#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h7f n SER 0 N 0.00 0.45 0.27 1.61 3.41 -1.26 -2.88 113.62 115.22 3h7f n SER 0 Ca 0.00 0.62 0.11 0.00 -0.26 0.00 0.00 58.87 59.34 3h7f n SER 0 Cb 0.00 -0.71 0.75 0.00 -0.26 0.00 0.00 64.21 63.99 3h7f n SER 0 CO 0.00 0.00 0.00 0.24 -0.16 0.00 0.00 175.04 175.12 3h7f h MET 1 N 0.00 0.00 -0.09 4.33 0.00 -2.07 -3.02 114.93 114.08 3h7f h MET 1 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59.70 59.70 3h7f h MET 1 Cb 0.31 0.00 0.00 0.00 0.00 0.00 0.00 31.60 31.91 3h7f h MET 1 CO 0.00 0.01 0.00 -1.13 0.00 0.00 0.00 176.91 175.79 3h7f n SER 2 N -4.22 1.95 -4.78 1.22 3.41 -1.14 -5.03 113.62 105.03 3h7f n SER 2 Ca -0.03 -1.62 -0.39 0.00 -0.26 0.00 0.00 58.87 56.57 3h7f n SER 2 Cb 0.10 -0.06 -0.06 0.00 -0.26 0.00 0.00 64.21 63.93 3h7f n SER 2 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3h7f s ALA 3 N -0.73 3.41 0.61 7.33 0.00 -1.14 -5.05 121.76 126.19 3h7f s ALA 3 Ca 0.09 0.39 -0.17 0.00 0.00 0.00 0.00 51.96 52.27 3h7f s ALA 3 Cb 0.05 -3.00 -0.03 0.00 0.00 0.00 0.00 23.12 20.14 3h7f s ALA 3 CO 0.07 0.27 1.14 -1.25 0.00 0.00 0.00 175.76 175.99 3h7f s PRO 4 N -1.32 3.01 0.33 0.00 0.04 -1.26 -4.79 135.00 131.00 3h7f s PRO 4 Ca 0.39 1.57 0.10 0.00 0.04 0.00 0.00 61.00 63.09 3h7f s PRO 4 Cb -0.22 -1.96 0.86 0.00 0.04 0.00 0.00 34.50 33.21 3h7f s PRO 4 CO 0.26 -1.12 1.77 1.25 0.04 0.00 0.00 177.00 179.21 3h7f h LEU 5 N 0.61 0.68 -2.12 -3.56 5.85 -1.96 -1.48 115.31 113.32 3h7f h LEU 5 Ca -0.49 0.10 -0.00 0.00 0.84 0.00 0.00 57.88 58.33 3h7f h LEU 5 Cb 1.26 -0.02 -0.00 0.00 0.37 0.00 0.00 40.66 42.28 3h7f h LEU 5 CO 0.55 0.20 -0.00 0.00 -0.34 0.00 0.00 178.44 178.84 3h7f h ALA 6 N 1.66 1.86 0.06 1.25 0.00 -1.92 -0.73 119.26 121.44 3h7f h ALA 6 Ca 0.59 -0.00 -0.26 0.00 0.00 0.00 0.00 54.91 55.24 3h7f h ALA 6 Cb 1.10 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.87 3h7f h ALA 6 CO -0.37 0.01 -1.37 0.93 0.00 0.00 0.00 179.25 178.44 3h7f h GLU 7 N 0.00 0.12 -0.55 0.00 5.08 -1.68 -3.35 114.58 114.20 3h7f h GLU 7 Ca -0.00 -0.20 -0.11 0.00 -1.00 0.00 0.00 59.36 58.05 3h7f h GLU 7 Cb 0.01 0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 3h7f h GLU 7 CO 0.00 1.10 -0.09 0.28 -1.00 0.00 0.00 179.01 179.30 3h7f h VAL 8 N -0.61 1.27 -1.63 3.13 2.07 -1.15 -3.40 116.25 115.94 3h7f h VAL 8 Ca -0.33 -1.25 -0.42 0.00 0.82 0.00 0.00 66.70 65.52 3h7f h VAL 8 Cb 1.55 0.93 -0.29 0.00 -1.52 0.00 0.00 31.29 31.96 3h7f h VAL 8 CO -0.07 0.44 -0.82 -0.67 0.02 0.00 0.00 177.57 176.48 3h7f n ASP 9 N -4.15 -1.43 -0.05 0.57 -0.08 -0.29 -5.03 116.55 106.09 3h7f n ASP 9 Ca 0.02 -2.70 0.05 0.00 -1.51 0.00 0.00 54.79 50.64 3h7f n ASP 9 Cb 0.39 0.33 0.40 0.00 2.34 0.00 0.00 41.12 44.59 3h7f n ASP 9 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 3h7f h PRO 10 N 4.91 0.60 -0.32 -0.67 0.11 -1.71 -2.01 132.00 132.91 3h7f h PRO 10 Ca 0.12 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.19 3h7f h PRO 10 Cb 0.97 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 31.93 3h7f h PRO 10 CO 0.29 0.40 0.21 -0.44 -0.21 0.00 0.00 178.00 178.25 3h7f h ASP 11 N 0.62 0.37 -0.54 -2.05 3.32 -1.92 -1.62 116.42 114.60 3h7f h ASP 11 Ca 0.19 -0.02 -0.10 0.00 0.02 0.00 0.00 57.03 57.13 3h7f h ASP 11 Cb 0.02 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 39.45 3h7f h ASP 11 CO -0.05 0.28 -0.05 0.40 -1.72 0.00 0.00 179.24 178.10 3h7f h ILE 12 N 0.44 1.27 -0.80 0.35 1.08 -1.83 -2.59 117.51 115.42 3h7f h ILE 12 Ca 0.12 -1.18 0.03 0.00 -0.39 0.00 0.00 64.86 63.44 3h7f h ILE 12 Cb -0.04 0.94 -0.05 0.00 -3.07 0.00 0.00 36.82 34.60 3h7f h ILE 12 CO -0.03 0.42 0.51 0.00 -0.69 0.00 0.00 178.15 178.36 3h7f h ALA 13 N 0.94 1.06 -0.72 1.87 0.00 -1.25 -1.48 119.26 119.68 3h7f h ALA 13 Ca 0.15 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 3h7f h ALA 13 Cb 0.60 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 3h7f h ALA 13 CO 0.04 0.32 0.39 1.49 0.00 0.00 0.00 179.25 181.49 3h7f h GLU 14 N 0.99 1.00 -0.24 0.00 4.81 -1.20 -2.39 114.58 117.54 3h7f h GLU 14 Ca 0.32 -0.12 -0.11 0.00 -0.13 0.00 0.00 59.36 59.32 3h7f h GLU 14 Cb 0.03 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.20 3h7f h GLU 14 CO -0.12 0.75 -0.32 -0.07 -0.73 0.00 0.00 179.01 178.52 3h7f h LEU 15 N 0.99 0.53 -0.70 1.64 3.38 -1.10 -1.46 115.31 118.59 3h7f h LEU 15 Ca 0.25 -0.20 0.01 0.00 0.09 0.00 0.00 57.88 58.03 3h7f h LEU 15 Cb 0.04 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.61 3h7f h LEU 15 CO -0.04 0.82 0.46 -0.07 0.09 0.00 0.00 178.44 179.70 3h7f h LEU 16 N 0.44 0.80 -0.55 1.67 4.07 -1.06 -0.50 115.31 120.19 3h7f h LEU 16 Ca 0.05 -0.02 -0.09 0.00 0.08 0.00 0.00 57.88 57.90 3h7f h LEU 16 Cb 0.78 -0.20 -0.02 0.00 1.08 0.00 0.00 40.66 42.30 3h7f h LEU 16 CO 0.06 0.58 -0.02 0.00 -1.08 0.00 0.00 178.44 177.99 3h7f h ALA 17 N 1.26 0.74 -0.69 1.53 0.00 -1.19 -2.12 119.26 118.78 3h7f h ALA 17 Ca 0.26 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 3h7f h ALA 17 Cb -0.11 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.45 3h7f h ALA 17 CO -0.06 0.58 0.35 0.87 0.00 0.00 0.00 179.25 180.99 3h7f h LYS 18 N 0.86 0.99 -0.60 0.00 1.57 -1.11 -2.04 116.57 116.24 3h7f h LYS 18 Ca 0.15 -0.14 -0.08 0.00 -1.87 0.00 0.00 60.65 58.72 3h7f h LYS 18 Cb 0.56 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.67 3h7f h LYS 18 CO 0.03 0.77 0.07 1.49 -0.57 0.00 0.00 179.45 181.25 3h7f h GLU 19 N 0.96 1.01 -0.42 3.15 4.57 -1.03 -1.74 114.58 121.07 3h7f h GLU 19 Ca 0.24 -0.28 0.04 0.00 -1.18 0.00 0.00 59.36 58.17 3h7f h GLU 19 Cb 0.10 -0.11 -0.04 0.00 -0.16 0.00 0.00 28.75 28.54 3h7f h GLU 19 CO -0.03 0.96 0.20 1.25 -1.18 0.00 0.00 179.01 180.21 3h7f h LEU 20 N 0.91 0.28 -1.11 1.64 5.85 -1.35 -1.85 115.31 119.68 3h7f h LEU 20 Ca 0.18 0.03 0.02 0.00 0.84 0.00 0.00 57.88 58.95 3h7f h LEU 20 Cb 0.46 -0.02 -0.05 0.00 0.37 0.00 0.00 40.66 41.42 3h7f h LEU 20 CO 0.02 0.20 0.60 1.23 -0.34 0.00 0.00 178.44 180.15 3h7f h GLY 21 N 0.40 1.30 0.98 3.75 0.00 -1.18 -1.74 103.07 106.57 3h7f h GLY 21 Ca 0.18 -0.47 -0.04 0.00 0.00 0.00 0.00 47.33 47.01 3h7f h GLY 21 CO -0.14 0.43 0.17 -0.09 0.00 0.00 0.00 176.54 176.91 3h7f h ARG 22 N 1.19 0.79 -0.69 4.80 2.43 -1.01 -1.18 114.38 120.72 3h7f h ARG 22 Ca 0.35 -0.16 -0.03 0.00 -0.81 0.00 0.00 59.98 59.33 3h7f h ARG 22 Cb -0.07 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 29.33 3h7f h ARG 22 CO -0.09 0.73 0.32 1.96 -1.51 0.00 0.00 179.97 181.38 3h7f h GLN 23 N 0.70 0.99 -0.54 0.20 4.20 -1.11 -2.69 115.11 116.86 3h7f h GLN 23 Ca 0.17 -0.15 -0.08 0.00 0.06 0.00 0.00 58.65 58.64 3h7f h GLN 23 Cb 0.25 -0.18 -0.02 0.00 0.30 0.00 0.00 27.48 27.84 3h7f h GLN 23 CO -0.01 0.79 0.00 0.00 -0.67 0.00 0.00 178.83 178.95 3h7f h ARG 24 N 0.96 0.92 0.00 1.46 3.08 -1.09 -3.33 114.38 116.37 3h7f h ARG 24 Ca 0.23 -0.27 0.00 0.00 0.07 0.00 0.00 59.98 60.02 3h7f h ARG 24 Cb 0.13 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.08 3h7f h ARG 24 CO -0.03 0.91 -0.79 -0.44 -1.07 0.00 0.00 179.97 178.55 3h7f h ASP 25 N 0.85 0.00 -2.28 7.04 3.32 -1.10 -3.46 116.42 120.79 3h7f h ASP 25 Ca 0.16 -0.03 -0.47 0.00 0.02 0.00 0.00 57.03 56.72 3h7f h ASP 25 Cb 0.50 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.04 3h7f h ASP 25 CO 0.02 0.01 -0.40 0.42 -1.72 0.00 0.00 179.24 177.58 3h7f s THR 26 N -3.31 5.24 -0.45 0.35 -4.23 -1.03 -4.88 115.64 107.33 3h7f s THR 26 Ca 0.02 -0.91 -0.16 0.00 -1.18 0.00 0.00 61.69 59.46 3h7f s THR 26 Cb 0.09 -3.85 0.05 0.00 1.34 0.00 0.00 