLU 198 CO -0.33 0.43 0.31 -0.44 -0.73 0.00 0.00 179.01 178.25 1ock h ASP 199 N 0.67 0.90 -0.74 1.04 3.32 -1.71 -1.55 116.42 118.36 1ock h ASP 199 Ca 0.50 -0.14 -0.03 0.00 0.02 0.00 0.00 57.03 57.37 1ock h ASP 199 Cb 0.72 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 40.01 1ock h ASP 199 CO -0.37 0.79 0.33 -0.07 -1.72 0.00 0.00 179.24 178.20 1ock h LEU 200 N 0.95 0.98 -0.55 1.55 3.38 -0.97 -1.27 115.31 119.38 1ock h LEU 200 Ca 0.23 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 1ock h LEU 200 Cb 0.14 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.61 1ock h LEU 200 CO -0.03 0.86 0.29 0.00 0.09 0.00 0.00 178.44 179.66 1ock h ALA 201 N 1.16 0.70 -0.10 1.53 0.00 -0.84 -1.10 119.26 120.62 1ock h ALA 201 Ca 0.25 -0.10 -0.09 0.00 0.00 0.00 0.00 54.91 54.97 1ock h ALA 201 Cb 0.16 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1ock h ALA 201 CO -0.03 0.23 -0.34 0.00 0.00 0.00 0.00 179.25 179.12 1ock h ARG 202 N 0.74 0.20 -0.18 0.00 2.47 -1.06 -1.65 114.38 114.89 1ock h ARG 202 Ca 0.19 -0.08 -0.04 0.00 -1.26 0.00 0.00 59.98 58.80 1ock h ARG 202 Cb 0.07 -0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 28.37 1ock h ARG 202 CO -0.03 0.52 -0.03 0.78 0.56 0.00 0.00 179.97 181.77 1ock h GLY 203 N 1.11 0.37 1.80 0.04 0.00 -0.67 -2.43 103.07 103.29 1ock h GLY 203 Ca 0.02 -0.29 -0.09 0.00 0.00 0.00 0.00 47.33 46.97 1ock h GLY 203 CO 0.05 0.27 -0.32 1.41 0.00 0.00 0.00 176.54 177.95 1ock h LEU 204 N 0.06 0.23 -0.39 3.11 3.38 -1.07 -1.43 115.31 119.20 1ock h LEU 204 Ca 0.05 -0.08 -0.04 0.00 0.09 0.00 0.00 57.88 57.90 1ock h LEU 204 Cb 0.45 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 1ock h LEU 204 CO 0.02 0.55 0.09 0.25 0.09 0.00 0.00 178.44 179.44 1ock h LEU 205 N 0.20 0.60 -0.69 1.67 5.85 -1.24 0.82 115.31 122.52 1ock h LEU 205 Ca 0.03 -0.24 -0.08 0.00 0.84 0.00 0.00 57.88 58.43 1ock h LEU 205 Cb 0.67 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.52 1ock h LEU 205 CO 0.05 0.68 0.08 0.00 -0.34 0.00 0.00 178.44 178.91 1ock h ALA 206 N 0.94 0.91 -0.04 1.25 0.00 -1.15 0.38 119.26 121.56 1ock h ALA 206 Ca 0.12 -0.28 -0.13 0.00 0.00 0.00 0.00 54.91 54.63 1ock h ALA 206 Cb 0.32 -0.24 0.01 0.00 0.00 0.00 0.00 17.79 17.87 1ock h ALA 206 CO 0.00 0.66 -0.47 0.52 0.00 0.00 0.00 179.25 179.97 1ock h MET 207 N 1.01 0.38 0.00 0.00 2.86 -1.12 -3.39 114.93 114.68 1ock h MET 207 Ca 0.19 -0.36 -0.19 0.00 -2.06 0.00 0.00 59.70 57.28 1ock h MET 207 Cb 0.47 0.09 -0.04 0.00 0.06 0.00 0.00 31.60 32.19 1ock h MET 207 CO 0.02 1.02 -1.90 0.25 1.06 0.00 0.00 176.91 177.36 1ock n THR 208 N -4.31 0.94 -1.22 2.22 -2.24 0.27 -4.88 114.28 105.05 1ock n THR 208 Ca -0.09 -0.70 -0.08 0.00 -2.27 0.00 0.00 64.05 60.91 1ock n THR 208 Cb 0.59 -0.45 -0.03 0.00 -2.10 0.00 0.00 70.33 68.34 1ock n THR 208 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ock n GLY 209 N 1.48 0.90 3.71 3.38 0.00 0.13 -4.97 105.19 109.83 1ock n GLY 209 Ca -0.16 -0.27 -0.40 0.00 0.00 0.00 0.00 46.02 45.18 1ock n GLY 209 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ock s ARG 210 N -2.33 4.44 0.42 1.61 0.52 -1.26 -4.95 118.95 117.40 1ock s ARG 210 Ca 0.00 1.01 0.18 0.00 -0.52 0.00 0.00 55.73 56.40 1ock s ARG 210 Cb 0.00 -3.47 1.09 0.00 0.52 0.00 0.00 34.95 33.09 1ock s ARG 210 CO 0.00 -0.02 1.85 0.66 0.02 0.00 0.00 175.30 177.81 1ock h SER 211 N 6.86 0.40 -0.12 0.23 4.64 -1.95 -1.20 113.55 122.42 1ock h SER 211 Ca -0.39 0.04 0.03 0.00 -0.47 0.00 0.00 61.79 61.01 1ock h SER 211 Cb 1.19 -0.03 -0.00 0.00 -0.31 0.00 0.00 62.40 63.25 1ock h SER 211 CO 0.76 0.16 0.32 1.05 -0.87 0.00 0.00 176.83 178.25 1ock h GLU 212 N 0.40 0.00 -0.32 4.77 9.09 -2.02 0.30 114.58 126.80 1ock h GLU 212 Ca 0.48 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.89 1ock h GLU 212 Cb 1.20 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.30 1ock h GLU 212 CO -0.18 0.00 0.00 1.19 0.05 0.00 0.00 179.01 180.07 1ock n PHE 213 N -3.20 0.40 -3.96 2.06 3.01 -0.45 -4.73 117.46 110.59 1ock n PHE 213 Ca 0.01 -0.20 -0.35 0.00 1.01 0.00 0.00 57.45 57.92 1ock n PHE 213 Cb 0.41 0.00 -0.09 0.00 -0.01 0.00 0.00 39.48 39.78 1ock n PHE 213 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 1ock s SER 214 N -1.58 5.73 -0.10 4.37 0.15 0.10 -4.41 113.70 117.97 1ock s SER 214 Ca 0.37 0.11 0.00 0.00 0.70 0.00 0.00 55.95 57.13 1ock s SER 214 Cb 0.22 -1.99 0.00 0.00 -1.71 0.00 0.00 66.02 62.54 1ock s SER 214 CO 0.31 0.18 0.00 0.61 1.20 0.00 0.00 173.24 175.54 1ock n GLY 215 N 3.52 0.42 3.72 9.45 0.00 -1.26 -5.01 105.19 116.04 1ock n GLY 215 Ca -0.16 -0.99 -0.42 0.00 0.00 0.00 0.00 46.02 44.44 1ock n GLY 215 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ock s ILE 216 N -2.04 3.24 0.12 -0.61 1.01 -1.26 -5.02 121.20 116.63 1ock s ILE 216 Ca 0.00 0.93 0.06 0.00 0.00 0.00 0.00 60.65 61.65 1ock s ILE 216 Cb 0.00 -3.60 -0.04 0.00 0.01 0.00 0.00 42.46 38.84 1ock s ILE 216 CO 0.00 0.10 -0.15 0.54 0.00 0.00 0.00 174.94 175.43 1ock s VAL 217 N 0.75 1.37 0.35 2.92 0.11 -1.26 -5.08 120.40 119.56 1ock s VAL 217 Ca 0.62 -1.65 -0.25 0.00 -2.93 0.00 0.00 61.98 57.77 1ock s VAL 217 Cb -0.37 -1.49 -0.13 0.00 -1.53 0.00 0.00 36.38 32.86 1ock s VAL 217 CO 0.33 -0.34 0.72 -2.65 -3.33 0.00 0.00 175.10 169.83 1ock n PRO 218 N 0.68 0.79 -1.62 1.54 -0.02 -1.26 -4.72 135.00 130.39 1ock n PRO 218 Ca -0.17 0.28 -0.32 0.00 -2.02 0.00 0.00 63.50 61.27 1ock n PRO 218 Cb 0.56 -1.58 0.06 0.00 -0.02 0.00 0.00 33.50 32.52 1ock n PRO 218 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ock s ALA 219 N -1.27 2.44 -0.12 3.55 0.00 -0.13 -4.89 121.76 121.33 1ock s ALA 219 Ca 0.62 0.43 0.01 0.00 0.00 0.00 0.00 51.96 53.02 1ock s ALA 219 Cb -0.67 -3.29 -0.01 0.00 0.00 0.00 0.00 23.12 19.14 1ock s ALA 219 CO 0.58 -1.38 -0.16 0.15 0.00 0.00 0.00 175.76 174.94 1ock s LYS 220 N -4.38 3.28 -1.32 0.00 -0.14 -1.26 -4.70 119.74 111.22 1ock s LYS 220 Ca 0.65 -0.75 -0.20 0.00 -1.36 0.00 0.00 55.97 54.31 1ock s LYS 220 Cb -0.19 -2.53 0.02 0.00 -1.68 0.00 0.00 37.83 33.45 1ock s LYS 220 CO 0.46 0.20 0.47 0.00 -0.76 0.00 0.00 175.35 175.72 1ock n ALA 221 N 3.53 -2.38 -1.72 5.17 0.00 -1.26 -4.87 120.51 118.99 1ock n ALA 221 Ca -0.18 -0.48 -0.37 0.00 0.00 0.00 0.00 53.44 52.41 1ock n ALA 221 Cb 0.53 -2.14 0.07 0.00 0.00 0.00 0.00 19.45 17.91 1ock n ALA 221 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1ock s PRO 222 N -7.20 2.52 -0.47 0.00 0.02 -1.26 -4.64 135.00 123.98 1ock s PRO 222 Ca 0.30 2.06 -0.13 0.00 0.02 0.00 0.00 61.00 63.25 1ock s PRO 222 Cb -0.16 -1.84 0.09 0.00 0.02 0.00 0.00 34.50 32.61 1ock s PRO 222 CO 0.96 -1.62 0.37 1.03 -0.33 0.00 0.00 177.00 177.41 1ock s ARG 223 N -3.40 2.84 -0.11 5.54 0.52 -1.26 -1.36 118.95 121.73 1ock s ARG 223 Ca 0.83 -1.46 -0.05 0.00 -0.52 0.00 0.00 55.73 54.52 1ock s ARG 223 Cb -0.37 -4.05 -0.04 0.00 0.52 0.00 0.00 34.95 31.01 1ock s ARG 223 CO 0.40 -1.07 0.09 0.42 0.02 0.00 0.00 175.30 175.16 1ock s ILE 224 N 1.56 5.05 -0.22 1.52 1.01 0.30 -0.22 121.20 130.19 1ock s ILE 224 Ca 0.04 0.04 -0.01 0.00 0.00 0.00 0.00 60.65 60.72 1ock s ILE 224 Cb -0.25 -3.18 0.02 0.00 0.01 0.00 0.00 42.46 39.06 1ock s ILE 224 CO 0.04 0.60 -0.11 -0.83 0.00 0.00 0.00 174.94 174.65 1ock s GLY 225 N -0.89 1.54 -0.29 6.18 0.00 -0.03 -1.95 107.32 111.88 1ock s GLY 225 Ca 0.14 -1.34 -0.20 0.00 0.00 0.00 0.00 44.72 43.31 1ock s GLY 225 CO 0.03 0.42 0.64 0.14 0.00 0.00 0.00 173.10 174.33 1ock s VAL 226 N 1.32 4.94 -0.17 1.40 1.01 0.15 -0.22 120.40 128.83 1ock s VAL 226 Ca 0.02 0.95 0.01 0.00 0.00 0.00 0.00 61.98 62.96 1ock s VAL 226 Cb -0.15 -3.99 0.02 0.00 0.00 0.00 0.00 36.38 32.26 1ock s VAL 226 CO -0.07 -0.10 -0.17 0.68 0.00 0.00 0.00 175.10 175.44 1ock s VAL 227 N 2.60 1.81 -2.43 2.92 -7.23 -0.69 -1.88 120.40 115.51 1ock s VAL 227 Ca 0.26 -0.82 0.24 0.00 -1.81 0.00 0.00 61.98 59.85 1ock s VAL 227 Cb -0.15 -1.69 0.49 0.00 0.56 0.00 0.00 36.38 35.59 1ock s VAL 227 CO 0.11 0.47 1.62 0.54 -0.31 0.00 0.00 175.10 177.53 1ock n ARG 228 N 4.69 1.76 -3.74 4.82 1.74 -1.26 -4.29 116.66 120.38 1ock n ARG 228 Ca -0.19 -1.13 -0.32 0.00 -0.77 0.00 0.00 57.85 55.44 1ock n ARG 228 Cb 0.50 -1.44 0.03 0.00 -1.02 0.00 0.00 32.46 30.53 1ock n ARG 228 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 1ock n GLN 229 N 0.36 -1.05 -0.19 5.56 6.02 -1.26 -4.84 117.38 121.98 1ock n GLN 229 Ca 0.18 0.46 0.06 0.00 -0.01 0.00 0.00 57.00 57.69 1ock n GLN 229 Cb 0.37 -3.74 0.35 0.00 1.02 0.00 0.00 30.24 28.24 1ock n GLN 229 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 1ock h GLU 230 N -1.79 0.74 0.00 -1.09 3.07 -1.93 -0.02 114.58 113.56 1ock h GLU 230 Ca -0.64 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 58.18 1ock h GLU 230 Cb 1.35 -0.17 0.00 0.00 -0.84 0.00 0.00 28.75 29.10 1ock h GLU 230 CO 0.47 0.49 0.01 0.27 -1.40 0.00 0.00 179.01 178.86 1ock h PHE 231 N 0.77 0.00 -0.00 4.33 -0.00 -1.99 -1.36 116.94 118.69 1ock h PHE 231 Ca 0.32 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 58.29 1ock h PHE 231 Cb 0.26 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 36.21 1ock h PHE 231 CO -0.00 0.00 -0.20 0.00 -0.00 0.00 0.00 178.31 178.10 1ock n ALA 232 N -1.98 2.86 0.00 12.09 0.00 -0.02 -5.03 120.51 128.43 1ock n ALA 232 Ca -0.02 -0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.19 1ock n ALA 232 Cb 0.07 -1.32 0.00 0.00 0.00 0.00 0.00 19.45 18.20 1ock n ALA 232 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ock n GLY 233 N 1.46 -0.57 3.70 0.00 0.00 -0.51 -4.91 105.19 104.36 1ock n GLY 233 Ca 0.08 -2.24 -0.42 0.00 0.00 0.00 0.00 46.02 43.43 1ock n GLY 233 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ock s ALA 234 N -1.60 3.23 0.42 4.61 0.00 -1.26 -4.76 121.76 122.40 1ock s ALA 234 Ca 0.00 0.49 -0.04 0.00 0.00 0.00 0.00 51.96 52.40 1ock s ALA 234 Cb 0.00 -3.36 -0.04 0.00 0.00 0.00 0.00 23.12 19.72 1ock s ALA 234 CO 0.00 -0.34 0.70 0.54 0.00 0.00 0.00 175.76 176.66 1ock s VAL 235 N 1.30 4.96 0.30 0.00 0.11 -1.26 -5.07 120.40 120.73 1ock s VAL 235 Ca 0.51 0.06 -0.20 0.00 -2.93 0.00 0.00 61.98 59.42 1ock s VAL 235 Cb -0.20 -3.84 -0.09 0.00 -1.53 0.00 0.00 36.38 30.72 1ock s VAL 235 CO 0.25 -0.70 0.80 -1.61 -3.33 0.00 0.00 175.10 170.52 1ock s GLU 236 N -4.44 4.24 0.26 1.54 2.02 -0.31 -4.97 118.70 117.04 1ock s GLU 236 Ca 0.45 0.94 -0.06 0.00 0.02 0.00 0.00 54.97 56.32 1ock s GLU 236 Cb -0.10 -2.63 0.48 0.00 0.10 0.00 0.00 34.13 31.97 1ock s GLU 236 CO 0.40 0.24 1.62 -1.35 0.02 0.00 0.00 175.26 176.19 1ock h PRO 237 N 2.82 0.07 -1.01 0.39 0.11 -1.98 -1.56 132.00 130.84 1ock h PRO 237 Ca -0.48 -0.00 0.14 0.00 0.11 0.00 0.00 66.00 65.77 1ock h PRO 237 Cb 1.19 -0.02 -0.09 0.00 0.11 0.00 0.00 31.00 32.19 1ock h PRO 237 CO 0.65 0.05 0.63 0.00 -0.21 0.00 0.00 178.00 179.11 1ock h ALA 238 N 1.78 1.57 -0.52 -0.75 0.00 -1.93 0.73 119.26 120.13 1ock h ALA 238 Ca 0.44 0.04 -0.12 0.00 0.00 0.00 0.00 54.91 55.27 1ock h ALA 238 Cb 0.79 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 1ock h ALA 238 CO -0.74 0.14 -0.13 0.00 0.00 0.00 0.00 179.25 178.52 1ock h ALA 239 N 1.57 0.72 -0.19 0.00 0.00 -1.50 -1.96 119.26 117.90 1ock h ALA 239 Ca 0.52 -0.36 -0.11 0.00 0.00 0.00 0.00 54.91 54.97 1ock h ALA 239 Cb 0.62 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1ock h ALA 239 CO -0.30 0.65 -0.34 1.49 0.00 0.00 0.00 179.25 180.75 1ock h GLU 240 N 0.88 0.39 -0.57 0.00 4.57 -1.17 -1.18 114.58 117.51 1ock h GLU 240 Ca 0.13 -0.17 0.01 0.00 -1.18 0.00 0.00 59.36 58.15 1ock h GLU 240 Cb 0.70 -0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 29.25 1ock h GLU 240 CO 0.05 0.69 0.38 1.96 -1.18 0.00 0.00 179.01 180.90 1ock h GLN 241 N 0.33 0.74 -0.37 1.92 4.20 -0.55 -0.69 115.11 120.70 1ock h GLN 241 Ca 0.04 -0.04 -0.07 0.00 0.06 0.00 0.00 58.65 58.63 1ock h GLN 241 Cb 0.76 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 28.36 1ock h GLN 241 CO 0.06 0.49 -0.06 0.78 -0.67 0.00 0.00 178.83 179.43 1ock h GLY 242 N 0.77 0.75 0.99 3.46 0.00 -0.98 -2.07 103.07 105.99 1ock h GLY 242 Ca 0.21 -0.60 -0.00 0.00 0.00 0.00 0.00 47.33 46.94 1ock h GLY 242 CO -0.05 0.55 0.28 -2.00 0.00 0.00 0.00 176.54 175.33 1ock h LEU 243 N 0.50 0.57 -0.75 3.11 5.85 -0.93 0.02 115.31 123.69 1ock h LEU 243 Ca 0.10 -0.06 -0.04 0.00 0.84 0.00 0.00 57.88 58.72 1ock h LEU 243 Cb 0.56 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.41 1ock h LEU 243 CO 0.03 0.46 0.31 1.56 -0.34 0.00 0.00 178.44 180.46 1ock h GLN 244 N 0.63 1.11 -0.64 1.25 4.20 -1.11 -0.23 115.11 120.32 1ock h GLN 244 Ca 0.17 -0.20 -0.02 0.00 0.06 0.00 0.00 58.65 58.67 1ock h GLN 244 Cb -0.00 -0.18 -0.03 0.00 0.30 0.00 0.00 27.48 27.56 1ock h GLN 244 CO -0.03 0.91 0.34 0.00 -0.67 0.00 0.00 178.83 179.37 1ock h ALA 245 N 1.15 0.82 -0.46 3.87 0.00 -0.92 -0.03 119.26 123.68 1ock h ALA 245 Ca 0.25 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 1ock h ALA 245 Cb 0.20 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1ock h ALA 245 CO -0.02 0.35 0.16 0.00 0.00 0.00 0.00 179.25 179.74 1ock h ALA 246 N 1.16 0.61 -0.31 0.00 0.00 -0.58 -1.13 119.26 119.01 1ock h ALA 246 Ca 0.22 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1ock h ALA 246 Cb 0.06 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1ock h ALA 246 CO -0.03 0.24 0.18 0.82 0.00 0.00 0.00 179.25 180.45 1ock h ILE 247 N 0.61 1.12 -0.02 0.00 2.04 -0.69 -0.04 117.51 120.54 1ock h ILE 247 Ca 0.15 -0.32 0.01 0.00 1.00 0.00 0.00 64.86 65.70 1ock h ILE 247 Cb 0.24 0.77 -0.01 0.00 -0.74 0.00 0.00 36.82 37.08 1ock h ILE 247 CO -0.01 0.12 -0.04 0.50 0.00 0.00 0.00 178.15 178.73 1ock h LYS 248 N 0.39 -0.05 -0.81 2.37 3.64 -0.83 -0.54 116.57 120.74 1ock h LYS 248 Ca 0.11 0.00 0.02 0.00 -1.27 0.00 0.00 60.65 59.51 1ock h LYS 248 Cb 0.05 0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 31.83 1ock h LYS 248 CO -0.02 -0.03 0.52 0.00 -2.27 0.00 0.00 179.45 177.65 1ock h ALA 249 N 0.96 1.04 -0.15 5.00 0.00 -1.04 -1.05 119.26 124.02 1ock h ALA 249 Ca 0.02 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1ock h ALA 249 Cb 0.08 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1ock h ALA 249 CO -0.05 0.38 0.07 0.00 0.00 0.00 0.00 179.25 179.65 1ock h ALA 250 N 1.32 0.19 -0.46 0.00 0.00 -0.66 -1.18 119.26 118.47 1ock h ALA 250 Ca 0.31 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 55.17 1ock h ALA 250 Cb -0.05 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 1ock h ALA 250 CO -0.09 -0.26 0.29 0.93 0.00 0.00 0.00 179.25 180.11 1ock h GLU 251 N 0.12 0.57 0.00 0.00 5.08 -0.81 -0.58 114.58 118.96 1ock h GLU 251 Ca 0.05 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.36 1ock h GLU 251 Cb 0.10 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 29.22 1ock h GLU 251 CO -0.01 0.37 -0.10 0.00 -1.00 0.00 