72.50 70.13 3h7f s THR 26 CO 0.76 -0.35 0.41 -0.76 -0.54 0.00 0.00 174.62 174.14 3h7f s LEU 27 N -3.98 5.27 -0.34 4.79 1.43 -0.55 -4.95 118.68 120.35 3h7f s LEU 27 Ca 0.35 -1.05 -0.27 0.00 -1.03 0.00 0.00 54.13 52.13 3h7f s LEU 27 Cb -0.09 -2.25 0.01 0.00 0.03 0.00 0.00 46.19 43.90 3h7f s LEU 27 CO 0.30 -0.62 0.98 -0.70 0.23 0.00 0.00 176.35 176.54 3h7f s GLU 28 N 1.87 3.95 -0.08 1.70 2.56 -1.26 -1.53 118.70 125.91 3h7f s GLU 28 Ca 0.07 0.79 0.12 0.00 0.00 0.00 0.00 54.97 55.95 3h7f s GLU 28 Cb -0.21 -3.77 0.22 0.00 2.00 0.00 0.00 34.13 32.37 3h7f s GLU 28 CO 0.09 -0.91 1.11 -1.33 -0.56 0.00 0.00 175.26 173.66 3h7f n MET 29 N 6.77 0.70 -2.36 4.30 2.81 -0.03 -4.13 117.12 125.19 3h7f n MET 29 Ca 0.09 -2.03 -0.43 0.00 -1.81 0.00 0.00 57.70 53.53 3h7f n MET 29 Cb 0.48 -0.97 -0.02 0.00 -0.71 0.00 0.00 33.22 31.99 3h7f n MET 29 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 3h7f s ILE 30 N -1.54 4.13 0.65 2.02 1.01 -1.01 -0.90 121.20 125.56 3h7f s ILE 30 Ca 0.21 1.33 0.40 0.00 0.00 0.00 0.00 60.65 62.59 3h7f s ILE 30 Cb 0.20 -3.98 0.41 0.00 0.01 0.00 0.00 42.46 39.11 3h7f s ILE 30 CO -0.02 -0.25 2.31 0.00 0.00 0.00 0.00 174.94 176.99 3h7f h ALA 31 N 8.88 1.19 -0.01 9.38 0.00 -1.85 -1.26 119.26 135.58 3h7f h ALA 31 Ca -0.28 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.63 3h7f h ALA 31 Cb 1.11 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.90 3h7f h ALA 31 CO 0.99 -0.03 -0.04 -1.13 0.00 0.00 0.00 179.25 179.04 3h7f n SER 32 N -3.30 1.37 -4.91 0.00 3.41 -1.26 -4.82 113.62 104.10 3h7f n SER 32 Ca -0.03 -1.37 -0.21 0.00 -0.26 0.00 0.00 58.87 57.00 3h7f n SER 32 Cb 0.10 0.02 -0.03 0.00 -0.26 0.00 0.00 64.21 64.04 3h7f n SER 32 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 3h7f s GLU 33 N -2.09 3.24 0.21 4.33 2.02 -0.48 -4.91 118.70 121.02 3h7f s GLU 33 Ca 0.36 -0.88 -0.11 0.00 0.02 0.00 0.00 54.97 54.37 3h7f s GLU 33 Cb 0.21 -2.76 0.04 0.00 0.10 0.00 0.00 34.13 31.71 3h7f s GLU 33 CO 0.37 0.41 0.54 -1.71 0.02 0.00 0.00 175.26 174.89 3h7f n ASN 34 N -1.32 -1.34 -4.01 -0.19 2.85 -1.26 -3.91 115.26 106.07 3h7f n ASN 34 Ca -0.08 -1.88 -0.29 0.00 -0.11 0.00 0.00 54.58 52.22 3h7f n ASN 34 Cb 0.57 2.22 -0.17 0.00 1.24 0.00 0.00 39.78 43.65 3h7f n ASN 34 CO 0.00 0.00 0.00 -0.36 -2.11 0.00 0.00 177.26 174.79 3h7f s PHE 35 N -4.38 1.94 0.47 1.20 0.08 -1.26 -4.99 117.98 111.03 3h7f s PHE 35 Ca 0.11 -1.00 -0.22 0.00 0.12 0.00 0.00 56.93 55.95 3h7f s PHE 35 Cb -0.03 -1.45 -0.08 0.00 -0.57 0.00 0.00 43.02 40.90 3h7f s PHE 35 CO 0.06 -0.55 1.11 0.14 -0.10 0.00 0.00 175.22 175.87 3h7f s VAL 36 N 1.31 3.40 0.79 -0.44 -7.23 -1.26 -4.95 120.40 112.02 3h7f s VAL 36 Ca -0.00 0.98 -0.11 0.00 -1.81 0.00 0.00 61.98 61.04 3h7f s VAL 36 Cb -0.14 -3.46 0.07 0.00 0.56 0.00 0.00 36.38 33.41 3h7f s VAL 36 CO -0.06 -0.08 1.09 -2.16 -0.31 0.00 0.00 175.10 173.57 3h7f s PRO 37 N -2.88 2.11 0.26 4.82 0.04 -1.26 -4.91 135.00 133.18 3h7f s PRO 37 Ca 0.65 0.89 -0.04 0.00 0.04 0.00 0.00 61.00 62.54 3h7f s PRO 37 Cb -0.24 -1.90 0.53 0.00 0.04 0.00 0.00 34.50 32.93 3h7f s PRO 37 CO 0.28 -1.67 1.63 -0.09 0.04 0.00 0.00 177.00 177.20 3h7f h ARG 38 N -1.13 0.12 -0.44 4.56 2.43 -2.00 -2.06 114.38 115.85 3h7f h ARG 38 Ca -0.46 -0.01 0.01 0.00 -0.81 0.00 0.00 59.98 58.72 3h7f h ARG 38 Cb 1.25 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.75 3h7f h ARG 38 CO 0.55 0.08 0.29 0.00 -1.51 0.00 0.00 179.97 179.38 3h7f h ALA 39 N 1.75 1.72 -0.13 2.80 0.00 -2.00 -1.70 119.26 121.72 3h7f h ALA 39 Ca 0.46 -0.03 -0.22 0.00 0.00 0.00 0.00 54.91 55.12 3h7f h ALA 39 Cb 0.86 -0.16 0.01 0.00 0.00 0.00 0.00 17.79 18.49 3h7f h ALA 39 CO -0.69 0.25 -0.80 0.28 0.00 0.00 0.00 179.25 178.28 3h7f h VAL 40 N 0.56 1.29 -0.54 0.00 2.07 -1.74 -2.23 116.25 115.66 3h7f h VAL 40 Ca 0.17 -2.02 0.09 0.00 0.82 0.00 0.00 66.70 65.76 3h7f h VAL 40 Cb -0.02 2.04 -0.07 0.00 -1.52 0.00 0.00 31.29 31.72 3h7f h VAL 40 CO -0.04 0.64 0.14 -0.07 0.02 0.00 0.00 177.57 178.26 3h7f h LEU 41 N 0.50 0.06 -0.49 2.57 3.38 -1.20 -1.06 115.31 119.06 3h7f h LEU 41 Ca -0.06 0.09 -0.04 0.00 0.09 0.00 0.00 57.88 57.96 3h7f h LEU 41 Cb 1.43 0.11 -0.02 0.00 0.09 0.00 0.00 40.66 42.27 3h7f h LEU 41 CO 0.16 0.05 0.13 1.56 0.09 0.00 0.00 178.44 180.44 3h7f h GLN 42 N 0.29 0.78 -0.45 1.13 4.20 -1.31 -1.52 115.11 118.22 3h7f h GLN 42 Ca 0.28 -0.18 -0.00 0.00 0.06 0.00 0.00 58.65 58.80 3h7f h GLN 42 Cb 0.37 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 28.02 3h7f h GLN 42 CO -0.33 0.75 0.27 0.00 -0.67 0.00 0.00 178.83 178.84 3h7f h ALA 43 N 1.00 0.58 0.00 3.87 0.00 -1.18 -2.96 119.26 120.57 3h7f h ALA 43 Ca 0.16 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 3h7f h ALA 43 Cb 0.31 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 3h7f h ALA 43 CO -0.00 0.07 -0.26 1.96 0.00 0.00 0.00 179.25 181.02 3h7f h GLN 44 N 0.60 0.00 -0.69 0.00 4.20 -1.02 -2.45 115.11 115.75 3h7f h GLN 44 Ca 0.16 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.87 3h7f h GLN 44 Cb 0.00 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.78 3h7f h GLN 44 CO -0.03 0.26 0.00 0.41 -0.67 0.00 0.00 178.83 178.80 3h7f n GLY 45 N -0.53 1.73 3.93 3.46 0.00 -0.59 -4.87 105.19 108.33 3h7f n GLY 45 Ca -0.02 -0.39 -0.25 0.00 0.00 0.00 0.00 46.02 45.36 3h7f n GLY 45 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3h7f s SER 46 N -0.51 5.69 0.00 1.61 1.04 -0.92 -4.99 113.70 115.61 3h7f s SER 46 Ca 0.24 0.54 0.18 0.00 0.48 0.00 0.00 55.95 57.38 3h7f s SER 46 Cb 0.17 -1.63 1.00 0.00 0.10 0.00 0.00 66.02 65.65 3h7f s SER 46 CO 0.09 -0.92 1.50 1.33 0.98 0.00 0.00 173.24 176.22 3h7f n VAL 47 N -2.38 0.21 0.31 5.02 0.24 -1.26 -3.07 118.33 117.39 3h7f n VAL 47 Ca 0.03 0.05 0.19 0.00 -2.04 0.00 0.00 64.34 62.58 3h7f n VAL 47 Cb 0.58 -0.77 1.01 0.00 -1.47 0.00 0.00 33.84 33.18 3h7f n VAL 47 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 3h7f h LEU 48 N 0.00 0.00 -1.96 1.34 4.07 -1.94 -1.59 115.31 115.23 3h7f h LEU 48 Ca 0.00 0.00 0.16 0.00 0.08 0.00 0.00 57.88 58.12 3h7f h LEU 48 Cb 0.07 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 41.79 3h7f h LEU 48 CO 0.00 0.02 0.50 0.00 -1.08 0.00 0.00 178.44 177.89 3h7f h THR 49 N 0.00 0.44 0.00 0.22 1.03 -1.91 -2.60 112.91 110.10 3h7f h THR 49 Ca -0.00 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 66.40 3h7f h THR 49 Cb 0.14 0.62 0.00 0.00 -1.07 0.00 0.00 68.15 67.84 3h7f h THR 49 CO 0.00 0.00 0.00 0.59 -0.01 0.00 0.00 175.52 176.10 3h7f n ASN 50 N -3.89 0.64 -4.66 0.00 3.02 -0.60 -4.83 115.26 104.94 3h7f n ASN 50 Ca 0.11 0.58 -0.40 0.00 -0.03 0.00 0.00 54.58 54.84 3h7f n ASN 50 Cb 0.72 -0.75 -0.06 0.00 -0.61 0.00 0.00 39.78 39.08 3h7f n ASN 50 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 3h7f s LYS 51 N -3.13 4.19 -0.08 3.52 2.47 -0.98 -5.06 119.74 120.67 3h7f s LYS 51 Ca 0.09 0.51 -0.29 0.00 -1.56 0.00 0.00 55.97 54.72 3h7f s LYS 51 Cb 0.12 -3.58 -0.02 0.00 -1.46 0.00 0.00 37.83 32.90 3h7f s LYS 51 CO 0.53 -0.22 0.98 0.71 0.16 0.00 0.00 175.35 177.51 3h7f s TYR 52 N 1.84 3.55 -0.29 4.03 2.02 -1.26 -4.78 117.35 122.46 3h7f s TYR 52 Ca 0.26 1.60 0.20 0.00 -0.37 0.00 0.00 57.07 58.75 3h7f s TYR 52 Cb -0.16 -3.15 0.48 0.00 -0.40 0.00 0.00 41.96 38.73 3h7f s TYR 52 CO 0.10 -0.15 1.16 0.00 -1.57 0.00 0.00 175.55 175.09 3h7f n ALA 53 N 4.66 2.73 -1.70 3.71 0.00 -1.26 -4.78 120.51 123.87 3h7f n ALA 53 Ca 0.07 -2.45 -0.43 0.00 0.00 0.00 0.00 53.44 50.63 3h7f n ALA 53 Cb 0.49 -0.89 -0.01 0.00 0.00 0.00 0.00 19.45 