0.00 179.01 178.28 1ock h ARG 252 N 0.58 0.00 -0.00 2.33 2.47 -1.00 -1.16 114.38 117.60 1ock h ARG 252 Ca 0.18 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.90 1ock h ARG 252 Cb -0.02 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.30 1ock h ARG 252 CO -0.06 0.10 -0.09 0.00 0.56 0.00 0.00 179.97 180.47 1ock n ALA 253 N -2.39 2.67 0.00 0.04 0.00 -0.46 -4.91 120.51 115.46 1ock n ALA 253 Ca -0.02 -0.21 0.00 0.00 0.00 0.00 0.00 53.44 53.21 1ock n ALA 253 Cb 0.19 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.25 1ock n ALA 253 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ock n GLY 254 N 1.34 0.95 3.81 0.00 0.00 -0.44 -4.75 105.19 106.10 1ock n GLY 254 Ca 0.12 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.80 1ock n GLY 254 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ock s ALA 255 N -2.00 3.12 -0.43 4.61 0.00 -0.33 -4.45 121.76 122.27 1ock s ALA 255 Ca 0.00 0.38 -0.17 0.00 0.00 0.00 0.00 51.96 52.17 1ock s ALA 255 Cb 0.00 -3.11 0.03 0.00 0.00 0.00 0.00 23.12 20.04 1ock s ALA 255 CO 0.00 0.17 0.43 -1.54 0.00 0.00 0.00 175.76 174.82 1ock s SER 256 N -2.04 6.19 -0.09 0.00 1.04 -0.46 -4.30 113.70 114.04 1ock s SER 256 Ca 0.58 -0.76 -0.01 0.00 0.48 0.00 0.00 55.95 56.25 1ock s SER 256 Cb -0.12 -2.22 -0.03 0.00 0.10 0.00 0.00 66.02 63.75 1ock s SER 256 CO 0.16 -0.59 -0.04 -0.69 0.98 0.00 0.00 173.24 173.05 1ock s VAL 257 N 2.09 3.90 -0.16 5.02 1.01 -1.26 -0.54 120.40 130.46 1ock s VAL 257 Ca 0.11 -0.40 -0.13 0.00 0.00 0.00 0.00 61.98 61.57 1ock s VAL 257 Cb -0.18 -2.63 0.05 0.00 0.00 0.00 0.00 36.38 33.62 1ock s VAL 257 CO 0.13 0.58 0.42 0.00 0.00 0.00 0.00 175.10 176.23 1ock s GLN 258 N -0.61 0.46 -0.08 2.72 -2.07 -0.82 -5.00 119.66 114.25 1ock s GLN 258 Ca 0.09 0.67 -0.30 0.00 -1.82 0.00 0.00 55.36 54.01 1ock s GLN 258 Cb -0.12 0.14 -0.02 0.00 -1.09 0.00 0.00 33.01 31.93 1ock s GLN 258 CO 0.02 -0.10 1.05 0.00 -1.32 0.00 0.00 175.29 174.94 1ock s ALA 259 N 0.67 3.40 0.19 2.60 0.00 -1.26 -0.68 121.76 126.68 1ock s ALA 259 Ca -0.04 0.45 0.08 0.00 0.00 0.00 0.00 51.96 52.45 1ock s ALA 259 Cb -0.05 -3.44 -0.05 0.00 0.00 0.00 0.00 23.12 19.58 1ock s ALA 259 CO -0.05 -0.59 -0.15 0.96 0.00 0.00 0.00 175.76 175.93 1ock s ILE 260 N 1.92 1.72 0.03 0.00 -4.36 -0.79 -4.87 121.20 114.86 1ock s ILE 260 Ca 0.50 -2.15 0.01 0.00 -0.26 0.00 0.00 60.65 58.76 1ock s ILE 260 Cb -0.20 -1.99 -0.04 0.00 1.25 0.00 0.00 42.46 41.48 1ock s ILE 260 CO 0.20 -0.55 0.11 -1.81 0.24 0.00 0.00 174.94 173.13 1ock s ASP 261 N -3.18 5.81 0.13 4.36 1.01 -1.26 -4.47 116.67 119.06 1ock s ASP 261 Ca 0.21 0.13 -0.08 0.00 0.71 0.00 0.00 52.55 53.52 1ock s ASP 261 Cb -0.02 -1.67 -0.06 0.00 1.01 0.00 0.00 42.92 42.18 1ock s ASP 261 CO 0.06 0.22 0.43 -0.76 0.21 0.00 0.00 175.17 175.33 1ock s LEU 262 N -2.11 4.29 0.53 1.23 1.43 -1.26 -5.05 118.68 117.75 1ock s LEU 262 Ca 0.28 0.77 -0.21 0.00 -1.03 0.00 0.00 54.13 53.93 1ock s LEU 262 Cb -0.12 -3.22 -0.06 0.00 0.03 0.00 0.00 46.19 42.82 1ock s LEU 262 CO 0.19 0.09 1.15 -2.65 0.23 0.00 0.00 176.35 175.37 1ock n PRO 263 N 0.47 1.37 -0.12 1.29 -0.02 -1.26 -4.79 135.00 131.94 1ock n PRO 263 Ca -0.05 0.51 0.11 0.00 -2.02 0.00 0.00 63.50 62.05 1ock n PRO 263 Cb 0.52 -2.32 0.46 0.00 -0.02 0.00 0.00 33.50 32.14 1ock n PRO 263 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1ock h GLU 264 N 1.17 0.49 -0.24 -0.52 4.57 -1.99 0.19 114.58 118.26 1ock h GLU 264 Ca -0.49 -0.03 0.01 0.00 -1.18 0.00 0.00 59.36 57.68 1ock h GLU 264 Cb 1.33 -0.11 -0.01 0.00 -0.16 0.00 0.00 28.75 29.80 1ock h GLU 264 CO 0.55 0.33 0.16 0.00 -1.18 0.00 0.00 179.01 178.86 1ock h ALA 265 N 1.67 1.89 -0.05 2.92 0.00 -1.93 -0.57 119.26 123.19 1ock h ALA 265 Ca 0.30 -0.01 -0.24 0.00 0.00 0.00 0.00 54.91 54.95 1ock h ALA 265 Cb 0.50 -0.08 0.02 0.00 0.00 0.00 0.00 17.79 18.23 1ock h ALA 265 CO -0.09 0.09 -0.93 0.28 0.00 0.00 0.00 179.25 178.60 1ock h VAL 266 N 0.27 1.29 -0.96 0.00 2.07 -0.89 -2.59 116.25 115.44 1ock h VAL 266 Ca 0.09 -2.14 0.02 0.00 0.82 0.00 0.00 66.70 65.50 1ock h VAL 266 Cb 0.04 2.27 -0.05 0.00 -1.52 0.00 0.00 31.29 32.02 1ock h VAL 266 CO -0.02 0.66 0.63 0.45 0.02 0.00 0.00 177.57 179.32 1ock h HIS 267 N 0.40 1.19 -0.75 1.57 -0.00 -0.77 -1.88 115.15 114.91 1ock h HIS 267 Ca -0.10 0.03 -0.03 0.00 -0.00 0.00 0.00 60.37 60.27 1ock h HIS 267 Cb 1.58 -0.40 -0.03 0.00 -0.00 0.00 0.00 27.41 28.55 1ock h HIS 267 CO 0.10 0.72 0.34 0.93 -0.00 0.00 0.00 177.93 180.02 1ock h GLU 268 N 1.26 1.08 -0.56 2.45 4.39 -1.10 -2.41 114.58 119.69 1ock h GLU 268 Ca 0.37 -0.16 -0.04 0.00 0.34 0.00 0.00 59.36 59.87 1ock h GLU 268 Cb -0.07 -0.19 -0.03 0.00 -0.10 0.00 0.00 28.75 28.36 1ock h GLU 268 CO -0.10 0.85 0.19 0.00 -1.16 0.00 0.00 179.01 178.78 1ock h ALA 269 N 1.30 1.27 -0.55 3.43 0.00 -0.94 -2.08 119.26 121.69 1ock h ALA 269 Ca 0.26 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 1ock h ALA 269 Cb 0.14 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 1ock h ALA 269 CO -0.03 0.52 0.26 2.35 0.00 0.00 0.00 179.25 182.36 1ock h TRP 270 N 0.82 0.80 -0.88 0.00 7.01 -0.98 -2.63 115.95 120.08 1ock h TRP 270 Ca 0.19 -0.04 -0.00 0.00 2.11 0.00 0.00 58.89 61.14 1ock h TRP 270 Cb 0.22 -0.25 -0.04 0.00 -2.10 0.00 0.00 29.16 26.99 1ock h TRP 270 CO 0.01 0.62 0.53 -0.09 -2.79 0.00 0.00 178.44 176.72 1ock h ARG 271 N 0.74 1.19 -0.24 2.65 2.43 -0.93 -3.00 114.38 117.22 1ock h ARG 271 Ca 0.19 -0.11 0.00 0.00 -0.81 0.00 0.00 59.98 59.25 1ock h ARG 271 Cb 0.13 -0.25 0.00 0.00 -0.42 0.00 0.00 29.97 29.42 1ock h ARG 271 CO -0.02 0.83 0.00 0.44 -1.51 0.00 0.00 179.97 179.71 1ock n ILE 272 N -4.36 0.30 -0.25 1.20 -6.64 -0.90 -4.27 119.36 104.43 1ock n ILE 272 Ca 0.10 -0.48 0.03 0.00 -1.77 0.00 0.00 62.75 60.63 1ock n ILE 272 Cb 0.06 0.59 0.16 0.00 -1.44 0.00 0.00 39.64 39.02 1ock n ILE 272 CO 0.00 0.00 0.00 -0.74 -1.77 0.00 0.00 176.55 174.04 1ock h HIS 273 N 3.00 0.61 -0.46 4.28 2.76 -1.32 -1.13 115.15 122.90 1ock h HIS 273 Ca 0.00 0.03 0.02 0.00 -2.20 0.00 0.00 60.37 58.22 1ock h HIS 273 Cb 0.66 -0.16 -0.02 0.00 1.55 0.00 0.00 27.41 29.44 1ock h HIS 273 CO 0.15 0.17 0.30 -1.35 -1.30 0.00 0.00 177.93 175.90 1ock h PRO 274 N 0.55 0.54 -0.06 5.26 0.11 -1.81 -0.89 132.00 135.70 1ock h PRO 274 Ca 0.38 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 66.45 1ock h PRO 274 Cb 0.49 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 31.47 1ock h PRO 274 CO -0.32 0.36 0.01 0.82 -0.21 0.00 0.00 178.00 178.65 1ock h ILE 275 N 0.55 1.23 0.19 4.15 1.08 -1.50 -0.53 117.51 122.68 1ock h ILE 275 Ca 0.18 -0.70 -0.01 0.00 -0.39 0.00 0.00 64.86 63.94 1ock h ILE 275 Cb 0.03 1.58 0.00 0.00 -3.07 0.00 0.00 36.82 35.37 1ock h ILE 275 CO -0.04 0.19 -0.09 0.40 -0.69 0.00 0.00 178.15 177.92 1ock h ILE 276 N -0.16 0.87 -0.03 -0.67 2.04 -1.18 -1.73 117.51 116.65 1ock h ILE 276 Ca 0.02 -0.25 0.02 0.00 1.00 0.00 0.00 64.86 65.65 1ock h ILE 276 Cb 0.30 1.02 -0.03 0.00 -0.74 0.00 0.00 36.82 37.37 1ock h ILE 276 CO 0.00 0.06 -0.11 -0.61 0.00 0.00 0.00 178.15 177.49 1ock h GLN 277 N -0.37 -0.16 -0.10 2.37 4.15 -1.17 -2.05 115.11 117.78 1ock h GLN 277 Ca -0.03 0.01 -0.16 0.00 0.77 0.00 0.00 58.65 59.25 1ock h GLN 277 Cb 0.29 0.04 -0.01 0.00 0.21 0.00 0.00 27.48 28.00 1ock h GLN 277 CO 0.04 -0.11 -0.62 -0.44 -1.93 0.00 0.00 178.83 175.78 1ock h ASP 278 N -0.17 0.39 -0.24 -0.69 3.32 -1.13 -0.34 116.42 117.58 1ock h ASP 278 Ca 0.05 -0.23 -0.05 0.00 0.02 0.00 0.00 57.03 56.82 1ock h ASP 278 Cb 0.23 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.66 1ock h ASP 278 CO -0.13 0.92 -0.05 0.15 -1.72 0.00 0.00 179.24 178.41 1ock h PHE 279 N 0.25 0.50 -0.23 4.55 3.57 -1.27 -2.75 116.94 121.57 1ock h PHE 279 Ca -0.01 -0.11 -0.10 0.00 3.53 0.00 0.00 57.97 61.29 1ock h PHE 279 Cb 1.15 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 39.75 1ock h PHE 279 CO 0.03 0.67 -0.27 0.93 -2.23 0.00 0.00 178.31 177.44 1ock h GLU 280 N 0.19 0.45 -0.96 1.11 5.08 -1.34 -2.77 114.58 116.35 1ock h GLU 280 Ca 0.06 -0.18 0.05 0.00 -1.00 0.00 0.00 59.36 58.30 1ock h GLU 280 Cb 0.50 -0.02 -0.06 0.00 0.50 0.00 0.00 28.75 29.67 1ock h GLU 280 CO 0.02 0.69 0.62 0.00 -1.00 0.00 0.00 179.01 179.34 1ock h ALA 281 N 1.31 1.43 -0.51 3.43 0.00 -0.89 0.39 119.26 124.42 1ock h ALA 281 Ca 0.06 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 1ock h ALA 281 Cb 0.69 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 1ock h ALA 281 CO 0.05 0.45 0.14 0.45 0.00 0.00 0.00 179.25 180.34 1ock h HIS 282 N 1.15 0.79 0.01 0.00 3.86 -1.20 0.70 115.15 120.45 1ock h HIS 282 Ca 0.40 -0.06 -0.16 0.00 -1.16 0.00 0.00 60.37 59.38 1ock h HIS 282 Cb 0.11 -0.24 0.01 0.00 1.06 0.00 0.00 27.41 28.36 1ock h HIS 282 CO -0.00 0.66 -0.63 0.00 0.86 0.00 0.00 177.93 178.81 1ock h ARG 283 N 0.75 0.42 0.00 2.45 -0.00 -1.13 -2.40 114.38 114.46 1ock h ARG 283 Ca 0.17 -0.46 -0.07 0.00 -0.50 0.00 0.00 59.98 59.13 1ock h ARG 283 Cb 0.25 0.13 -0.01 0.00 0.00 0.00 0.00 29.97 30.35 1ock h ARG 283 CO -0.01 1.12 -0.31 0.00 0.00 0.00 0.00 179.97 180.77 1ock h ALA 284 N 0.31 1.42 -0.19 0.04 0.00 -0.10 -2.91 119.26 117.83 1ock h ALA 284 Ca -0.08 -0.28 -0.10 0.00 0.00 0.00 0.00 54.91 54.45 1ock h ALA 284 Cb 1.35 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 19.03 1ock h ALA 284 CO 0.12 0.39 -0.24 1.28 0.00 0.00 0.00 179.25 180.80 1ock n LEU 285 N -4.08 3.48 -0.14 0.00 4.77 0.22 -4.79 117.00 116.46 1ock n LEU 285 Ca -0.02 -3.78 -0.06 0.00 -0.03 0.00 0.00 56.01 52.12 1ock n LEU 285 Cb 0.36 -0.58 0.03 0.00 -2.33 0.00 0.00 43.42 40.90 1ock n LEU 285 CO 0.37 1.28 1.02 0.00 -1.33 0.00 0.00 177.39 178.74 1ock h ALA 286 N 0.98 0.57 -0.12 -1.18 0.00 -1.21 -1.19 119.26 117.10 1ock h ALA 286 Ca 0.12 0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.04 1ock h ALA 286 Cb 1.36 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.04 1ock h ALA 286 CO 0.21 -0.08 0.05 2.35 0.00 0.00 0.00 179.25 181.79 1ock h TRP 287 N 0.50 0.10 -0.67 0.00 7.01 -1.86 0.07 115.95 121.10 1ock h TRP 287 Ca 0.19 0.01 -0.01 0.00 2.11 0.00 0.00 58.89 61.18 1ock h TRP 287 Cb 0.05 -0.03 -0.03 0.00 -2.10 0.00 0.00 29.16 27.05 1ock h TRP 287 CO -0.08 0.06 0.39 0.93 -2.79 0.00 0.00 178.44 176.94 1ock h GLU 288 N 0.12 0.91 -0.37 2.65 3.07 -1.88 0.12 114.58 119.21 1ock h GLU 288 Ca 0.05 -0.09 -0.14 0.00 -0.50 0.00 0.00 59.36 58.68 1ock h GLU 288 Cb 0.02 -0.19 -0.01 0.00 -0.84 0.00 0.00 28.75 27.73 1ock h GLU 288 CO -0.04 0.67 -0.32 0.35 -1.40 0.00 0.00 179.01 178.27 1ock h PHE 289 N 0.91 0.97 0.20 4.33 3.57 -1.02 0.22 116.94 126.11 1ock h PHE 289 Ca 0.24 -0.26 -0.31 0.00 3.53 0.00 0.00 57.97 61.17 1ock h PHE 289 Cb -0.00 -0.22 0.02 0.00 2.79 0.00 0.00 35.95 38.54 1ock h PHE 289 CO -0.01 1.04 -1.38 0.77 -2.23 0.00 0.00 178.31 176.49 1ock h SER 290 N 0.70 0.65 0.00 0.41 0.02 -0.81 -3.26 113.55 111.25 1ock h SER 290 Ca 0.07 -0.70 -0.06 0.00 -0.84 0.00 0.00 61.79 60.26 1ock h SER 290 Cb 0.87 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 63.19 1ock h SER 290 CO 0.08 1.55 -2.00 -0.62 -1.14 0.00 0.00 176.83 174.69 1ock n GLU 291 N -3.63 0.67 -2.64 3.45 -0.58 0.41 -4.64 120.64 113.68 1ock n GLU 291 Ca -0.13 -0.16 -0.01 0.00 -0.42 0.00 0.00 57.16 56.45 1ock n GLU 291 Cb 1.07 -1.49 0.05 0.00 -0.57 0.00 0.00 31.44 30.50 1ock n GLU 291 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 1ock n HIS 292 N -2.30 1.20 -0.14 -0.32 8.25 0.72 -4.97 115.22 117.65 1ock n HIS 292 Ca -0.09 -1.97 -0.11 0.00 -0.26 0.00 0.00 57.72 55.30 1ock n HIS 292 Cb 0.64 -0.23 -0.06 0.00 1.12 0.00 0.00 29.99 31.46 1ock n HIS 292 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 1ock h HIS 293 N 2.41 -1.39 0.00 4.41 6.17 -1.43 -0.81 115.15 124.51 1ock h HIS 293 Ca -0.12 0.08 0.00 0.00 0.71 0.00 0.00 60.37 61.03 1ock h HIS 293 Cb 1.35 0.67 0.00 0.00 2.52 0.00 0.00 27.41 31.94 1ock h HIS 293 CO 0.49 -0.45 0.00 -0.44 0.71 0.00 0.00 177.93 178.23 1ock h ASP 294 N -0.33 0.00 0.42 3.26 3.45 -1.90 -2.15 116.42 119.17 1ock h ASP 294 Ca 0.13 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.59 1ock h ASP 294 Cb 0.59 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.36 1ock h ASP 294 CO -0.60 0.00 -0.28 -0.62 -1.57 0.00 0.00 179.24 176.17 1ock n GLU 295 N -2.55 0.46 -2.62 3.56 1.02 -0.32 -4.86 120.64 115.33 1ock n GLU 295 Ca -0.00 -0.23 -0.41 0.00 -0.02 0.00 0.00 57.16 56.50 1ock n GLU 295 Cb 0.15 -1.50 -0.04 0.00 -0.02 0.00 0.00 31.44 30.03 1ock n GLU 295 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1ock s ILE 296 N -2.70 4.17 0.32 -3.67 1.01 -0.81 -4.66 121.20 114.86 1ock s ILE 296 Ca 0.20 1.83 -0.26 0.00 0.00 0.00 0.00 60.65 62.42 1ock s ILE 296 Cb 0.19 -4.17 -0.14 0.00 0.01 0.00 0.00 42.46 38.35 1ock s ILE 296 CO 0.57 0.29 0.73 0.00 0.00 0.00 0.00 174.94 176.54 1ock n ALA 297 N 2.61 -1.29 -0.39 9.38 0.00 -1.26 -4.55 120.51 125.02 1ock n ALA 297 Ca 0.03 0.32 -0.03 0.00 0.00 0.00 0.00 53.44 53.75 1ock n ALA 297 Cb 0.48 -1.84 0.01 0.00 0.00 0.00 0.00 19.45 18.09 1ock n ALA 297 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1ock n PRO 298 N 0.74 -0.28 -0.16 0.00 -0.02 -1.26 -0.85 135.00 133.16 1ock n PRO 298 Ca 0.12 1.52 -0.11 0.00 -2.02 0.00 0.00 63.50 63.01 1ock n PRO 298 Cb 0.33 -2.25 -0.00 0.00 -0.02 0.00 0.00 33.50 31.55 1ock n PRO 298 CO 0.00 0.00 0.00 0.52 1.98 0.00 0.00 175.50 178.00 1ock h MET 299 N 0.00 1.01 -0.26 -0.52 2.86 -1.96 -1.38 114.93 114.68 1ock h MET 299 Ca 0.30 -0.43 -0.19 0.00 -2.06 0.00 0.00 59.70 57.32 1ock h MET 299 Cb 0.55 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.18 1ock h MET 299 CO -0.97 1.11 -0.58 1.25 1.06 0.00 0.00 176.91 178.77 1ock h LEU 300 N 0.87 0.97 -0.93 1.22 5.85 -1.86 -1.90 115.31 119.53 1ock h LEU 300 Ca 0.11 -0.55 0.05 0.00 0.84 0.00 0.00 57.88 58.33 1ock h LEU 300 Cb 0.80 -0.28 -0.06 0.00 0.37 0.00 0.00 40.66 41.49 1ock h LEU 300 CO 0.07 1.34 0.60 -0.09 -0.34 0.00 0.00 178.44 180.01 1ock h ARG 301 N 0.64 1.09 -0.45 1.25 2.43 -0.92 0.19 114.38 118.62 1ock h ARG 301 Ca 0.00 -0.07 -0.14 0.00 -0.81 0.00 0.00 59.98 58.97 1ock h ARG 301 Cb 1.20 -0.25 -0.01 0.00 -0.42 0.00 0.00 29.97 30.49 1ock h ARG 301 CO 0.13 0.72 -0.26 0.00 -1.51 0.00 0.00 179.97 179.05 1ock h ALA 302 N 1.40 0.68 -0.34 2.80 0.00 -1.10 -0.35 119.26 122.35 1ock h ALA 302 Ca 0.38 -0.41 -0.14 0.00 0.00 0.00 0.00 54.91 54.74 1ock h ALA 302 Cb 0.07 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1ock h ALA 302 CO -0.14 0.67 -0.34 0.66 0.00 0.00 0.00 179.25 180.10 1ock h SER 303 N 0.82 0.81 -0.19 0.00 4.64 -0.75 -1.33 113.55 117.56 1ock h SER 303 Ca 0.10 -0.34 -0.04 0.00 -0.47 0.00 0.00 61.79 61.03 1ock h SER 303 Cb 0.84 -0.23 -0.01 0.00 -0.31 0.00 0.00 62.40 62.70 1ock h SER 303 CO 0.07 1.08 -0.03 -0.07 -0.87 0.00 0.00 176.83 177.01 1ock h LEU 304 N 0.65 0.35 -1.15 5.97 3.38 -0.89 -2.53 115.31 121.09 1ock h LEU 304 Ca 0.07 -0.35 0.07 0.00 0.09 0.00 0.00 57.88 57.76 1ock h LEU 304 Cb 0.88 -0.10 -0.06 0.00 0.09 0.00 0.00 40.66 41.48 1ock h LEU 304 CO 0.08 0.62 0.59 0.44 0.09 0.00 0.00 178.44 180.26 1ock h ASP 305 N 0.07 0.88 1.29 -0.43 3.45 -0.91 -1.66 116.42 119.11 1ock h ASP 305 Ca 0.05 0.01 0.00 0.00 0.43 0.00 0.00 57.03 57.52 1ock h ASP 305 Cb 0.46 -0.18 0.00 0.00 -0.56 0.00 0.00 39.33 39.05 1ock h ASP 305 CO 0.02 0.56 0.00 0.00 -1.57 0.00 0.00 179.24 178.24 1ock h ALA 306 N 1.52 1.00 -0.18 3.45 0.00 -1.07 -3.28 119.26 120.69 1ock h ALA 306 Ca 0.40 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.31 1ock h ALA 306 Cb 0.