19.05 3h7f n ALA 53 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3h7f n GLU 54 N -0.65 2.17 0.00 0.00 1.02 -1.26 -4.66 120.64 117.26 3h7f n GLU 54 Ca 0.03 0.76 0.00 0.00 -0.02 0.00 0.00 57.16 57.93 3h7f n GLU 54 Cb 0.82 -2.37 0.00 0.00 -0.02 0.00 0.00 31.44 29.87 3h7f n GLU 54 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3h7f n GLY 55 N 1.01 -0.23 3.29 0.62 0.00 -1.26 -1.55 105.19 107.06 3h7f n GLY 55 Ca 0.06 -1.97 -0.16 0.00 0.00 0.00 0.00 46.02 43.95 3h7f n GLY 55 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h7f s LEU 56 N 0.00 2.45 0.10 0.99 1.43 -1.10 -4.96 118.68 117.60 3h7f s LEU 56 Ca 0.00 -1.07 -0.36 0.00 -1.03 0.00 0.00 54.13 51.67 3h7f s LEU 56 Cb 0.00 -0.38 -0.17 0.00 0.03 0.00 0.00 46.19 45.67 3h7f s LEU 56 CO 0.00 -0.35 1.22 -2.65 0.23 0.00 0.00 176.35 174.80 3h7f n PRO 57 N -0.29 0.95 -0.25 1.29 -0.02 -1.26 -0.85 135.00 134.57 3h7f n PRO 57 Ca -0.08 0.34 0.00 0.00 -2.02 0.00 0.00 63.50 61.74 3h7f n PRO 57 Cb 0.61 -1.90 0.00 0.00 -0.02 0.00 0.00 33.50 32.20 3h7f n PRO 57 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3h7f n GLY 58 N 2.20 2.16 2.41 -1.23 0.00 -1.26 -4.84 105.19 104.63 3h7f n GLY 58 Ca 0.18 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.06 3h7f n GLY 58 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h7f n ARG 59 N -2.00 1.03 -3.29 1.61 5.12 -0.03 -5.14 116.66 113.97 3h7f n ARG 59 Ca 0.00 -3.07 -0.24 0.00 -1.93 0.00 0.00 57.85 52.61 3h7f n ARG 59 Cb 0.00 -1.41 -0.01 0.00 -1.16 0.00 0.00 32.46 29.89 3h7f n ARG 59 CO 0.00 0.00 0.00 1.03 -1.93 0.00 0.00 177.63 176.73 3h7f s ARG 60 N -2.11 3.43 -0.07 5.56 1.81 -1.17 -2.72 118.95 123.68 3h7f s ARG 60 Ca 0.33 -0.33 0.20 0.00 -1.72 0.00 0.00 55.73 54.21 3h7f s ARG 60 Cb 0.37 -2.64 0.69 0.00 -0.45 0.00 0.00 34.95 32.93 3h7f s ARG 60 CO -0.05 0.08 1.60 0.66 -0.68 0.00 0.00 175.30 176.91 3h7f n TYR 61 N -1.85 1.30 -3.95 -0.53 4.02 -0.60 -4.94 117.16 110.61 3h7f n TYR 61 Ca -0.04 -0.57 -0.11 0.00 -0.01 0.00 0.00 57.90 57.17 3h7f n TYR 61 Cb 0.56 -0.16 -0.13 0.00 -0.02 0.00 0.00 39.34 39.60 3h7f n TYR 61 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 176.86 176.56 3h7f s TYR 62 N -1.55 0.20 0.97 -0.72 2.02 -1.26 -5.00 117.35 112.00 3h7f s TYR 62 Ca 0.50 -0.26 -0.13 0.00 -0.37 0.00 0.00 57.07 56.81 3h7f s TYR 62 Cb 0.30 -0.13 0.17 0.00 -0.40 0.00 0.00 41.96 41.90 3h7f s TYR 62 CO 0.28 -0.08 1.14 0.20 -1.57 0.00 0.00 175.55 175.51 3h7f s GLY 63 N -0.72 1.59 -0.19 0.71 0.00 -1.26 -4.48 107.32 102.97 3h7f s GLY 63 Ca -0.07 -0.59 0.00 0.00 0.00 0.00 0.00 44.72 44.06 3h7f s GLY 63 CO -0.00 0.04 0.00 0.61 0.00 0.00 0.00 173.10 173.74 3h7f n GLY 64 N -1.92 0.53 1.06 0.20 0.00 -1.26 -4.96 105.19 98.85 3h7f n GLY 64 Ca 0.08 -0.38 0.06 0.00 0.00 0.00 0.00 46.02 45.77 3h7f n GLY 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h7f h GLU 66 N 2.47 0.84 0.21 0.00 9.09 -1.97 -0.95 114.58 124.28 3h7f h GLU 66 Ca 0.00 -0.05 -0.27 0.00 0.05 0.00 0.00 59.36 59.09 3h7f h GLU 66 Cb 0.97 -0.19 0.03 0.00 -1.65 0.00 0.00 28.75 27.91 3h7f h GLU 66 CO 0.14 0.56 -1.19 0.45 0.05 0.00 0.00 179.01 179.02 3h7f h HIS 67 N 0.87 0.79 0.00 2.06 3.86 -2.02 -3.21 115.15 117.50 3h7f h HIS 67 Ca 0.40 -0.58 -0.04 0.00 -1.16 0.00 0.00 60.37 59.00 3h7f h HIS 67 Cb 0.31 -0.03 -0.01 0.00 1.06 0.00 0.00 27.41 28.75 3h7f h HIS 67 CO -0.05 1.46 -0.17 -0.39 0.86 0.00 0.00 177.93 179.64 3h7f h VAL 68 N -0.08 0.72 -0.63 2.45 -1.51 -1.86 -2.26 116.25 113.08 3h7f h VAL 68 Ca -0.21 -0.69 -0.06 0.00 -1.23 0.00 0.00 66.70 64.51 3h7f h VAL 68 Cb 1.94 1.42 -0.03 0.00 -2.13 0.00 0.00 31.29 32.50 3h7f h VAL 68 CO 0.22 0.16 0.14 0.44 -1.23 0.00 0.00 177.57 177.30 3h7f h ASP 69 N 0.00 0.96 -0.64 4.19 5.19 -1.23 -1.57 116.42 123.33 3h7f h ASP 69 Ca -0.00 -0.24 -0.04 0.00 -0.62 0.00 0.00 57.03 56.12 3h7f h ASP 69 Cb 0.41 -0.25 -0.03 0.00 0.18 0.00 0.00 39.33 39.64 3h7f h ASP 69 CO 0.02 0.96 0.23 0.58 -3.12 0.00 0.00 179.24 177.91 3h7f h VAL 70 N 0.93 1.24 -0.09 -1.35 2.07 -1.45 -2.06 116.25 115.55 3h7f h VAL 70 Ca 0.20 -0.79 0.01 0.00 0.82 0.00 0.00 66.70 66.94 3h7f h VAL 70 Cb 0.38 0.56 -0.01 0.00 -1.52 0.00 0.00 31.29 30.69 3h7f h VAL 70 CO 0.00 0.31 0.00 0.58 0.02 0.00 0.00 177.57 178.49 3h7f h VAL 71 N 0.90 0.95 -0.86 2.57 2.07 -1.29 -1.48 116.25 119.11 3h7f h VAL 71 Ca 0.21 -0.01 -0.03 0.00 0.82 0.00 0.00 66.70 67.69 3h7f h VAL 71 Cb 0.25 0.91 -0.04 0.00 -1.52 0.00 0.00 31.29 30.88 3h7f h VAL 71 CO -0.01 0.01 0.43 -0.08 0.02 0.00 0.00 177.57 177.93 3h7f h GLU 72 N 0.04 1.22 -0.12 1.57 4.81 -1.25 -2.26 114.58 118.59 3h7f h GLU 72 Ca 0.04 -0.17 -0.10 0.00 -0.13 0.00 0.00 59.36 59.00 3h7f h GLU 72 Cb 0.04 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 29.18 3h7f h GLU 72 CO -0.06 0.93 -0.39 -0.91 -0.73 0.00 0.00 179.01 177.85 3h7f h ASN 73 N 1.22 0.26 -0.43 1.04 2.35 -1.21 -1.26 115.58 117.55 3h7f h ASN 73 Ca 0.30 -0.10 -0.03 0.00 -0.55 0.00 0.00 56.30 55.91 3h7f h ASN 73 Cb 0.09 -0.07 -0.02 0.00 0.05 0.00 0.00 38.32 38.37 3h7f h ASN 73 CO -0.04 0.63 0.15 -0.07 -1.65 0.00 0.00 177.43 176.45 3h7f h LEU 74 N 0.21 0.61 -0.51 1.61 3.38 -0.97 -0.43 115.31 119.22 3h7f h LEU 74 Ca 0.02 -0.19 -0.04 0.00 0.09 0.00 0.00 57.88 57.77 3h7f h LEU 74 Cb 0.78 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.35 3h7f h LEU 74 CO 0.06 0.63 0.17 0.00 0.09 0.00 0.00 178.44 179.40 3h7f h ALA 75 N 1.00 0.66 -0.14 1.53 0.00 -1.16 -1.68 119.26 119.46 3h7f h ALA 75 Ca 0.14 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 3h7f h ALA 75 Cb 0.23 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 3h7f h ALA 75 CO -0.01 0.30 0.07 0.00 0.00 0.00 0.00 179.25 179.62 3h7f h ARG 76 N 0.68 0.20 -0.56 0.00 3.08 -1.17 -1.63 114.38 114.98 3h7f h ARG 76 Ca 0.16 -0.03 -0.11 0.00 0.07 0.00 0.00 59.98 60.08 3h7f h ARG 76 Cb 0.25 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.24 3h7f h ARG 76 CO -0.01 0.23 -0.06 -0.44 -1.07 0.00 0.00 179.97 178.62 3h7f h ASP 77 N 0.12 1.02 -0.46 7.04 3.32 -1.03 -1.57 116.42 124.86 3h7f h ASP 77 Ca 0.05 -0.31 -0.11 0.00 0.02 0.00 0.00 57.03 56.67 3h7f h ASP 77 Cb 0.09 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.35 3h7f h ASP 77 CO -0.01 1.10 -0.13 0.03 -1.72 0.00 0.00 179.24 178.51 3h7f h ARG 78 N 0.92 0.94 -0.26 3.56 3.08 -1.30 -1.55 114.38 119.78 3h7f h ARG 78 Ca 0.15 -0.35 -0.02 0.00 0.07 0.00 0.00 59.98 59.83 3h7f h ARG 78 Cb 0.62 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.60 3h7f h ARG 78 CO 0.04 1.01 0.07 0.00 -1.07 0.00 0.00 179.97 180.02 3h7f h ALA 79 N 1.00 0.34 -0.36 0.04 0.00 -1.12 -0.66 119.26 118.50 3h7f h ALA 79 Ca 0.13 -0.15 0.02 0.00 0.00 0.00 0.00 54.91 54.91 3h7f h ALA 79 Cb 0.68 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.34 3h7f h ALA 79 CO 0.05 -0.02 0.18 0.87 0.00 0.00 0.00 179.25 180.33 3h7f h LYS 80 N 0.25 0.36 -0.42 0.00 1.57 -1.19 -2.52 116.57 114.62 3h7f h LYS 80 Ca 0.08 -0.02 -0.08 0.00 -1.87 0.00 0.00 60.65 58.76 3h7f h LYS 80 Cb 0.26 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.47 3h7f h LYS 80 CO -0.00 0.24 -0.04 0.00 -0.57 0.00 0.00 179.45 179.07 3h7f h ALA 81 N 1.18 0.57 -0.48 3.86 0.00 -1.23 0.59 119.26 123.75 3h7f h ALA 81 Ca 0.15 -0.29 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 3h7f h ALA 81 Cb 0.05 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 3h7f h ALA 81 CO -0.10 0.40 0.17 1.25 0.00 0.00 0.00 179.25 180.97 3h7f h LEU 82 N 0.60 0.69 -1.02 0.00 5.85 -1.08 -3.22 115.31 117.12 3h7f h LEU 82 Ca 0.11 -0.19 0.00 