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1ock h ALA 306 CO -0.16 0.00 0.00 0.25 0.00 0.00 0.00 179.25 179.34 1ock n THR 307 N -2.57 1.54 0.28 0.00 -2.24 -0.66 -4.67 114.28 105.98 1ock n THR 307 Ca 0.03 -1.49 0.12 0.00 -2.27 0.00 0.00 64.05 60.45 1ock n THR 307 Cb 0.37 0.14 0.81 0.00 -2.10 0.00 0.00 70.33 69.55 1ock n THR 307 CO 0.00 0.00 0.00 -0.37 -0.57 0.00 0.00 175.07 174.13 1ock h VAL 308 N 1.16 0.69 -0.00 2.28 -1.51 -1.53 -2.63 116.25 114.71 1ock h VAL 308 Ca 0.00 -0.05 0.00 0.00 -1.23 0.00 0.00 66.70 65.42 1ock h VAL 308 Cb 0.94 1.03 0.00 0.00 -2.13 0.00 0.00 31.29 31.13 1ock h VAL 308 CO 0.07 0.01 -0.06 0.61 -1.23 0.00 0.00 177.57 176.97 1ock n GLY 309 N -1.35 -0.90 3.69 5.19 0.00 -1.26 -4.89 105.19 105.66 1ock n GLY 309 Ca -0.03 -0.26 -0.45 0.00 0.00 0.00 0.00 46.02 45.29 1ock n GLY 309 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ock n LEU 310 N -0.89 3.55 -4.91 0.99 4.77 -0.99 -4.96 117.00 114.56 1ock n LEU 310 Ca 0.17 1.05 -0.29 0.00 -0.03 0.00 0.00 56.01 56.90 1ock n LEU 310 Cb 0.25 -1.48 -0.04 0.00 -2.33 0.00 0.00 43.42 39.82 1ock n LEU 310 CO 0.22 -0.05 0.08 0.42 -1.33 0.00 0.00 177.39 176.72 1ock s THR 311 N 1.71 5.13 0.43 -5.08 -4.23 -1.26 -4.98 115.64 107.35 1ock s THR 311 Ca 0.80 -0.09 0.12 0.00 -1.18 0.00 0.00 61.69 61.33 1ock s THR 311 Cb -0.60 -3.69 0.30 0.00 1.34 0.00 0.00 72.50 69.85 1ock s THR 311 CO 0.38 -0.14 2.01 -0.65 -0.54 0.00 0.00 174.62 175.68 1ock h PRO 312 N 2.20 0.43 0.35 3.99 0.11 -1.98 -0.67 132.00 136.42 1ock h PRO 312 Ca -0.47 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 65.60 1ock h PRO 312 Cb 1.18 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1ock h PRO 312 CO 0.69 0.29 -0.17 -0.22 -0.21 0.00 0.00 178.00 178.38 1ock h LYS 313 N 0.44 -0.45 0.00 1.05 3.64 -1.99 0.26 116.57 119.53 1ock h LYS 313 Ca 0.22 0.03 -0.09 0.00 -1.27 0.00 0.00 60.65 59.54 1ock h LYS 313 Cb 0.31 0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.22 1ock h LYS 313 CO -0.06 -0.25 -0.44 1.05 -2.27 0.00 0.00 179.45 177.48 1ock h GLU 314 N -0.54 0.00 -0.13 1.90 4.11 -1.86 -1.76 114.58 116.29 1ock h GLU 314 Ca -0.05 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.36 1ock h GLU 314 Cb 0.41 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.65 1ock h GLU 314 CO 0.08 0.44 -0.02 -0.92 0.07 0.00 0.00 179.01 178.66 1ock h TYR 315 N 0.00 0.27 -0.98 2.06 3.20 -0.93 -0.29 116.97 120.30 1ock h TYR 315 Ca -0.00 -0.05 0.00 0.00 3.14 0.00 0.00 58.73 61.81 1ock h TYR 315 Cb 0.80 -0.07 -0.05 0.00 1.54 0.00 0.00 36.73 38.96 1ock h TYR 315 CO 0.00 0.51 0.62 -0.44 -1.64 0.00 0.00 178.16 177.21 1ock h ASP 316 N -0.04 1.15 -0.66 -2.11 3.32 -0.28 -1.08 116.42 116.73 1ock h ASP 316 Ca 0.04 -0.05 -0.07 0.00 0.02 0.00 0.00 57.03 56.96 1ock h ASP 316 Cb 0.41 -0.29 -0.03 0.00 0.22 0.00 0.00 39.33 39.65 1ock h ASP 316 CO 0.01 0.86 0.12 -0.08 -1.72 0.00 0.00 179.24 178.43 1ock h GLU 317 N 1.34 1.08 -0.71 3.56 4.57 -1.17 -1.85 114.58 121.40 1ock h GLU 317 Ca 0.35 -0.28 -0.01 0.00 -1.18 0.00 0.00 59.36 58.24 1ock h GLU 317 Cb -0.10 -0.13 -0.03 0.00 -0.16 0.00 0.00 28.75 28.32 1ock h GLU 317 CO -0.07 0.99 0.41 0.00 -1.18 0.00 0.00 179.01 179.16 1ock h ALA 318 N 1.05 0.90 -0.63 2.92 0.00 -0.28 -1.02 119.26 122.20 1ock h ALA 318 Ca 0.20 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 1ock h ALA 318 Cb 0.42 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 1ock h ALA 318 CO 0.01 0.39 0.21 0.00 0.00 0.00 0.00 179.25 179.87 1ock h ARG 319 N 0.97 0.95 -0.80 0.00 3.08 -0.91 0.19 114.38 117.85 1ock h ARG 319 Ca 0.25 -0.17 -0.04 0.00 0.07 0.00 0.00 59.98 60.09 1ock h ARG 319 Cb -0.00 -0.15 -0.04 0.00 0.08 0.00 0.00 29.97 29.86 1ock h ARG 319 CO -0.04 0.80 0.36 0.00 -1.07 0.00 0.00 179.97 180.02 1ock h ARG 320 N 0.92 1.17 -0.63 0.04 3.08 -0.65 -1.56 114.38 116.75 1ock h ARG 320 Ca 0.21 -0.19 -0.07 0.00 0.07 0.00 0.00 59.98 60.00 1ock h ARG 320 Cb 0.24 -0.20 -0.03 0.00 0.08 0.00 0.00 29.97 30.06 1ock h ARG 320 CO -0.01 0.92 0.11 0.82 -1.07 0.00 0.00 179.97 180.73 1ock h ILE 321 N 1.14 1.25 -0.68 2.04 2.04 -0.43 -2.17 117.51 120.71 1ock h ILE 321 Ca 0.27 -0.98 -0.01 0.00 1.00 0.00 0.00 64.86 65.14 1ock h ILE 321 Cb 0.15 0.66 -0.03 0.00 -0.74 0.00 0.00 36.82 36.86 1ock h ILE 321 CO -0.03 0.37 0.40 1.23 0.00 0.00 0.00 178.15 180.11 1ock h GLY 322 N 1.04 1.00 1.02 5.37 0.00 -0.29 -1.70 103.07 109.50 1ock h GLY 322 Ca 0.19 -0.43 -0.04 0.00 0.00 0.00 0.00 47.33 47.06 1ock h GLY 322 CO 0.01 0.41 0.30 3.21 0.00 0.00 0.00 176.54 180.48 1ock h ARG 323 N 0.93 1.04 -0.78 4.80 3.08 -0.95 -1.03 114.38 121.47 1ock h ARG 323 Ca 0.24 -0.18 -0.05 0.00 0.07 0.00 0.00 59.98 60.07 1ock h ARG 323 Cb -0.00 -0.18 -0.03 0.00 0.08 0.00 0.00 29.97 29.84 1ock h ARG 323 CO -0.04 0.85 0.31 0.00 -1.07 0.00 0.00 179.97 180.01 1ock h ARG 324 N 1.00 1.16 -0.37 0.04 3.08 -1.13 -1.21 114.38 116.94 1ock h ARG 324 Ca 0.24 -0.21 0.00 0.00 0.07 0.00 0.00 59.98 60.08 1ock h ARG 324 Cb 0.18 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 30.02 1ock h ARG 324 CO -0.02 0.94 0.24 0.78 -1.07 0.00 0.00 179.97 180.83 1ock h GLY 325 N 1.15 0.53 0.98 0.04 0.00 -0.74 -1.56 103.07 103.48 1ock h GLY 325 Ca 0.26 -0.21 -0.01 0.00 0.00 0.00 0.00 47.33 47.37 1ock h GLY 325 CO -0.02 0.20 0.27 3.21 0.00 0.00 0.00 176.54 180.21 1ock h ARG 326 N 0.50 0.64 -0.48 4.80 3.08 -0.85 -1.04 114.38 121.03 1ock h ARG 326 Ca 0.14 -0.07 0.03 0.00 0.07 0.00 0.00 59.98 60.15 1ock h ARG 326 Cb -0.03 -0.13 -0.04 0.00 0.08 0.00 0.00 29.97 29.85 1ock h ARG 326 CO -0.03 0.49 0.26 -0.09 -1.07 0.00 0.00 179.97 179.54 1ock h ARG 327 N 0.62 0.51 0.00 0.04 2.43 -0.92 -2.72 114.38 114.34 1ock h ARG 327 Ca 0.17 -0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.27 1ock h ARG 327 Cb 0.02 -0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 29.45 1ock h ARG 327 CO -0.03 0.34 -0.15 0.93 -1.51 0.00 0.00 179.97 179.55 1ock h GLU 328 N 0.52 0.00 -0.46 0.20 5.08 -1.14 -3.26 114.58 115.52 1ock h GLU 328 Ca 0.20 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.47 1ock h GLU 328 Cb 0.07 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 1ock h GLU 328 CO -0.12 0.15 -0.10 1.25 -1.00 0.00 0.00 179.01 179.20 1ock h LEU 329 N 0.00 0.81 -1.63 1.33 5.85 -0.87 -3.00 115.31 117.80 1ock h LEU 329 Ca -0.00 -0.24 0.13 0.00 0.84 0.00 0.00 57.88 58.61 1ock h LEU 329 Cb 1.04 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 41.80 1ock h LEU 329 CO 0.02 0.93 0.47 1.23 -0.34 0.00 0.00 178.44 180.75 1ock h GLY 330 N 0.97 0.62 1.87 3.75 0.00 -1.58 -0.96 103.07 107.74 1ock h GLY 330 Ca 0.13 -0.16 -0.05 0.00 0.00 0.00 0.00 47.33 47.25 1ock h GLY 330 CO 0.04 0.07 -0.14 0.83 0.00 0.00 0.00 176.54 177.33 1ock h GLU 331 N 0.39 0.17 -0.48 4.80 5.08 -1.71 -2.72 114.58 120.10 1ock h GLU 331 Ca 0.33 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.65 1ock h GLU 331 Cb 0.77 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.97 1ock h GLU 331 CO -0.10 0.32 0.25 0.28 -1.00 0.00 0.00 179.01 178.76 1ock h VAL 332 N 0.16 1.15 0.00 3.13 2.07 -1.29 -2.35 116.25 119.12 1ock h VAL 332 Ca 0.03 -0.40 0.00 0.00 0.82 0.00 0.00 66.70 67.15 1ock h VAL 332 Cb 0.36 0.51 0.00 0.00 -1.52 0.00 0.00 31.29 30.64 1ock h VAL 332 CO 0.02 0.17 0.00 0.49 0.02 0.00 0.00 177.57 178.27 1ock n PHE 333 N -4.41 0.00 0.06 1.57 3.01 -1.02 -3.46 117.46 113.21 1ock n PHE 333 Ca 0.04 0.00 -0.15 0.00 1.01 0.00 0.00 57.45 58.35 1ock n PHE 333 Cb 0.10 -0.00 -0.06 0.00 -0.01 0.00 0.00 39.48 39.51 1ock n PHE 333 CO 0.00 0.00 0.00 0.93 1.01 0.00 0.00 176.76 178.70 1ock h GLU 334 N 0.01 0.46 0.00 -1.08 5.08 -1.57 -3.33 114.58 114.14 1ock h GLU 334 Ca 0.00 -0.50 0.00 0.00 -1.00 0.00 0.00 59.36 57.86 1ock h GLU 334 Cb 0.02 0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.41 1ock h GLU 334 CO 0.00 1.15 -1.67 0.41 -1.00 0.00 0.00 179.01 177.90 1ock n GLY 335 N 0.99 -1.11 3.21 -3.84 0.00 -1.22 -4.96 105.19 98.26 1ock n GLY 335 Ca -0.08 -0.46 -0.22 0.00 0.00 0.00 0.00 46.02 45.27 1ock n GLY 335 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1ock s VAL 336 N -3.43 1.40 0.03 1.61 -7.23 -1.25 -4.94 120.40 106.58 1ock s VAL 336 Ca -0.05 -1.28 -0.16 0.00 -1.81 0.00 0.00 61.98 58.68 1ock s VAL 336 Cb 0.13 -1.27 -0.29 0.00 0.56 0.00 0.00 36.38 35.51 1ock s VAL 336 CO 0.88 -0.04 1.07 0.44 -0.31 0.00 0.00 175.10 177.14 1ock h ASP 337 N 4.50 0.79 -5.19 4.85 3.32 -0.87 -3.41 116.42 120.42 1ock h ASP 337 Ca -0.42 -0.84 -0.11 0.00 0.02 0.00 0.00 57.03 55.68 1ock h ASP 337 Cb 1.18 -0.25 -0.15 0.00 0.22 0.00 0.00 39.33 40.33 1ock h ASP 337 CO 0.42 1.55 -0.57 0.68 -1.72 0.00 0.00 179.24 179.59 1ock s VAL 338 N -2.92 0.18 0.08 -1.35 -7.23 -1.06 -4.36 120.40 103.74 1ock s VAL 338 Ca -0.10 -1.52 0.03 0.00 -1.81 0.00 0.00 61.98 58.58 1ock s VAL 338 Cb 0.05 -1.36 -0.04 0.00 0.56 0.00 0.00 36.38 35.59 1ock s VAL 338 CO 0.91 -0.84 0.11 -0.76 -0.31 0.00 0.00 175.10 174.22 1ock s LEU 339 N -2.77 3.93 -0.08 1.32 1.43 0.10 -0.85 118.68 121.77 1ock s LEU 339 Ca 0.04 0.04 0.02 0.00 -1.03 0.00 0.00 54.13 53.20 1ock s LEU 339 Cb 0.05 -2.59 0.02 0.00 0.03 0.00 0.00 46.19 43.70 1ock s LEU 339 CO -0.09 0.16 -0.11 -0.22 0.23 0.00 0.00 176.35 176.31 1ock s LEU 340 N -2.48 1.57 0.00 1.79 2.96 0.69 -0.84 118.68 122.36 1ock s LEU 340 Ca 0.31 -0.30 -0.02 0.00 -0.22 0.00 0.00 54.13 53.90 1ock s LEU 340 Cb -0.12 -0.84 0.01 0.00 0.50 0.00 0.00 46.19 45.74 1ock s LEU 340 CO 0.23 0.00 0.21 1.07 -1.32 0.00 0.00 176.35 176.55 1ock n THR 341 N 4.03 0.00 -2.22 3.68 5.66 -0.55 -1.70 114.28 123.19 1ock n THR 341 Ca -0.21 -0.63 -0.34 0.00 -3.05 0.00 0.00 64.05 59.82 1ock n THR 341 Cb 0.51 0.42 0.00 0.00 -1.55 0.00 0.00 70.33 69.71 1ock n THR 341 CO 0.00 0.00 0.00 -0.31 -3.05 0.00 0.00 175.07 171.71 1ock s TYR 342 N -4.67 2.83 -0.27 1.09 4.12 -1.26 0.35 117.35 119.53 1ock s TYR 342 Ca 0.10 1.55 0.21 0.00 0.02 0.00 0.00 57.07 58.95 1ock s TYR 342 Cb -0.01 -3.14 -0.30 0.00 -1.52 0.00 0.00 41.96 37.00 1ock s TYR 342 CO 0.07 -1.27 0.56 0.43 0.02 0.00 0.00 175.55 175.37 1ock n SER 343 N -1.54 0.43 -3.79 2.29 7.64 -1.24 -4.31 113.62 113.11 1ock n SER 343 Ca 0.10 -0.26 -0.07 0.00 1.01 0.00 0.00 58.87 59.66 1ock n SER 343 Cb 0.52 1.70 -0.02 0.00 -1.01 0.00 0.00 64.21 65.40 1ock n SER 343 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ock s ALA 344 N -3.30 -1.37 0.40 -0.43 0.00 -1.26 -3.95 121.76 111.84 1ock s ALA 344 Ca -0.04 -0.11 0.10 0.00 0.00 0.00 0.00 51.96 51.92 1ock s ALA 344 Cb 0.14 0.79 0.82 0.00 0.00 0.00 0.00 23.12 24.87 1ock s ALA 344 CO 0.85 -1.01 1.93 -1.35 0.00 0.00 0.00 175.76 176.19 1ock h PRO 345 N 2.00 0.21 0.00 0.00 0.11 -1.96 -3.46 132.00 128.89 1ock h PRO 345 Ca -0.22 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.85 1ock h PRO 345 Cb 1.25 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1ock h PRO 345 CO 0.25 0.34 0.00 0.41 -0.21 0.00 0.00 178.00 178.79 1ock n GLY 346 N -0.91 -0.97 3.84 -0.55 0.00 -1.26 -1.16 105.19 104.19 1ock n GLY 346 Ca -0.01 -0.06 -0.32 0.00 0.00 0.00 0.00 46.02 45.63 1ock n GLY 346 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ock s THR 347 N -4.00 4.39 0.16 2.61 -4.23 -1.26 -4.86 115.64 108.46 1ock s THR 347 Ca 0.00 1.01 -0.34 0.00 -1.18 0.00 0.00 61.69 61.18 1ock s THR 347 Cb 0.00 -3.66 -0.15 0.00 1.34 0.00 0.00 72.50 70.03 1ock s THR 347 CO 0.00 -0.79 1.46 0.00 -0.54 0.00 0.00 174.62 174.75 1ock n ALA 348 N -2.12 0.65 -1.59 3.99 0.00 -1.26 -4.93 120.51 115.25 1ock n ALA 348 Ca 0.07 0.46 -0.35 0.00 0.00 0.00 0.00 53.44 53.62 1ock n ALA 348 Cb 0.54 -2.25 0.05 0.00 0.00 0.00 0.00 19.45 17.79 1ock n ALA 348 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1ock s PRO 349 N 0.43 2.73 0.40 0.00 0.02 -1.26 -4.69 135.00 132.63 1ock s PRO 349 Ca 0.77 1.70 -0.26 0.00 0.02 0.00 0.00 61.00 63.24 1ock s PRO 349 Cb -0.74 -1.91 -0.08 0.00 0.02 0.00 0.00 34.50 31.78 1ock s PRO 349 CO 0.43 -1.37 1.22 0.00 -0.33 0.00 0.00 177.00 176.95 1ock s ALA 350 N -1.87 3.19 0.41 -1.55 0.00 -1.26 -0.42 121.76 120.26 1ock s ALA 350 Ca 0.74 1.07 0.18 0.00 0.00 0.00 0.00 51.96 53.95 1ock s ALA 350 Cb -0.27 -3.42 1.09 0.00 0.00 0.00 0.00 23.12 20.51 1ock s ALA 350 CO 0.38 -0.64 1.84 0.87 0.00 0.00 0.00 175.76 178.20 1ock h LYS 351 N 2.66 0.40 -0.30 0.00 1.79 -1.40 -0.16 116.57 119.56 1ock h LYS 351 Ca -0.49 -0.02 0.09 0.00 -2.18 0.00 0.00 60.65 58.04 1ock h LYS 351 Cb 1.24 -0.09 -0.01 0.00 -1.58 0.00 0.00 32.23 31.79 1ock h LYS 351 CO 0.62 0.26 0.28 0.00 -1.08 0.00 0.00 179.45 179.54 1ock h ALA 352 N 1.61 2.05 0.00 3.86 0.00 -1.90 0.11 119.26 124.99 1ock h ALA 352 Ca 0.49 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.39 1ock h ALA 352 Cb 1.23 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1ock h ALA 352 CO -0.20 -0.44 0.00 1.28 0.00 0.00 0.00 179.25 179.90 1ock n LEU 353 N -3.97 0.38 -3.79 0.00 4.77 -0.07 -4.90 117.00 109.41 1ock n LEU 353 Ca 0.04 0.57 -0.24 0.00 -0.03 0.00 0.00 56.01 56.35 1ock n LEU 353 Cb 0.44 -0.49 0.02 0.00 -2.33 0.00 0.00 43.42 41.06 1ock n LEU 353 CO 0.30 -0.31 -0.04 0.00 -1.33 0.00 0.00 177.39 176.02 1ock n ALA 354 N -1.65 -1.81 -3.12 -1.18 0.00 0.40 -4.99 120.51 108.17 1ock n ALA 354 Ca 0.04 -0.08 -0.13 0.00 0.00 0.00 0.00 53.44 53.28 1ock n ALA 354 Cb 0.26 -2.60 -0.14 0.00 0.00 0.00 0.00 19.45 16.98 1ock n ALA 354 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1ock s SER 355 N -4.07 -0.08 0.00 0.00 0.15 -1.26 -4.83 113.70 103.61 1ock s SER 355 Ca 0.19 0.17 0.24 0.00 0.70 0.00 0.00 55.95 57.25 1ock s SER 355 Cb -0.09 0.15 0.96 0.00 -1.71 0.00 0.00 66.02 65.33 1ock s SER 355 CO 0.83 -0.05 1.68 0.35 1.20 0.00 0.00 173.24 177.24 1ock n THR 356 N 3.27 0.10 0.00 6.45 -2.24 -1.26 -4.75 114.28 115.85 1ock n THR 356 Ca -0.15 -0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.37 1ock n THR 356 Cb 0.58 0.31 0.00 0.00 -2.10 0.00 0.00 70.33 69.12 1ock n THR 356 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ock n GLY 357 N 1.11 2.25 3.70 3.38 0.00 -1.26 -3.68 105.19 110.68 1ock n GLY 357 Ca 0.17 -1.80 -0.40 0.00 0.00 0.00 0.00 46.02 