0.00 0.84 0.00 0.00 57.88 58.64 3h7f h LEU 82 Cb 0.55 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.40 3h7f h LEU 82 CO 0.03 0.69 -0.47 0.49 -0.34 0.00 0.00 178.44 178.85 3h7f n PHE 83 N -4.54 0.00 -2.38 1.25 3.72 -0.96 -4.92 117.46 109.64 3h7f n PHE 83 Ca 0.01 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.30 3h7f n PHE 83 Cb 0.18 -0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.72 3h7f n PHE 83 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3h7f n GLY 84 N 1.42 -0.05 3.92 1.37 0.00 0.13 -4.85 105.19 107.13 3h7f n GLY 84 Ca 0.09 -0.37 -0.26 0.00 0.00 0.00 0.00 46.02 45.49 3h7f n GLY 84 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h7f s ALA 85 N -2.68 3.90 0.12 4.61 0.00 -0.76 -4.93 121.76 122.03 3h7f s ALA 85 Ca 0.06 -1.07 -0.01 0.00 0.00 0.00 0.00 51.96 50.94 3h7f s ALA 85 Cb -0.03 -1.71 -0.16 0.00 0.00 0.00 0.00 23.12 21.22 3h7f s ALA 85 CO 0.07 0.51 1.26 0.93 0.00 0.00 0.00 175.76 178.53 3h7f h GLU 86 N 2.12 0.23 -4.14 0.00 5.08 -1.79 -3.44 114.58 112.65 3h7f h GLU 86 Ca -0.49 -0.32 -0.11 0.00 -1.00 0.00 0.00 59.36 57.44 3h7f h GLU 86 Cb 1.20 0.11 -0.15 0.00 0.50 0.00 0.00 28.75 30.41 3h7f h GLU 86 CO 0.67 1.09 -0.60 -0.59 -1.00 0.00 0.00 179.01 178.58 3h7f s PHE 87 N -2.92 0.44 0.02 4.33 -0.12 -0.73 -4.76 117.98 114.24 3h7f s PHE 87 Ca -0.03 -0.95 0.01 0.00 -0.05 0.00 0.00 56.93 55.90 3h7f s PHE 87 Cb 0.09 -0.31 -0.01 0.00 -0.63 0.00 0.00 43.02 42.15 3h7f s PHE 87 CO 0.86 -0.43 -0.04 0.00 -0.05 0.00 0.00 175.22 175.56 3h7f s ALA 88 N -3.91 0.23 -0.16 1.99 0.00 -1.26 -1.99 121.76 116.65 3h7f s ALA 88 Ca 0.07 -0.44 0.01 0.00 0.00 0.00 0.00 51.96 51.60 3h7f s ALA 88 Cb 0.07 0.06 0.02 0.00 0.00 0.00 0.00 23.12 23.27 3h7f s ALA 88 CO -0.10 -0.06 -0.17 1.21 0.00 0.00 0.00 175.76 176.65 3h7f s ASN 89 N -0.95 2.88 -0.01 0.00 3.84 0.00 -4.97 114.94 115.73 3h7f s ASN 89 Ca -0.08 -0.56 0.18 0.00 0.21 0.00 0.00 52.86 52.61 3h7f s ASN 89 Cb -0.06 -1.31 0.53 0.00 -0.55 0.00 0.00 41.25 39.85 3h7f s ASN 89 CO -0.00 -0.03 1.45 1.33 -2.79 0.00 0.00 177.10 177.05 3h7f n VAL 90 N 4.68 1.10 0.12 -5.21 0.24 -1.26 -1.79 118.33 116.21 3h7f n VAL 90 Ca -0.19 -1.04 0.06 0.00 -2.04 0.00 0.00 64.34 61.14 3h7f n VAL 90 Cb 0.50 0.45 0.03 0.00 -1.47 0.00 0.00 33.84 33.35 3h7f n VAL 90 CO 0.00 0.00 0.00 1.56 -2.14 0.00 0.00 176.83 176.25 3h7f h GLN 91 N 3.43 0.00 -6.47 7.34 4.20 -1.96 -3.47 115.11 118.17 3h7f h GLN 91 Ca 0.00 0.00 -0.61 0.00 0.06 0.00 0.00 58.65 58.10 3h7f h GLN 91 Cb 0.95 0.00 0.07 0.00 0.30 0.00 0.00 27.48 28.80 3h7f h GLN 91 CO 0.02 0.22 0.57 -2.30 -0.67 0.00 0.00 178.83 176.67 3h7f n PRO 92 N -2.99 1.76 0.21 1.46 -0.02 -1.26 -4.77 135.00 129.40 3h7f n PRO 92 Ca -0.01 0.63 0.15 0.00 -2.02 0.00 0.00 63.50 62.25 3h7f n PRO 92 Cb 0.67 -2.28 0.64 0.00 -0.02 0.00 0.00 33.50 32.50 3h7f n PRO 92 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3h7f h HIS 93 N 4.52 0.00 -2.57 6.00 3.86 -1.90 -2.06 115.15 122.99 3h7f h HIS 93 Ca -0.45 0.00 0.13 0.00 -1.16 0.00 0.00 60.37 58.89 3h7f h HIS 93 Cb 1.29 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 29.72 3h7f h HIS 93 CO 0.58 0.00 0.49 -1.54 0.86 0.00 0.00 177.93 178.32 3h7f s SER 94 N -4.96 -0.06 0.17 2.45 1.04 -1.26 -4.15 113.70 106.93 3h7f s SER 94 Ca 0.02 -0.68 -0.11 0.00 0.48 0.00 0.00 55.95 55.66 3h7f s SER 94 Cb 0.09 0.57 0.07 0.00 0.10 0.00 0.00 66.02 66.85 3h7f s SER 94 CO 0.45 -1.10 1.70 1.23 0.98 0.00 0.00 173.24 176.50 3h7f h GLY 95 N 2.00 1.01 0.96 7.32 0.00 -1.83 -1.62 103.07 110.91 3h7f h GLY 95 Ca -0.27 -0.60 -0.03 0.00 0.00 0.00 0.00 47.33 46.42 3h7f h GLY 95 CO 0.33 0.56 0.17 0.00 0.00 0.00 0.00 176.54 177.60 3h7f h ALA 96 N 1.06 0.63 -0.24 3.60 0.00 -1.96 -2.14 119.26 120.20 3h7f h ALA 96 Ca 0.19 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 3h7f h ALA 96 Cb 0.30 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 3h7f h ALA 96 CO -0.00 0.27 -0.14 1.96 0.00 0.00 0.00 179.25 181.33 3h7f h GLN 97 N 0.64 0.41 -0.42 0.00 7.50 -1.93 -0.95 115.11 120.36 3h7f h GLN 97 Ca 0.16 -0.11 -0.01 0.00 0.50 0.00 0.00 58.65 59.19 3h7f h GLN 97 Cb 0.24 -0.05 -0.02 0.00 0.05 0.00 0.00 27.48 27.71 3h7f h GLN 97 CO -0.01 0.55 0.23 0.00 -1.50 0.00 0.00 178.83 178.10 3h7f h ALA 98 N 1.48 0.54 -0.41 3.87 0.00 -1.04 -2.65 119.26 121.05 3h7f h ALA 98 Ca 0.07 -0.08 -0.11 0.00 0.00 0.00 0.00 54.91 54.79 3h7f h ALA 98 Cb 0.48 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 3h7f h ALA 98 CO 0.03 0.06 -0.19 -0.91 0.00 0.00 0.00 179.25 178.24 3h7f h ASN 99 N 0.54 0.81 -0.74 0.00 2.35 -1.07 -1.91 115.58 115.56 3h7f h ASN 99 Ca 0.15 -0.28 0.02 0.00 -0.55 0.00 0.00 56.30 55.64 3h7f h ASN 99 Cb 0.05 -0.22 -0.04 0.00 0.05 0.00 0.00 38.32 38.16 3h7f h ASN 99 CO -0.02 0.99 0.48 0.00 -1.65 0.00 0.00 177.43 177.22 3h7f h ALA 100 N 1.08 0.96 -0.36 -0.83 0.00 -1.14 -2.09 119.26 116.88 3h7f h ALA 100 Ca 0.10 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.90 3h7f h ALA 100 Cb 0.70 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 3h7f h ALA 100 CO 0.05 0.31 -0.07 0.00 0.00 0.00 0.00 179.25 179.55 3h7f h ALA 101 N 1.29 0.49 -0.57 0.00 0.00 -1.29 -1.75 119.26 117.44 3h7f h ALA 101 Ca 0.28 -0.29 0.08 0.00 0.00 0.00 0.00 54.91 54.99 3h7f h ALA 101 Cb -0.05 -0.13 -0.07 0.00 0.00 0.00 0.00 17.79 17.54 3h7f h ALA 101 CO -0.08 0.32 0.21 0.28 0.00 0.00 0.00 179.25 179.98 3h7f h VAL 102 N 0.48 0.79 -0.35 0.00 2.07 -1.09 -1.31 116.25 116.84 3h7f h VAL 102 Ca 0.09 -0.13 -0.15 0.00 0.82 0.00 0.00 66.70 67.33 3h7f h VAL 102 Cb 0.56 0.37 -0.00 0.00 -1.52 0.00 0.00 31.29 30.69 3h7f h VAL 102 CO 0.03 0.07 -0.38 -0.07 0.02 0.00 0.00 177.57 177.24 3h7f h LEU 103 N 0.39 0.94 -0.78 2.57 3.38 -1.36 -1.89 115.31 118.56 3h7f h LEU 103 Ca 0.28 -0.48 0.14 0.00 0.09 0.00 0.00 57.88 57.91 3h7f h LEU 103 Cb 0.33 -0.26 -0.09 0.00 0.09 0.00 0.00 40.66 40.73 3h7f h LEU 103 CO -0.29 1.22 0.36 -0.74 0.09 0.00 0.00 178.44 179.08 3h7f h HIS 104 N 0.67 0.62 -0.12 1.13 2.76 -1.18 -0.97 115.15 118.06 3h7f h HIS 104 Ca 0.05 0.03 -0.18 0.00 -2.20 0.00 0.00 60.37 58.08 3h7f h HIS 104 Cb 0.97 -0.16 -0.00 0.00 1.55 0.00 0.00 27.41 29.77 3h7f h HIS 104 CO 0.07 0.13 -0.68 0.00 -1.30 0.00 0.00 177.93 176.15 3h7f h ALA 105 N 1.53 0.60 0.00 5.26 0.00 -0.81 -3.37 119.26 122.47 3h7f h ALA 105 Ca 0.42 -0.57 0.00 0.00 0.00 0.00 0.00 54.91 54.76 3h7f h ALA 105 Cb 0.60 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.33 3h7f h ALA 105 CO -0.37 0.73 -1.75 1.28 0.00 0.00 0.00 179.25 179.14 3h7f n LEU 106 N -3.89 0.11 -4.28 0.00 4.77 -0.75 -4.93 117.00 108.03 3h7f n LEU 106 Ca -0.04 -0.06 -0.15 0.00 -0.03 0.00 0.00 56.01 55.72 3h7f n LEU 106 Cb 0.68 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.67 3h7f n LEU 106 CO 0.48 0.03 -0.38 -0.04 -1.33 0.00 0.00 177.39 176.15 3h7f s MET 107 N -3.26 1.17 0.19 3.23 -1.94 -0.38 -4.97 119.30 113.34 3h7f s MET 107 Ca -0.05 -1.54 0.10 0.00 -1.71 0.00 0.00 55.69 52.49 3h7f s MET 107 Cb 0.13 -0.62 -0.04 0.00 2.01 0.00 0.00 34.83 36.30 3h7f s MET 107 CO 0.79 0.01 -0.17 -1.12 -0.01 0.00 0.00 175.02 174.52 3h7f s SER 108 N -3.22 3.83 0.30 3.03 0.01 -1.26 -4.61 113.70 111.78 3h7f s SER 108 Ca 0.21 -0.74 -0.29 0.00 1.31 0.00 0.00 55.95 56.45 3h7f s SER 108 Cb 0.04 -0.48 -0.13 0.00 0.21 0.00 0.00 66.02 65.66 3h7f s SER 108 CO 0.04 0.11 1.19 -2.65 0.41 0.00 0.00 173.24 172.33 3h7f n PRO 109 N 0.11 1.77 0.00 12.44 -0.02 -1.26 -2.19 135.00 145.85 3h7f n PRO 109 Ca -0.11 0.62 0.00 0.00 -2.02 0.00 0.00 63.50 61.99 3h7f