43.99 1ock n GLY 357 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ock s ASP 358 N 0.00 6.96 -0.02 1.61 3.68 -1.26 -4.96 116.67 122.68 1ock s ASP 358 Ca 0.00 1.17 0.03 0.00 2.13 0.00 0.00 52.55 55.88 1ock s ASP 358 Cb 0.00 -2.43 0.13 0.00 -1.45 0.00 0.00 42.92 39.17 1ock s ASP 358 CO 0.00 -0.23 0.93 -2.65 0.13 0.00 0.00 175.17 173.35 1ock n PRO 359 N 4.38 1.48 0.08 4.34 -0.02 -1.26 -4.52 135.00 139.49 1ock n PRO 359 Ca 0.01 -0.52 0.18 0.00 -2.02 0.00 0.00 63.50 61.16 1ock n PRO 359 Cb 0.50 -1.34 0.72 0.00 -0.02 0.00 0.00 33.50 33.36 1ock n PRO 359 CO 0.00 0.00 0.00 0.07 1.98 0.00 0.00 175.50 177.55 1ock h ARG 360 N 0.75 0.00 -0.16 -0.52 0.11 -1.93 0.78 114.38 113.42 1ock h ARG 360 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1ock h ARG 360 Cb 0.44 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.52 1ock h ARG 360 CO 0.04 0.00 0.00 0.66 0.10 0.00 0.00 179.97 180.77 1ock n TYR 361 N -4.19 0.19 -0.05 4.08 4.02 -1.26 -4.35 117.16 115.60 1ock n TYR 361 Ca 0.06 -0.10 -0.09 0.00 -0.01 0.00 0.00 57.90 57.77 1ock n TYR 361 Cb 0.50 0.00 -0.05 0.00 -0.02 0.00 0.00 39.34 39.77 1ock n TYR 361 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 1ock n ASN 362 N 0.60 2.43 -0.33 7.72 3.02 0.15 -4.82 115.26 124.04 1ock n ASN 362 Ca 0.17 0.00 0.16 0.00 -0.03 0.00 0.00 54.58 54.89 1ock n ASN 362 Cb 0.41 -0.22 0.36 0.00 -0.61 0.00 0.00 39.78 39.73 1ock n ASN 362 CO 0.00 0.00 0.00 0.08 -2.62 0.00 0.00 177.26 174.72 1ock h ARG 363 N -0.13 0.48 -0.35 3.52 0.11 -1.04 -2.44 114.38 114.52 1ock h ARG 363 Ca -0.25 -0.03 0.06 0.00 0.10 0.00 0.00 59.98 59.86 1ock h ARG 363 Cb 1.33 -0.11 -0.06 0.00 1.11 0.00 0.00 29.97 32.24 1ock h ARG 363 CO -0.08 0.32 0.01 1.25 0.10 0.00 0.00 179.97 181.57 1ock h LEU 364 N 0.50 -0.13 -1.65 0.08 5.85 -1.86 -2.36 115.31 115.73 1ock h LEU 364 Ca 0.62 0.08 -0.04 0.00 0.84 0.00 0.00 57.88 59.38 1ock h LEU 364 Cb 1.19 0.14 -0.01 0.00 0.37 0.00 0.00 40.66 42.35 1ock h LEU 364 CO -0.50 -0.03 -0.20 -0.50 -0.34 0.00 0.00 178.44 176.87 1ock h TRP 365 N 0.10 0.00 -0.19 1.25 4.06 -1.78 -0.06 115.95 119.34 1ock h TRP 365 Ca 0.17 0.00 -0.15 0.00 2.06 0.00 0.00 58.89 60.97 1ock h TRP 365 Cb 0.23 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.38 1ock h TRP 365 CO -0.24 0.20 -0.51 1.15 -3.56 0.00 0.00 178.44 175.48 1ock h THR 366 N 0.00 1.32 -0.04 1.49 2.02 -1.41 0.10 112.91 116.39 1ock h THR 366 Ca -0.00 -1.74 -0.23 0.00 0.77 0.00 0.00 66.41 65.21 1ock h THR 366 Cb 0.39 1.73 0.01 0.00 -1.74 0.00 0.00 68.15 68.53 1ock h THR 366 CO 0.03 0.54 -0.90 0.25 0.37 0.00 0.00 175.52 175.81 1ock h LEU 367 N 0.41 0.68 -0.77 2.58 5.85 -1.04 -3.04 115.31 119.97 1ock h LEU 367 Ca 0.02 -0.51 -0.13 0.00 0.84 0.00 0.00 57.88 58.10 1ock h LEU 367 Cb 1.03 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.85 1ock h LEU 367 CO 0.09 1.29 -0.47 0.24 -0.34 0.00 0.00 178.44 179.25 1ock h MET 368 N 0.33 0.33 0.00 1.25 2.86 -0.93 -3.47 114.93 115.30 1ock h MET 368 Ca -0.08 -0.18 0.00 0.00 -2.06 0.00 0.00 59.70 57.38 1ock h MET 368 Cb 1.52 0.01 0.00 0.00 0.06 0.00 0.00 31.60 33.19 1ock h MET 368 CO 0.16 0.74 0.00 0.41 1.06 0.00 0.00 176.91 179.28 1ock n GLY 369 N 0.01 0.92 3.66 8.32 0.00 0.35 -4.96 105.19 113.49 1ock n GLY 369 Ca -0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.65 1ock n GLY 369 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1ock n ASN 370 N 0.00 0.98 -4.74 1.61 4.13 -1.21 -1.33 115.26 114.70 1ock n ASN 370 Ca 0.00 0.68 -0.41 0.00 1.68 0.00 0.00 54.58 56.53 1ock n ASN 370 Cb 0.00 -1.47 -0.03 0.00 -1.54 0.00 0.00 39.78 36.74 1ock n ASN 370 CO 0.00 0.00 0.00 -2.16 0.28 0.00 0.00 177.26 175.38 1ock s PRO 371 N -3.57 4.50 -0.03 3.52 0.04 -1.26 -4.61 135.00 133.60 1ock s PRO 371 Ca 0.75 1.87 0.05 0.00 0.04 0.00 0.00 61.00 63.71 1ock s PRO 371 Cb -0.34 -3.24 -0.01 0.00 0.04 0.00 0.00 34.50 30.96 1ock s PRO 371 CO 0.48 -0.06 -0.19 0.00 0.04 0.00 0.00 177.00 177.27 1ock s VAL 373 N -0.24 0.84 -0.07 0.00 1.01 -0.11 -0.48 120.40 121.35 1ock s VAL 373 Ca 0.02 -0.30 -0.20 0.00 0.00 0.00 0.00 61.98 61.49 1ock s VAL 373 Cb -0.10 -0.81 -0.04 0.00 0.00 0.00 0.00 36.38 35.43 1ock s VAL 373 CO 0.01 0.29 0.58 0.21 0.00 0.00 0.00 175.10 176.19 1ock s ASN 374 N 0.80 6.86 -0.26 3.32 3.84 -0.02 -0.70 114.94 128.79 1ock s ASN 374 Ca -0.13 1.03 0.01 0.00 0.21 0.00 0.00 52.86 53.99 1ock s ASN 374 Cb -0.15 -2.35 0.05 0.00 -0.55 0.00 0.00 41.25 38.25 1ock s ASN 374 CO 0.02 -0.00 -0.10 -0.69 -2.79 0.00 0.00 177.10 173.54 1ock s VAL 375 N 0.42 2.38 0.29 -5.21 1.01 -0.16 -3.57 120.40 115.56 1ock s VAL 375 Ca 0.31 -1.44 -0.30 0.00 0.00 0.00 0.00 61.98 60.55 1ock s VAL 375 Cb -0.17 -2.32 -0.12 0.00 0.00 0.00 0.00 36.38 33.77 1ock s VAL 375 CO 0.15 0.05 1.54 -2.65 0.00 0.00 0.00 175.10 174.19 1ock n PRO 376 N 4.51 2.52 -0.01 2.72 -0.02 -1.26 -1.80 135.00 141.66 1ock n PRO 376 Ca -0.15 0.90 -0.05 0.00 -2.02 0.00 0.00 63.50 62.17 1ock n PRO 376 Cb 0.44 -2.64 -0.02 0.00 -0.02 0.00 0.00 33.50 31.26 1ock n PRO 376 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1ock n VAL 377 N 1.96 0.87 -3.34 -1.45 0.31 -0.55 -4.90 118.33 111.23 1ock n VAL 377 Ca 0.09 0.12 -0.03 0.00 -0.01 0.00 0.00 64.34 64.50 1ock n VAL 377 Cb 0.35 -1.70 0.01 0.00 -0.91 0.00 0.00 33.84 31.59 1ock n VAL 377 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1ock n LEU 378 N -3.56 0.00 -4.11 7.52 -0.00 -1.02 -5.03 117.00 110.80 1ock n LEU 378 Ca -0.09 -0.95 -0.19 0.00 -0.00 0.00 0.00 56.01 54.77 1ock n LEU 378 Cb 0.37 1.44 -0.13 0.00 -0.00 0.00 0.00 43.42 45.10 1ock n LEU 378 CO 0.03 -0.32 -0.45 -0.54 -0.00 0.00 0.00 177.39 176.11 1ock s LYS 379 N -2.03 0.85 -0.14 1.47 1.02 -1.26 -0.67 119.74 118.98 1ock s LYS 379 Ca 0.06 -0.69 -0.00 0.00 0.02 0.00 0.00 55.97 55.37 1ock s LYS 379 Cb -0.02 -0.83 0.03 0.00 -0.52 0.00 0.00 37.83 36.49 1ock s LYS 379 CO 0.04 0.21 -0.08 0.08 -0.92 0.00 0.00 175.35 174.68 1ock s VAL 380 N -0.80 1.20 -1.58 3.17 1.01 -0.21 -4.67 120.40 118.52 1ock s VAL 380 Ca 0.01 -0.51 0.00 0.00 0.00 0.00 0.00 61.98 61.48 1ock s VAL 380 Cb -0.07 -1.25 0.00 0.00 0.00 0.00 0.00 36.38 35.06 1ock s VAL 380 CO 0.01 0.30 0.00 0.61 0.00 0.00 0.00 175.10 176.02 1ock n GLY 381 N 4.87 1.12 1.57 4.51 0.00 -1.26 -1.69 105.19 114.31 1ock n GLY 381 Ca -0.13 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.62 1ock n GLY 381 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ock n GLY 382 N -1.05 0.77 3.45 -0.02 0.00 -1.26 -5.05 105.19 102.02 1ock n GLY 382 Ca -0.16 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.51 1ock n GLY 382 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ock s LEU 383 N 0.00 3.18 0.63 0.99 2.01 -0.68 -4.75 118.68 120.05 1ock s LEU 383 Ca 0.00 -0.20 -0.18 0.00 0.01 0.00 0.00 54.13 53.76 1ock s LEU 383 Cb 0.00 -1.79 -0.04 0.00 0.01 0.00 0.00 46.19 44.37 1ock s LEU 383 CO 0.00 0.10 0.92 -2.65 1.01 0.00 0.00 176.35 175.72 1ock n PRO 384 N 4.01 0.77 -3.76 1.29 -0.02 -1.26 -1.04 135.00 134.98 1ock n PRO 384 Ca -0.17 0.31 -0.14 0.00 -2.02 0.00 0.00 63.50 61.47 1ock n PRO 384 Cb 0.52 -2.13 -0.15 0.00 -0.02 0.00 0.00 33.50 31.71 1ock n PRO 384 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1ock s ILE 385 N -1.59 -0.06 0.39 4.25 -1.09 0.16 -4.56 121.20 118.71 1ock s ILE 385 Ca 0.75 0.21 0.03 0.00 -2.23 0.00 0.00 60.65 59.41 1ock s ILE 385 Cb -0.40 -0.15 -0.03 0.00 -1.58 0.00 