n PRO 109 Cb 0.56 -2.13 0.00 0.00 -0.02 0.00 0.00 33.50 31.91 3h7f n PRO 109 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3h7f n GLY 110 N 1.17 1.97 3.86 -1.23 0.00 0.06 -5.01 105.19 106.01 3h7f n GLY 110 Ca 0.08 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.80 3h7f n GLY 110 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3h7f s GLU 111 N -0.51 2.37 -0.17 1.61 2.02 -0.93 -4.28 118.70 118.80 3h7f s GLU 111 Ca 0.00 0.42 -0.15 0.00 0.02 0.00 0.00 54.97 55.26 3h7f s GLU 111 Cb 0.00 -1.97 -0.04 0.00 0.10 0.00 0.00 34.13 32.22 3h7f s GLU 111 CO 0.00 -1.37 0.34 1.03 0.02 0.00 0.00 175.26 175.28 3h7f s ARG 112 N -5.35 4.24 -0.11 1.61 0.52 -1.26 -1.33 118.95 117.26 3h7f s ARG 112 Ca 0.60 0.16 0.03 0.00 -0.52 0.00 0.00 55.73 56.00 3h7f s ARG 112 Cb -0.12 -3.47 -0.00 0.00 0.52 0.00 0.00 34.95 31.88 3h7f s ARG 112 CO 0.52 0.13 -0.22 -1.17 0.02 0.00 0.00 175.30 174.58 3h7f s LEU 113 N 0.78 2.19 -0.17 2.53 2.96 -0.45 -0.69 118.68 125.83 3h7f s LEU 113 Ca 0.18 -0.53 -0.01 0.00 -0.22 0.00 0.00 54.13 53.55 3h7f s LEU 113 Cb -0.14 -1.45 -0.00 0.00 0.50 0.00 0.00 46.19 45.10 3h7f s LEU 113 CO 0.06 0.14 -0.13 -0.22 -1.32 0.00 0.00 176.35 174.89 3h7f s LEU 114 N 0.44 2.58 0.21 -0.68 2.96 -0.84 -1.46 118.68 121.89 3h7f s LEU 114 Ca -0.15 -0.44 -0.07 0.00 -0.22 0.00 0.00 54.13 53.24 3h7f s LEU 114 Cb -0.17 -1.60 -0.02 0.00 0.50 0.00 0.00 46.19 44.89 3h7f s LEU 114 CO 0.06 0.07 0.29 -0.83 -1.32 0.00 0.00 176.35 174.62 3h7f s GLY 115 N 0.94 0.85 0.04 7.98 0.00 -0.98 -1.10 107.32 115.05 3h7f s GLY 115 Ca -0.02 -1.19 -0.31 0.00 0.00 0.00 0.00 44.72 43.20 3h7f s GLY 115 CO -0.01 -0.98 1.46 -2.27 0.00 0.00 0.00 173.10 171.30 3h7f s LEU 116 N -3.06 4.34 0.58 0.66 2.96 -1.26 -1.89 118.68 121.01 3h7f s LEU 116 Ca 0.27 2.25 -0.18 0.00 -0.22 0.00 0.00 54.13 56.25 3h7f s LEU 116 Cb 0.03 -3.57 -0.04 0.00 0.50 0.00 0.00 46.19 43.11 3h7f s LEU 116 CO 0.07 -0.74 1.10 1.51 -1.32 0.00 0.00 176.35 176.97 3h7f s ASP 117 N 1.82 5.66 0.27 3.68 3.84 -0.85 -4.08 116.67 127.01 3h7f s ASP 117 Ca 0.66 2.02 -0.01 0.00 -0.00 0.00 0.00 52.55 55.23 3h7f s ASP 117 Cb -0.35 -2.56 0.51 0.00 -1.38 0.00 0.00 42.92 39.15 3h7f s ASP 117 CO 0.29 -1.25 1.80 0.25 -0.00 0.00 0.00 175.17 176.26 3h7f h LEU 118 N 0.79 0.73 -2.50 2.11 5.85 -1.88 -1.06 115.31 119.35 3h7f h LEU 118 Ca -0.48 0.06 -0.00 0.00 0.84 0.00 0.00 57.88 58.30 3h7f h LEU 118 Cb 1.24 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 42.20 3h7f h LEU 118 CO 0.57 0.37 -0.02 0.00 -0.34 0.00 0.00 178.44 179.01 3h7f h ALA 119 N 1.53 1.12 -0.22 1.25 0.00 -1.92 -2.32 119.26 118.70 3h7f h ALA 119 Ca 0.46 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 55.29 3h7f h ALA 119 Cb 0.53 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.28 3h7f h ALA 119 CO -0.30 0.02 -0.07 0.09 0.00 0.00 0.00 179.25 179.00 3h7f n ASN 120 N -3.28 2.88 0.00 0.00 5.03 -0.58 -4.76 115.26 114.55 3h7f n ASN 120 Ca -0.02 -3.39 0.00 0.00 0.87 0.00 0.00 54.58 52.04 3h7f n ASN 120 Cb 0.14 -0.56 0.00 0.00 -1.02 0.00 0.00 39.78 38.34 3h7f n ASN 120 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3h7f n GLY 121 N -0.97 0.93 3.68 7.41 0.00 -0.87 -4.80 105.19 110.58 3h7f n GLY 121 Ca 0.24 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.97 3h7f n GLY 121 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3h7f s GLY 122 N -1.80 1.58 0.24 -0.02 0.00 -0.51 -0.93 107.32 105.88 3h7f s GLY 122 Ca 0.00 -0.61 0.04 0.00 0.00 0.00 0.00 44.72 44.14 3h7f s GLY 122 CO 0.00 0.08 0.38 -1.58 0.00 0.00 0.00 173.10 171.98 3h7f s HIS 123 N -3.08 3.47 0.42 1.90 2.46 -1.26 -4.44 115.29 114.75 3h7f s HIS 123 Ca 0.67 0.08 0.29 0.00 0.47 0.00 0.00 55.06 56.57 3h7f s HIS 123 Cb -0.15 -1.65 1.53 0.00 -0.13 0.00 0.00 32.58 32.18 3h7f s HIS 123 CO 0.56 0.40 2.10 1.37 -2.47 0.00 0.00 174.74 176.70 3h7f h LEU 124 N 1.32 0.00 -0.29 8.88 8.10 -1.98 -1.88 115.31 129.46 3h7f h LEU 124 Ca -0.51 0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.48 3h7f h LEU 124 Cb 1.22 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 41.44 3h7f h LEU 124 CO 0.63 0.10 0.00 0.35 -4.11 0.00 0.00 178.44 175.40 3h7f n THR 125 N -3.58 0.10 -0.45 0.15 -2.24 -1.26 -2.32 114.28 104.68 3h7f n THR 125 Ca -0.02 -0.10 0.09 0.00 -2.27 0.00 0.00 64.05 61.75 3h7f n THR 125 Cb 0.22 0.03 0.29 0.00 -2.10 0.00 0.00 70.33 68.77 3h7f n THR 125 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 3h7f n HIS 126 N -0.30 1.03 0.00 4.78 8.25 -0.71 -4.78 115.22 123.50 3h7f n HIS 126 Ca 0.04 -0.56 0.00 0.00 -0.26 0.00 0.00 57.72 56.94 3h7f n HIS 126 Cb 0.08 -0.11 0.00 0.00 1.12 0.00 0.00 29.99 31.08 3h7f n HIS 126 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3h7f n GLY 127 N 1.09 0.47 3.76 -1.41 0.00 -1.23 -4.35 105.19 103.52 3h7f n GLY 127 Ca 0.22 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.83 3h7f n GLY 127 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 3h7f n MET 128 N 0.00 2.66 -0.29 1.61 0.00 -0.98 -4.03 117.12 116.09 3h7f n MET 128 Ca 0.00 0.94 0.20 0.00 0.00 0.00 0.00 57.70 58.84 3h7f n MET 128 Cb 0.00 -2.68 0.49 0.00 0.00 0.00 0.00 33.22 31.03 3h7f n MET 128 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 175.97 176.04 3h7f h ARG 129 N 3.56 0.42 -0.28 2.12 -0.00 -1.90 -2.36 114.38 115.95 3h7f h ARG 129 Ca -0.49 -0.03 0.00 0.00 -0.00 0.00 0.00 59.98 59.46 3h7f h ARG 129 Cb 1.24 -0.09 0.00 0.00 -0.00 0.00 0.00 29.97 31.11 3h7f h ARG 129 CO 0.69 0.28 0.00 1.28 -0.00 0.00 0.00 179.97 182.22 3h7f n LEU 130 N -4.58 2.88 -4.92 0.08 4.77 -1.26 -3.43 117.00 110.56 3h7f n LEU 130 Ca 0.22 -1.52 -0.27 0.00 -0.03 0.00 0.00 56.01 54.42 3h7f n LEU 130 Cb 0.77 -0.18 -0.01 0.00 -2.33 0.00 0.00 43.42 41.68 3h7f n LEU 130 CO 0.28 0.64 0.34 0.21 -1.33 0.00 0.00 177.39 177.53 3h7f s ASN 131 N -1.18 6.30 0.37 -1.43 3.84 -0.91 -4.91 114.94 117.03 3h7f s ASN 131 Ca 0.27 0.78 0.18 0.00 0.21 0.00 0.00 52.86 54.29 3h7f s ASN 131 Cb 0.16 -2.18 1.12 0.00 -0.55 0.00 0.00 41.25 39.80 3h7f s ASN 131 CO 0.22 -0.45 1.69 2.19 -2.79 0.00 0.00 177.10 177.96 3h7f h PHE 132 N 0.55 0.80 0.00 0.43 -5.15 -1.91 -0.73 116.94 110.93 3h7f h PHE 132 Ca -0.48 0.03 -0.06 0.00 -0.20 0.00 0.00 57.97 57.26 3h7f h PHE 132 Cb 1.21 -0.22 -0.01 0.00 0.22 0.00 0.00 35.95 37.15 3h7f h PHE 132 CO 0.56 -0.08 -0.28 0.66 -2.00 0.00 0.00 178.31 177.17 3h7f h SER 133 N 0.34 0.00 0.23 -0.68 4.64 -1.86 -1.85 113.55 114.37 3h7f h SER 133 Ca 0.70 0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 61.68 3h7f h SER 133 Cb 1.73 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.78 3h7f h SER 133 CO -0.47 0.28 -1.96 0.61 -0.87 0.00 0.00 176.83 174.42 3h7f n GLY 134 N -0.62 -0.72 0.27 -0.77 0.00 -0.60 -4.03 105.19 98.73 3h7f n GLY 134 Ca -0.02 -0.19 -0.08 0.00 0.00 0.00 0.00 46.02 45.73 3h7f n GLY 134 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3h7f h LYS 135 N 0.04 0.93 0.00 1.61 1.79 -1.04 -3.34 116.57 116.55 3h7f h LYS 135 Ca -0.40 -0.21 -0.17 0.00 -2.18 0.00 0.00 60.65 57.70 3h7f h LYS 135 Cb 2.03 -0.13 -0.03 0.00 -1.58 0.00 0.00 32.23 32.52 3h7f h LYS 135 CO 0.07 0.84 -1.41 1.28 -1.08 0.00 0.00 179.45 179.15 3h7f n LEU 136 N -4.39 0.86 -4.42 2.94 4.77 -0.71 -5.00 117.00 111.05 3h7f n LEU 136 Ca 0.03 0.38 -0.23 0.00 -0.03 0.00 0.00 56.01 56.15 3h7f n LEU 136 Cb 0.22 0.07 -0.11 0.00 -2.33 0.00 0.00 43.42 41.28 3h7f n LEU 136 CO 0.40 0.14 -0.49 -0.31 -1.33 0.00 0.00 177.39 175.81 3h7f s TYR 137 N -2.93 2.13 -0.26 -1.77 2.02 -1.26 -0.76 117.35 114.53 3h7f