0.00 42.46 40.30 1ock s ILE 385 CO 0.48 0.08 0.10 -0.83 -1.23 0.00 0.00 174.94 173.54 1ock s GLY 386 N 1.13 2.48 0.19 6.18 0.00 -1.26 -1.48 107.32 114.55 1ock s GLY 386 Ca -0.09 -1.41 0.09 0.00 0.00 0.00 0.00 44.72 43.31 1ock s GLY 386 CO -0.04 -1.86 -0.18 -1.34 0.00 0.00 0.00 173.10 169.68 1ock s VAL 387 N -3.21 1.91 -0.22 1.40 -7.23 -0.75 -3.62 120.40 108.69 1ock s VAL 387 Ca 0.26 -2.04 -0.05 0.00 -1.81 0.00 0.00 61.98 58.34 1ock s VAL 387 Cb 0.04 -1.95 -0.02 0.00 0.56 0.00 0.00 36.38 35.01 1ock s VAL 387 CO 0.14 -0.37 0.00 -1.58 -0.31 0.00 0.00 175.10 172.98 1ock s GLN 388 N -3.03 3.55 -0.20 4.82 0.74 0.15 -0.99 119.66 124.71 1ock s GLN 388 Ca 0.19 -0.54 -0.11 0.00 0.05 0.00 0.00 55.36 54.94 1ock s GLN 388 Cb -0.05 -3.11 -0.05 0.00 1.10 0.00 0.00 33.01 30.90 1ock s GLN 388 CO 0.08 -0.10 0.19 0.08 -0.55 0.00 0.00 175.29 174.99 1ock s VAL 389 N 1.29 5.36 -0.08 1.34 1.01 0.12 -1.48 120.40 127.96 1ock s VAL 389 Ca 0.04 0.31 0.02 0.00 0.00 0.00 0.00 61.98 62.34 1ock s VAL 389 Cb -0.15 -3.53 0.02 0.00 0.00 0.00 0.00 36.38 32.72 1ock s VAL 389 CO 0.01 0.40 -0.11 -0.63 0.00 0.00 0.00 175.10 174.76 1ock s ILE 390 N 0.59 1.13 0.44 2.22 1.01 -0.02 -0.93 121.20 125.64 1ock s ILE 390 Ca 0.11 -0.44 0.07 0.00 0.00 0.00 0.00 60.65 60.38 1ock s ILE 390 Cb -0.12 -1.06 -0.02 0.00 0.01 0.00 0.00 42.46 41.27 1ock s ILE 390 CO 0.01 0.36 0.29 0.00 0.00 0.00 0.00 174.94 175.61 1ock s ALA 391 N 0.93 3.93 0.72 9.38 0.00 -1.09 0.03 121.76 135.65 1ock s ALA 391 Ca -0.10 -1.83 -0.15 0.00 0.00 0.00 0.00 51.96 49.88 1ock s ALA 391 Cb -0.15 -0.66 0.03 0.00 0.00 0.00 0.00 23.12 22.34 1ock s ALA 391 CO 0.01 -0.24 1.22 0.50 0.00 0.00 0.00 175.76 177.25 1ock s ARG 392 N -4.06 2.18 0.16 0.00 3.52 -1.26 -3.99 118.95 115.50 1ock s ARG 392 Ca 0.41 1.82 -0.34 0.00 -0.13 0.00 0.00 55.73 57.50 1ock s ARG 392 Cb 0.00 -1.83 -0.14 0.00 -1.56 0.00 0.00 34.95 31.42 1ock s ARG 392 CO 0.24 -1.82 1.55 0.34 -0.81 0.00 0.00 175.30 174.80 1ock n PHE 393 N -2.59 2.24 -0.03 5.12 7.35 -1.26 -1.33 117.46 126.95 1ock n PHE 393 Ca 0.14 0.30 0.00 0.00 -0.76 0.00 0.00 57.45 57.13 1ock n PHE 393 Cb 0.50 -2.53 0.00 0.00 0.35 0.00 0.00 39.48 37.80 1ock n PHE 393 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1ock n GLY 394 N 3.28 1.48 2.88 7.13 0.00 -1.26 -4.94 105.19 113.76 1ock n GLY 394 Ca 0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.80 1ock n GLY 394 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1ock n ASN 395 N 0.00 7.28 -0.34 1.61 3.02 -0.44 -4.71 115.26 121.67 1ock n ASN 395 Ca 0.00 -3.83 0.03 0.00 -0.03 0.00 0.00 54.58 50.75 1ock n ASN 395 Cb 0.00 -1.01 0.17 0.00 -0.61 0.00 0.00 39.78 38.33 1ock n ASN 395 CO 0.00 0.00 0.00 0.44 -2.62 0.00 0.00 177.26 175.08 1ock h ASP 396 N 2.96 0.93 -0.10 6.41 5.19 -1.92 -2.14 116.42 127.75 1ock h ASP 396 Ca 0.55 0.02 0.03 0.00 -0.62 0.00 0.00 57.03 57.01 1ock h ASP 396 Cb 0.10 -0.18 -0.04 0.00 0.18 0.00 0.00 39.33 39.40 1ock h ASP 396 CO 1.39 0.58 -0.12 0.00 -3.12 0.00 0.00 179.24 177.96 1ock h ALA 397 N 1.45 -0.06 -0.33 3.45 0.00 -1.84 -1.31 119.26 120.62 1ock h ALA 397 Ca 0.42 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.34 1ock h ALA 397 Cb 0.23 0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 1ock h ALA 397 CO -0.19 -0.59 0.06 1.25 0.00 0.00 0.00 179.25 179.79 1ock h HIS 398 N -0.16 0.48 -0.53 0.00 6.17 -1.81 0.12 115.15 119.42 1ock h HIS 398 Ca 0.08 -0.03 -0.01 0.00 0.71 0.00 0.00 60.37 61.11 1ock h HIS 398 Cb 0.27 -0.15 -0.02 0.00 2.52 0.00 0.00 27.41 30.03 1ock h HIS 398 CO -0.23 0.44 0.27 0.00 0.71 0.00 0.00 177.93 179.12 1ock h ALA 399 N 1.61 0.68 -0.38 5.26 0.00 -0.73 0.04 119.26 125.74 1ock h ALA 399 Ca 0.11 -0.11 -0.16 0.00 0.00 0.00 0.00 54.91 54.75 1ock h ALA 399 Cb 0.21 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1ock h ALA 399 CO -0.00 0.22 -0.37 -0.07 0.00 0.00 0.00 179.25 179.03 1ock h LEU 400 N 0.71 0.97 -0.43 0.00 3.38 -0.57 -0.70 115.31 118.66 1ock h LEU 400 Ca 0.18 -0.44 0.02 0.00 0.09 0.00 0.00 57.88 57.74 1ock h LEU 400 Cb 0.08 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.53 1ock h LEU 400 CO -0.03 1.23 0.24 0.00 0.09 0.00 0.00 178.44 179.97 1ock h ALA 401 N 0.82 0.55 -0.12 1.53 0.00 -0.46 -0.82 119.26 120.75 1ock h ALA 401 Ca 0.06 -0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.80 1ock h ALA 401 Cb 0.96 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 1ock h ALA 401 CO 0.09 -0.09 -0.65 1.15 0.00 0.00 0.00 179.25 179.75 1ock h THR 402 N 0.49 1.35 -0.68 0.00 2.02 -0.92 -0.20 112.91 114.98 1ock h THR 402 Ca 0.18 -1.98 -0.04 0.00 0.77 0.00 0.00 66.41 65.34 1ock h THR 402 Cb 0.04 1.97 -0.03 0.00 -1.74 0.00 0.00 68.15 68.38 1ock h THR 402 CO -0.10 0.60 0.28 0.00 0.37 0.00 0.00 175.52 176.67 1ock h ALA 403 N 0.97 1.21 0.13 6.16 0.00 -0.76 -1.63 119.26 125.34 1ock h ALA 403 Ca -0.01 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 1ock h ALA 403 Cb 1.20 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.73 1ock h ALA 403 CO 0.11 0.58 -0.06 2.35 0.00 0.00 0.00 179.25 182.23 1ock h TRP 404 N 0.97 -0.16 -1.00 0.00 2.91 -1.03 -1.51 115.95 116.13 1ock h TRP 404 Ca 0.23 -0.00 0.21 0.00 1.13 0.00 0.00 58.89 60.45 1ock h TRP 404 Cb 0.18 0.05 -0.11 0.00 -0.51 0.00 0.00 29.16 28.77 1ock h TRP 404 CO 0.01 0.03 0.61 0.35 -1.03 0.00 0.00 178.44 178.42 1ock h PHE 405 N -0.33 1.02 -0.29 2.65 3.57 -1.07 -1.22 116.94 121.27 1ock h PHE 405 Ca -0.02 0.03 -0.19 0.00 3.53 0.00 0.00 57.97 61.33 1ock h PHE 405 Cb 0.27 -0.31 0.00 0.00 2.79 0.00 0.00 35.95 38.70 1ock h PHE 405 CO -0.02 0.19 -0.55 1.25 -2.23 0.00 0.00 178.31 176.95 1ock h LEU 406 N 0.70 0.98 -0.42 0.59 6.46 -0.90 -2.01 115.31 120.71 1ock h LEU 406 Ca 0.59 -0.52 0.00 0.00 -0.12 0.00 0.00 57.88 57.83 1ock h LEU 406 Cb 1.01 -0.28 -0.02 0.00 -0.73 0.00 0.00 40.66 40.63 1ock h LEU 406 CO -0.39 1.33 0.27 -0.33 -0.62 0.00 0.00 178.44 178.70 1ock h GLU 407 N 0.67 0.55 -0.05 1.25 5.08 -0.20 -1.37 114.58 120.51 1ock h GLU 407 Ca 0.01 -0.04 -0.10 0.00 -1.00 0.00 0.00 59.36 58.24 1ock h GLU 407 Cb 1.16 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 30.27 1ock h GLU 407 CO 0.12 0.37 -0.41 -0.44 -1.00 0.00 0.00 179.01 177.66 1ock h ASP 408 N 0.56 0.12 -0.44 1.42 3.32 -1.40 -2.23 116.42 117.77 1ock h ASP 408 Ca 0.15 -0.05 -0.08 0.00 0.02 0.00 0.00 57.03 57.08 1ock h ASP 408 Cb -0.05 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.45 1ock h ASP 408 CO -0.03 0.52 -0.03 0.00 -1.72 0.00 0.00 179.24 177.97 1ock h ALA 409 N 1.49 0.59 0.00 3.45 0.00 -0.87 -2.35 119.26 121.57 1ock h ALA 409 Ca 0.01 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 1ock h ALA 409 Cb 0.77 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.40 1ock h ALA 409 CO 0.06 0.41 -0.04 -0.07 0.00 0.00 0.00 179.25 179.61 1ock h LEU 410 N 0.63 0.00 -0.28 0.00 3.38 -1.05 -1.84 115.31 116.15 1ock h LEU 410 Ca 0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.09 1ock h LEU 410 Cb 0.54 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.29 1ock h LEU 410 CO 0.03 0.04 0.00 0.00 0.09 0.00 0.00 178.44 178.60 1ock n ALA 411 N -2.12 2.54 -0.49 1.53 0.00 -0.86 -5.11 120.51 116.00 1ock n ALA 411 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.26 1ock n ALA 411 Cb 0.31 -1.12 0.00 0.00 0.00 0.00 0.00 19.45 18.64 1ock n ALA 411 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13