s TYR 137 Ca -0.03 -0.40 -0.24 0.00 -0.37 0.00 0.00 57.07 56.03 3h7f s TYR 137 Cb 0.09 -0.98 -0.00 0.00 -0.40 0.00 0.00 41.96 40.66 3h7f s TYR 137 CO 0.81 0.56 0.82 -2.00 -1.57 0.00 0.00 175.55 174.16 3h7f s GLU 138 N -3.25 4.14 -0.12 -0.62 2.12 -0.44 -4.76 118.70 115.77 3h7f s GLU 138 Ca 0.25 0.86 -0.06 0.00 0.36 0.00 0.00 54.97 56.38 3h7f s GLU 138 Cb -0.05 -3.66 -0.04 0.00 0.26 0.00 0.00 34.13 30.64 3h7f s GLU 138 CO 0.11 -0.55 0.09 -0.80 -0.54 0.00 0.00 175.26 173.57 3h7f s ASN 139 N 1.40 5.94 0.15 -1.70 -0.87 -1.26 -1.34 114.94 117.26 3h7f s ASN 139 Ca 0.34 0.31 0.06 0.00 -1.57 0.00 0.00 52.86 52.00 3h7f s ASN 139 Cb -0.15 -1.88 -0.04 0.00 -0.02 0.00 0.00 41.25 39.16 3h7f s ASN 139 CO 0.08 0.36 -0.12 -0.83 -2.57 0.00 0.00 177.10 174.02 3h7f s GLY 140 N -0.75 1.13 0.05 0.66 0.00 -0.53 -4.98 107.32 102.90 3h7f s GLY 140 Ca 0.13 -1.43 0.03 0.00 0.00 0.00 0.00 44.72 43.45 3h7f s GLY 140 CO 0.03 -1.51 -0.10 -1.36 0.00 0.00 0.00 173.10 170.16 3h7f s PHE 141 N -2.75 0.83 0.38 1.90 0.08 -1.26 -2.31 117.98 114.83 3h7f s PHE 141 Ca 0.14 -0.48 0.08 0.00 0.12 0.00 0.00 56.93 56.79 3h7f s PHE 141 Cb -0.01 -0.48 -0.06 0.00 -0.57 0.00 0.00 43.02 41.89 3h7f s PHE 141 CO 0.03 -0.04 0.02 1.52 -0.10 0.00 0.00 175.22 176.64 3h7f s TYR 142 N -1.32 2.52 0.00 0.36 -0.85 -0.79 -4.94 117.35 112.32 3h7f s TYR 142 Ca -0.07 -0.55 0.00 0.00 -0.52 0.00 0.00 57.07 55.92 3h7f s TYR 142 Cb -0.10 -1.64 0.00 0.00 0.38 0.00 0.00 41.96 40.60 3h7f s TYR 142 CO 0.01 0.44 0.00 0.41 -1.52 0.00 0.00 175.55 174.89 3h7f n GLY 143 N -0.97 4.89 3.63 5.49 0.00 -1.26 -2.02 105.19 114.95 3h7f n GLY 143 Ca -0.04 -1.45 -0.26 0.00 0.00 0.00 0.00 46.02 44.28 3h7f n GLY 143 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3h7f s VAL 144 N -1.25 3.50 0.19 1.61 -7.23 -1.26 -4.51 120.40 111.45 3h7f s VAL 144 Ca 0.00 -1.62 -0.30 0.00 -1.81 0.00 0.00 61.98 58.24 3h7f s VAL 144 Cb 0.00 -2.79 -0.09 0.00 0.56 0.00 0.00 36.38 34.07 3h7f s VAL 144 CO 0.00 -0.19 1.31 -0.62 -0.31 0.00 0.00 175.10 175.29 3h7f s ASP 145 N -3.12 6.90 0.60 4.85 2.15 -0.04 -4.89 116.67 123.11 3h7f s ASP 145 Ca 0.28 2.39 0.37 0.00 0.43 0.00 0.00 52.55 56.01 3h7f s ASP 145 Cb -0.08 -2.61 1.87 0.00 -0.30 0.00 0.00 42.92 41.80 3h7f s ASP 145 CO 0.18 -0.53 2.19 1.55 -0.17 0.00 0.00 175.17 178.39 3h7f h PRO 146 N 5.47 0.00 0.00 4.34 0.13 -1.97 -0.64 132.00 139.33 3h7f h PRO 146 Ca -0.45 0.00 -0.27 0.00 -0.87 0.00 0.00 66.00 64.42 3h7f h PRO 146 Cb 1.21 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.30 3h7f h PRO 146 CO 0.78 0.03 -1.49 0.00 -0.23 0.00 0.00 178.00 177.09 3h7f n ALA 147 N -2.15 0.85 0.08 -0.56 0.00 -1.26 -4.63 120.51 112.85 3h7f n ALA 147 Ca -0.02 -0.62 0.09 0.00 0.00 0.00 0.00 53.44 52.89 3h7f n ALA 147 Cb 0.18 -0.38 -0.03 0.00 0.00 0.00 0.00 19.45 19.22 3h7f n ALA 147 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3h7f n THR 148 N -4.41 0.74 -1.22 0.00 -2.24 -1.23 -4.97 114.28 100.95 3h7f n THR 148 Ca -0.35 -0.58 -0.07 0.00 -2.27 0.00 0.00 64.05 60.77 3h7f n THR 148 Cb 0.70 -0.42 -0.03 0.00 -2.10 0.00 0.00 70.33 68.47 3h7f n THR 148 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 3h7f n HIS 149 N -2.71 0.00 -4.08 4.78 -0.00 -0.25 -4.47 115.22 108.49 3h7f n HIS 149 Ca -0.03 0.00 -0.26 0.00 -0.00 0.00 0.00 57.72 57.44 3h7f n HIS 149 Cb 0.62 -1.83 -0.05 0.00 -0.00 0.00 0.00 29.99 28.73 3h7f n HIS 149 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 3h7f s LEU 150 N -1.71 3.83 -0.03 2.41 1.43 -1.26 -4.70 118.68 118.65 3h7f s LEU 150 Ca 0.00 -0.13 -0.30 0.00 -1.03 0.00 0.00 54.13 52.67 3h7f s LEU 150 Cb 0.00 -2.42 -0.05 0.00 0.03 0.00 0.00 46.19 43.75 3h7f s LEU 150 CO 0.00 0.05 1.45 -0.63 0.23 0.00 0.00 176.35 177.45 3h7f s ILE 151 N -1.81 3.74 -0.47 -0.59 1.01 -1.26 -0.86 121.20 120.96 3h7f s ILE 151 Ca 0.31 1.05 -0.16 0.00 0.00 0.00 0.00 60.65 61.85 3h7f s ILE 151 Cb -0.10 -3.67 0.06 0.00 0.01 0.00 0.00 42.46 38.75 3h7f s ILE 151 CO 0.24 -0.04 0.44 -0.62 0.00 0.00 0.00 174.94 174.96 3h7f s ASP 152 N 2.25 6.17 0.47 3.58 -1.08 -1.26 -4.98 116.67 121.81 3h7f s ASP 152 Ca 0.65 -1.11 0.25 0.00 -0.52 0.00 0.00 52.55 51.82 3h7f s ASP 152 Cb -0.31 -2.21 1.09 0.00 -1.46 0.00 0.00 42.92 40.04 3h7f s ASP 152 CO 0.26 -0.67 1.90 0.24 0.52 0.00 0.00 175.17 177.42 3h7f h MET 153 N 8.79 0.00 -0.69 4.34 2.86 -1.98 -1.47 114.93 126.78 3h7f h MET 153 Ca -0.28 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.31 3h7f h MET 153 Cb 1.11 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.74 3h7f h MET 153 CO 0.87 0.20 0.24 -0.44 1.06 0.00 0.00 176.91 178.83 3h7f h ASP 154 N 0.00 0.97 -0.11 1.22 3.32 -1.99 -0.80 116.42 119.03 3h7f h ASP 154 Ca -0.00 -0.16 -0.17 0.00 0.02 0.00 0.00 57.03 56.72 3h7f h ASP 154 Cb 0.62 -0.25 -0.00 0.00 0.22 0.00 0.00 39.33 39.91 3h7f h ASP 154 CO 0.03 0.89 -0.52 0.00 -1.72 0.00 0.00 179.24 177.92 3h7f h ALA 155 N 1.24 0.63 -0.53 3.45 0.00 -1.78 -2.39 119.26 119.87 3h7f h ALA 155 Ca 0.23 -0.50 -0.03 0.00 0.00 0.00 0.00 54.91 54.61 3h7f h ALA 155 Cb 0.25 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 3h7f h ALA 155 CO -0.01 0.68 0.21 0.28 0.00 0.00 0.00 179.25 180.41 3h7f h VAL 156 N 0.53 1.22 -0.42 0.00 2.07 -1.19 -2.36 116.25 116.11 3h7f h VAL 156 Ca 0.02 -0.68 -0.01 0.00 0.82 0.00 0.00 66.70 66.86 3h7f h VAL 156 Cb 1.09 0.67 -0.02 0.00 -1.52 0.00 0.00 31.29 31.50 3h7f h VAL 156 CO 0.11 0.26 0.24 -0.09 0.02 0.00 0.00 177.57 178.11 3h7f h ARG 157 N 0.72 0.58 -0.60 1.57 2.43 -1.11 -1.46 114.38 116.51 3h7f h ARG 157 Ca 0.18 -0.06 0.02 0.00 -0.81 0.00 0.00 59.98 59.31 3h7f h ARG 157 Cb 0.20 -0.12 -0.04 0.00 -0.42 0.00 0.00 29.97 29.59 3h7f h ARG 157 CO -0.01 0.45 0.37 0.00 -1.51 0.00 0.00 179.97 179.26 3h7f h ALA 158 N 1.10 0.77 -0.61 2.80 0.00 -1.33 -1.19 119.26 120.80 3h7f h ALA 158 Ca 0.15 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 3h7f h ALA 158 Cb 0.03 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 3h7f h ALA 158 CO -0.03 0.12 0.26 1.15 0.00 0.00 0.00 179.25 180.76 3h7f h THR 159 N 0.74 1.23 -0.55 0.00 2.02 -1.24 -2.62 112.91 112.49 3h7f h THR 159 Ca 0.23 -0.68 -0.09 0.00 0.77 0.00 0.00 66.41 66.65 3h7f h THR 159 Cb -0.01 0.54 -0.02 0.00 -1.74 0.00 0.00 68.15 66.92 3h7f h THR 159 CO -0.09 0.27 0.00 0.00 0.37 0.00 0.00 175.52 176.07 3h7f h ALA 160 N 1.10 0.96 -0.64 6.16 0.00 -0.91 -0.88 119.26 125.06 3h7f h ALA 160 Ca 0.20 -0.29 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 3h7f h ALA 160 Cb 0.18 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 3h7f h ALA 160 CO -0.02 0.63 0.28 -0.07 0.00 0.00 0.00 179.25 180.07 3h7f h LEU 161 N 0.87 0.83 -0.02 0.00 3.38 -1.12 -1.28 115.31 117.97 3h7f h LEU 161 Ca 0.16 -0.10 -0.07 0.00 0.09 0.00 0.00 57.88 57.96 3h7f h LEU 161 Cb 0.51 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.05 3h7f h LEU 161 CO 0.03 0.72 -0.28 -0.08 0.09 0.00 0.00 178.44 178.92 3h7f h GLU 162 N 0.91 0.23 0.00 1.13 4.81 -1.26 -3.37 114.58 117.02 3h7f h GLU 162 Ca 0.22 -0.21 -0.18 0.00 -0.13 0.00 0.00 59.36 59.05 3h7f h GLU 162 Cb 0.13 0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.54 3h7f h GLU 162 CO -0.03 0.91 -0.96 0.35 -0.73 0.00 0.00 179.01 178.55 3h7f h PHE 163 N -0.37 0.00 -6.16 0.92 3.57 -1.16 -3.49 116.94 110.24 3h7f h PHE 163 Ca -0.03 0.00 -0.39 0.00 3.53 0.00 0.00 57.97 61.08 3h7f h PHE 163 Cb 0.98 0.00 0.08 0.00 2.79 0.00 0.00 35.95 39.80 3h7f h PHE 163 CO 0.16 0.82 -0.86 0.54 -2.23 0.00 0.00 178.31 176.74 3h7f n ARG 164 N -3.24 -1.28 -1.81 1.11 1.74 -0.49 -4.97 116.66 107.72 3h7f n ARG 164 Ca -0.02 0.60 -0.33 0.00 -0.77 0.00 0.00 57.85 57.33 3h7f n ARG 164 Cb 0.88 -4.16 0.04 0.00 -1.02 0.00 0.00 32.46 28.20 3h7f n ARG 164 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 3h7f s PRO 165 N -5.52 2.87 0.10 5.56 0.04 -1.26 -4.88 135.00 131.91 3h7f s PRO 165 Ca 0.38 1.39 -0.04 0.00 0.04 0.00 0.00 61.00 62.78 3h7f s PRO 165 Cb -0.13 -1.96 -0.20 0.00 0.04 0.00 0.00 34.50 32.25 3h7f s PRO 165 CO 0.85 -1.20 1.21 -0.22 0.04 0.00 0.00 177.00 177.69 3h7f h LYS 166 N 0.13 0.31 -3.96 4.56 1.63 -1.27 -3.40 116.57 114.57 3h7f h LYS 166 Ca -0.47 -0.44 -0.37 0.00 -0.85 0.00 0.00 60.65 58.52 3h7f h LYS 166 Cb 1.25 0.15 -0.33 0.00 -0.60 0.00 0.00 32.23 32.69 3h7f h LYS 166 CO 0.54 1.16 -0.76 0.08 -3.45 0.00 0.00 179.45 177.03 3h7f s VAL 167 N -2.89 0.39 -0.17 2.00 1.01 -1.15 -1.25 120.40 118.35 3h7f s VAL 167 Ca -0.04 -0.07 -0.06 0.00 0.00 0.00 0.00 61.98 61.81 3h7f s VAL 167 Cb 0.08 -0.42 -0.04 0.00 0.00 0.00 0.00 36.38 36.00 3h7f s VAL 167 CO 0.87 0.18 0.02 -0.63 0.00 0.00 0.00 175.10 175.55 3h7f s ILE 168 N 0.77 4.44 -0.24 2.22 1.01 -0.34 -1.99 121.20 127.08 3h7f s ILE 168 Ca -0.09 -0.16 -0.11 0.00 0.00 0.00 0.00 60.65 60.29 3h7f s ILE 168 Cb -0.12 -2.98 -0.05 0.00 0.01 0.00 0.00 42.46 39.32 3h7f s ILE 168 CO -0.00 0.48 0.18 -0.63 0.00 0.00 0.00 174.94 174.96 3h7f s ILE 169 N 0.33 5.34 -0.22 2.92 1.01 -0.26 -1.43 121.20 128.90 3h7f s ILE 169 Ca 0.00 0.21 -0.07 0.00 0.00 0.00 0.00 60.65 60.79 3h7f s ILE 169 Cb -0.13 -3.52 -0.03 0.00 0.01 0.00 0.00 42.46 38.79 3h7f s ILE 169 CO 0.01 0.33 0.07 0.00 0.00 0.00 0.00 174.94 175.35 3h7f s ALA 170 N 1.16 3.26 0.00 9.38 0.00 -0.54 -4.42 121.76 130.60 3h7f s ALA 170 Ca 0.08 -0.96 0.00 0.00 0.00 0.00 0.00 51.96 51.08 3h7f s ALA 170 Cb -0.14 -2.00 0.00 0.00 0.00 0.00 0.00 23.12 20.98 3h7f s ALA 170 CO 0.05 -0.18 0.00 0.41 0.00 0.00 0.00 175.76 176.04 3h7f n GLY 171 N 4.30 2.70 3.44 0.00 0.00 -1.26 -1.47 105.19 112.90 3h7f n GLY 171 Ca -0.16 -1.15 -0.12 0.00 0.00 0.00 0.00 46.02 44.59 3h7f n GLY 171 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 3h7f s TRP 172 N -2.00 -0.53 -0.04 1.61 1.48 -1.26 -4.72 118.94 113.48 3h7f s TRP 172 Ca 0.00 0.41 0.15 0.00 -1.06 0.00 0.00 56.10 55.59 3h7f s TRP 172 Cb 0.00 0.54 -0.22 0.00 -1.16 0.00 0.00 33.47 32.63 3h7f s TRP 172 CO 0.00 -0.78 0.28 0.43 -4.06 0.00 0.00 176.95 172.82 3h7f n SER 173 N -0.21 1.59 -3.19 -2.66 7.64 -0.10 -4.52 113.62 112.17 3h7f n SER 173 Ca -0.16 0.00 -0.15 0.00 1.01 0.00 0.00 58.87 59.56 3h7f n SER 173 Cb 0.64 1.54 -0.05 0.00 -1.01 0.00 0.00 64.21 65.33 3h7f n SER 173 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3h7f s ALA 174 N -2.92 -0.46 -0.08 -0.43 0.00 -0.93 -5.01 121.76 111.94 3h7f s ALA 174 Ca -0.06 -1.21 -0.06 0.00 0.00 0.00 0.00 51.96 50.63 3h7f s ALA 174 Cb 0.09 -2.14 0.03 0.00 0.00 0.00 0.00 23.12 21.09 3h7f s ALA 174 CO 0.61 -2.13 0.19 -0.47 0.00 0.00 0.00 175.76 173.97 3h7f s TYR 175 N 0.86 -0.22 -1.63 0.00 5.04 -1.26 -4.35 117.35 115.79 3h7f s TYR 175 Ca 0.26 0.56 0.21 0.00 -2.44 0.00 0.00 57.07 55.65 3h7f s TYR 175 Cb -0.04 0.04 0.66 0.00 0.35 0.00 0.00 41.96 42.97 3h7f s TYR 175 CO -0.09 -0.14 1.56 -0.35 -1.34 0.00 0.00 175.55 175.20 3h7f n PRO 176 N 3.40 3.09 -4.43 4.97 -0.04 -1.26 -4.98 135.00 135.75 3h7f n PRO 176 Ca -0.17 -2.72 -0.23 0.00 -0.04 0.00 0.00 63.50 60.33 3h7f n PRO 176 Cb 0.57 -1.67 -0.08 0.00 -0.04 0.00 0.00 33.50 32.27 3h7f n PRO 176 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 3h7f s ARG 177 N -1.30 1.85 -0.22 0.54 1.81 -1.26 -1.72 118.95 118.65 3h7f s ARG 177 Ca 0.49 -2.11 -0.19 0.00 -1.72 0.00 0.00 55.73 52.20 3h7f s ARG 177 Cb 0.28 -0.31 -0.03 0.00 -0.45 0.00 0.00 34.95 34.44 3h7f s ARG 177 CO 0.30 -0.52 0.55 0.08 -0.68 0.00 0.00 175.30 175.02 3h7f s VAL 178 N -3.32 5.07 0.38 3.52 1.01 -1.26 -4.93 120.40 120.87 3h7f s VAL 178 Ca 0.29 1.00 -0.27 0.00 0.00 0.00 0.00 61.98 63.00 3h7f s VAL 178 Cb 0.03 -3.87 -0.10 0.00 0.00 0.00 0.00 36.38 32.44 3h7f s VAL 178 CO 0.18 0.13 1.35 -0.76 0.00 0.00 0.00 175.10 176.00 3h7f s LEU 179 N 1.94 4.29 -0.95 3.92 1.43 -1.26 -4.99 118.68 123.05 3h7f s LEU 179 Ca 0.24 2.76 -0.18 0.00 -1.03 0.00 0.00 54.13 55.93 3h7f s LEU 179 Cb -0.16 -3.79 0.14 0.00 0.03 0.00 0.00 46.19 42.41 3h7f s LEU 179 CO 0.09 -0.79 1.15 -0.62 0.23 0.00 0.00 176.35 176.41 3h7f s ASP 180 N -0.53 6.68 0.34 2.29 -1.08 -1.26 -4.91 116.67 118.19 3h7f s ASP 180 Ca 0.54 -2.16 0.06 0.00 -0.52 0.00 0.00 52.55 50.48 3h7f s ASP 180 Cb -0.41 -2.39 0.63 0.00 -1.46 0.00 0.00 42.92 39.29 3h7f s ASP 180 CO 0.53 -1.02 1.86 -0.26 0.52 0.00 0.00 175.17 176.80 3h7f h PHE 181 N 8.64 0.42 -0.68 -5.34 0.04 -1.95 -2.52 116.94 115.55 3h7f h PHE 181 Ca 0.17 -0.05 -0.08 0.00 2.80 0.00 0.00 57.97 60.81 3h7f h PHE 181 Cb 1.01 -0.12 -0.03 0.00 2.20 0.00 0.00 35.95 39.02 3h7f h PHE 181 CO 1.16 0.50 0.12 0.00 -0.60 0.00 0.00 178.31 179.49 3h7f h ALA 182 N 1.52 0.90 -0.51 2.45 0.00 -1.96 -1.83 119.26 119.82 3h7f h ALA 182 Ca 0.07 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.67 3h7f h ALA 182 Cb 0.42 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 3h7f h ALA 182 CO 0.02 0.66 0.15 0.00 0.00 0.00 0.00 179.25 180.08 3h7f h ALA 183 N 1.06 0.68 -0.90 0.00 0.00 -1.95 -2.20 119.26 115.95 3h7f h ALA 183 Ca 0.21 -0.20 0.03 0.00 0.00 0.00 0.00 54.91 54.95 3h7f h ALA 183 Cb 0.43 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 17.97 3h7f h ALA 183 CO 0.01 0.35 0.59 0.74 0.00 0.00 0.00 179.25 180.94 3h7f h PHE 184 N 0.71 1.10 -0.19 0.00 0.04 -1.20 -2.20 116.94 115.19 3h7f h PHE 184 Ca 0.16 0.03 0.01 0.00 2.80 0.00 0.00 57.97 60.97 3h7f h PHE 184 Cb 0.30 -0.37 -0.01 0.00 2.20 0.00 0.00 35.95 38.07 3h7f h PHE 184 CO 0.02 0.63 0.10 -0.09 -0.60 0.00 0.00 178.31 178.37 3h7f h ARG 185 N 1.14 0.21 -0.42 1.51 9.65 -1.26 -0.87 114.38 124.34 3h7f h ARG 185 Ca 0.36 -0.01 0.04 0.00 -1.10 0.00 0.00 59.98 59.27 3h7f h ARG 185 Cb 0.00 -0.05 -0.04 0.00 -1.39 0.00 0.00 29.97 28.49 3h7f h ARG 185 CO -0.12 0.14 0.18 1.03 2.80 0.00 0.00 179.97 184.00 3h7f h SER 186 N 0.22 0.23 -0.15 -3.80 0.87 -1.18 -0.61 113.55 109.12 3h7f h SER 186 Ca 0.08 0.04 -0.01 0.00 -1.23 0.00 0.00 61.79 60.67 3h7f h SER 186 Cb 0.01 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 61.96 3h7f h SER 186 CO -0.05 0.17 0.07 0.40 -0.53 0.00 0.00 176.83 176.89 3h7f h ILE 187 N 0.37 1.12 -0.48 2.23 2.04 -1.30 -1.11 117.51 120.39 3h7f h ILE 187 Ca 0.19 -0.35 0.05 0.00 1.00 0.00 0.00 64.86 65.75 3h7f h ILE 187 Cb 0.14 1.09 -0.05 0.00 -0.74 0.00 0.00 36.82 37.27 3h7f h ILE 187 CO -0.17 0.11 0.20 0.00 0.00 0.00 0.00 178.15 178.30 3h7f h ALA 188 N 0.94 0.59 -0.83 1.87 0.00 -0.98 -2.38 119.26 118.49 3h7f h ALA 188 Ca 0.05 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 3h7f h ALA 188 Cb 0.12 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.86 3h7f h ALA 188 CO -0.01 -0.17 0.40 -0.44 0.00 0.00 0.00 179.25 179.03 3h7f h ASP 189 N 0.41 1.08 -0.45 0.00 3.32 -0.98 -0.55 116.42 119.23 3h7f h ASP 189 Ca 0.22 -0.13 0.00 0.00 0.02 0.00 0.00 57.03 57.14 3h7f h ASP 189 Cb 0.18 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.43 3h7f h ASP 189 CO -0.19 0.90 0.28 -0.08 -1.72 0.00 0.00 179.24 178.44 3h7f h GLU 190 N 1.18 0.60 -0.19 3.56 4.81 -0.88 -3.16 114.58 120.50 3h7f h GLU 190 Ca 0.28 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.47 3h7f h GLU 190 Cb 0.11 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.36 3h7f h GLU 190 CO -0.04 0.42 0.00 1.33 -0.73 0.00 0.00 179.01 179.99 3h7f n VAL 191 N -4.75 0.23 -2.63 0.32 0.24 -0.92 -4.98 118.33 105.84 3h7f n VAL 191 Ca 0.01 -0.56 -0.13 0.00 -2.04 0.00 0.00 64.34 61.63 3h7f n VAL 191 Cb 0.04 1.07 0.02 0.00 -1.47 0.00 0.00 33.84 33.50 3h7f n VAL 191 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3h7f n GLY 192 N 1.38 -0.02 3.95 7.63 0.00 -0.39 -4.91 105.19 112.82 3h7f n GLY 192 Ca 0.17 -0.28 -0.24 0.00 0.00 0.00 0.00 46.02 45.67 3h7f n GLY 192 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h7f s ALA 193 N -2.86 3.85 0.30 4.61 0.00 -0.35 -4.93 121.76 122.37 3h7f s ALA 193 Ca 0.15 -1.01 -0.13 0.00 0.00 0.00 0.00 51.96 50.97 3h7f s ALA 193 Cb -0.07 -1.91 -0.08 0.00 0.00 0.00 0.00 23.12 21.06 3h7f s ALA 193 CO 0.19 0.26 0.67 0.15 0.00 0.00 0.00 175.76 177.03 3h7f s LYS 194 N -3.80 3.91 -0.25 0.00 -0.14 -0.38 -4.55 119.74 114.54 3h7f s LYS 194 Ca 0.37 0.51 -0.01 0.00 -1.36 0.00 0.00 55.97 55.48 3h7f s LYS 194 Cb -0.10 -2.50 0.03 0.00 -1.68 0.00 0.00 37.83 33.58 3h7f s LYS 194 CO 0.31 0.19 -0.06 -1.17 -0.76 0.00 0.00 175.35 173.87 3h7f s LEU 195 N -3.00 3.28 -0.26 3.17 2.96 -1.26 -1.20 118.68 122.37 3h7f s LEU 195 Ca 0.52 -0.94 -0.10 0.00 -0.22 0.00 0.00 54.13 53.39 3h7f s LEU 195 Cb -0.11 -1.66 -0.04 0.00 0.50 0.00 0.00 46.19 44.88 3h7f s LEU 195 CO 0.20 -0.14 0.15 -0.22 -1.32 0.00 0.00 176.35 175.01 3h7f s LEU 196 N 1.31 3.90 -0.26 -0.68 2.96 -0.51 -1.66 118.68 123.74 3h7f s LEU 196 Ca -0.01 -0.02 -0.11 0.00 -0.22 0.00 0.00 54.13 53.77 3h7f s LEU 196 Cb -0.17 -2.06 -0.05 0.00 0.50 0.00 0.00 46.19 44.41 3h7f s LEU 196 CO -0.04 -0.01 0.21 -0.69 -1.32 0.00 0.00 176.35 174.50 3h7f s VAL 197 N 1.48 5.31 -0.63 1.68 1.01 -0.86 -1.47 120.40 126.91 3h7f s VAL 197 Ca 0.07 0.23 -0.17 0.00 0.00 0.00 0.00 61.98 62.11 3h7f s VAL 197 Cb -0.15 -3.55 0.14 0.00 0.00 0.00 0.00 36.38 32.82 3h7f s VAL 197 CO 0.07 0.27 0.65 -0.62 0.00 0.00 0.00 175.10 175.47 3h7f s ASP 198 N 1.52 6.32 -0.12 3.32 -1.08 -0.54 -1.59 116.67 124.50 3h7f s ASP 198 Ca 0.08 -1.86 0.13 0.00 -0.52 0.00 0.00 52.55 50.38 3h7f s ASP 198 Cb -0.15 -2.25 0.59 0.00 -1.46 0.00 0.00 42.92 39.65 3h7f s ASP 198 CO 0.09 -0.90 1.45 1.15 0.52 0.00 0.00 175.17 177.48 3h7f n MET 199 N 5.41 3.46 -0.26 4.34 0.00 -0.58 -4.13 117.12 125.37 3h7f n MET 199 Ca -0.05 -2.30 0.01 0.00 0.00 0.00 0.00 57.70 55.36 3h7f n MET 199 Cb 0.43 -1.88 0.08 0.00 0.00 0.00 0.00 33.22 31.85 3h7f n MET 199 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 3h7f h ALA 200 N 3.71 0.48 -0.33 3.17 0.00 -1.90 -1.10 119.26 123.28 3h7f h ALA 200 Ca 0.00 0.29 -0.12 0.00 0.00 0.00 0.00 54.91 55.07 3h7f h ALA 200 Cb 1.36 0.58 -0.01 0.00 0.00 0.00 0.00 17.79 19.72 3h7f h ALA 200 CO 0.26 -0.42 -0.30 0.45 0.00 0.00 0.00 179.25 179.24 3h7f h HIS 201 N -0.01 0.82 -0.39 0.00 3.86 -1.85 -3.35 115.15 114.23 3h7f h HIS 201 Ca 0.36 -0.21 0.00 0.00 -1.16 0.00 0.00 60.37 59.36 3h7f h HIS 201 Cb 0.55 -0.19 0.00 0.00 1.06 0.00 0.00 27.41 28.83 3h7f h HIS 201 CO -0.60 0.92 0.00 1.97 0.86 0.00 0.00 177.93 181.08 3h7f n PHE 202 N -4.08 0.55 -0.25 2.45 1.16 -0.67 -3.85 117.46 112.77 3h7f n PHE 202 Ca -0.01 -0.51 0.02 0.00 -1.87 0.00 0.00 57.45 55.08 3h7f n PHE 202 Cb 0.47 -0.04 0.25 0.00 -1.61 0.00 0.00 39.48 38.55 3h7f n PHE 202 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 3h7f h ALA 203 N 2.31 1.50 -0.13 1.98 0.00 -1.37 -2.12 119.26 121.44 3h7f h ALA 203 Ca 0.00 -0.04 -0.12 0.00 0.00 0.00 0.00 54.91 54.75 3h7f h ALA 203 Cb 0.79 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 3h7f h ALA 203 CO 0.01 0.41 -0.45 0.78 0.00 0.00 0.00 179.25 180.00 3h7f h GLY 204 N 1.01 0.33 0.95 0.00 0.00 -1.84 -1.14 103.07 102.38 3h7f h GLY 204 Ca 0.33 -0.34 -0.02 0.00 0.00 0.00 0.00 47.33 47.30 3h7f h GLY 204 CO -0.10 0.31 0.18 1.41 0.00 0.00 0.00 176.54 178.34 3h7f h LEU 205 N 0.25 0.55 -0.36 3.11 3.38 -1.70 -2.72 115.31 117.83 3h7f h LEU 205 Ca 0.02 -0.14 0.01 0.00 0.09 0.00 0.00 57.88 57.86 3h7f h LEU 205 Cb 0.90 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.48 3h7f h LEU 205 CO 0.07 0.54 0.21 0.58 0.09 0.00 0.00 178.44 179.94 3h7f h VAL 206 N 0.52 1.04 -0.88 1.22 2.07 -1.26 -0.87 116.25 118.09 3h7f h VAL 206 Ca 0.14 -0.15 0.10 0.00 0.82 0.00 0.00 66.70 67.61 3h7f h VAL 206 Cb 0.15 0.58 -0.06 0.00 -1.52 0.00 0.00 31.29 30.43 3h7f h VAL 206 CO -0.02 0.08 0.57 0.00 0.02 0.00 0.00 177.57 178.22 3h7f h ALA 207 N 1.16 1.67 -0.01 1.67 0.00 -1.11 -1.63 119.26 121.01 3h7f h ALA 207 Ca 0.14 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.05 3h7f h ALA 207 Cb -0.00 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.60 3h7f h ALA 207 CO -0.06 0.14 -0.01 0.00 0.00 0.00 0.00 179.25 179.31 3h7f n ALA 208 N -2.41 2.65 -1.12 0.00 0.00 -1.04 -4.89 120.51 113.71 3h7f n ALA 208 Ca 0.15 -0.30 -0.04 0.00 0.00 0.00 0.00 53.44 53.25 3h7f n ALA 208 Cb 0.33 -1.37 -0.02 0.00 0.00 0.00 0.00 19.45 18.39 3h7f n ALA 208 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h7f n GLY 209 N 1.10 0.70 0.65 0.00 0.00 -0.61 -4.96 105.19 102.07 3h7f n GLY 209 Ca 0.21 -0.63 0.07 0.00 0.00 0.00 0.00 46.02 45.67 3h7f n GLY 209 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3h7f n LEU 210 N -0.47 2.48 -3.83 0.99 4.77 -0.35 -4.88 117.00 115.70 3h7f n LEU 210 Ca -0.04 -1.29 -0.13 0.00 -0.03 0.00 0.00 56.01 54.52 3h7f n LEU 210 Cb 0.17 -0.09 -0.15 0.00 -2.33 0.00 0.00 43.42 41.02 3h7f n LEU 210 CO 0.06 0.52 -0.35 -2.28 -1.33 0.00 0.00 177.39 174.01 3h7f s HIS 211 N -1.14 0.01 0.44 -1.77 2.46 -1.17 -4.92 115.29 109.20 3h7f s HIS 211 Ca 0.21 0.06 -0.25 0.00 0.47 0.00 0.00 55.06 55.55 3h7f s HIS 211 Cb 0.13 -0.09 -0.09 0.00 -0.13 0.00 0.00 32.58 32.40 3h7f s HIS 211 CO 0.19 -0.04 1.31 -2.30 -2.47 0.00 0.00 174.74 171.42 3h7f n PRO 212 N 3.49 1.96 -2.68 2.88 -0.02 -1.26 -4.34 135.00 135.04 3h7f n PRO 212 Ca -0.18 0.70 -0.41 0.00 -2.02 0.00 0.00 63.50 61.59 3h7f n PRO 212 Cb 0.56 -2.45 -0.05 0.00 -0.02 0.00 0.00 33.50 31.55 3h7f n PRO 212 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3h7f s SER 213 N -0.56 7.49 0.17 2.55 0.15 -1.26 -4.93 113.70 117.31 3h7f s SER 213 Ca 0.62 1.93 0.27 0.00 0.70 0.00 0.00 55.95 59.47 3h7f s SER 213 Cb -0.49 -2.60 0.90 0.00 -1.71 0.00 0.00 66.02 62.12 3h7f s SER 213 CO 0.57 -0.02 1.81 -0.81 1.20 0.00 0.00 173.24 175.98 3h7f n PRO 214 N 2.17 0.21 -0.36 5.44 -0.04 -1.26 -4.45 135.00 136.70 3h7f n PRO 214 Ca 0.01 0.17 -0.03 0.00 -0.04 0.00 0.00 63.50 63.61 3h7f n PRO 214 Cb 0.48 -1.74 0.10 0.00 -0.04 0.00 0.00 33.50 32.29 3h7f n PRO 214 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 3h7f h VAL 215 N 0.00 1.25 0.00 0.52 2.07 -1.92 -1.31 116.25 116.85 3h7f h VAL 215 Ca 0.00 -0.46 -0.01 0.00 0.82 0.00 0.00 66.70 67.05 3h7f h VAL 215 Cb 0.69 -0.17 -0.00 0.00 -1.52 0.00 0.00 31.29 30.29 3h7f h VAL 215 CO 0.00 0.24 -0.06 -0.65 0.02 0.00 0.00 177.57 177.12 3h7f h PRO 216 N 1.31 0.00 0.00 1.57 0.11 -1.92 -3.30 132.00 129.77 3h7f h PRO 216 Ca 0.35 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 66.31 3h7f h PRO 216 Cb -0.14 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 30.94 3h7f h PRO 216 CO -0.08 0.06 -2.01 0.72 -0.21 0.00 0.00 178.00 176.48 3h7f n HIS 217 N -3.44 0.00 -3.63 0.65 8.25 -0.67 -5.02 115.22 111.35 3h7f n HIS 217 Ca -0.02 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 57.13 3h7f n HIS 217 Cb 0.19 -0.63 -0.05 0.00 1.12 0.00 0.00 29.99 30.63 3h7f n HIS 217 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3h7f s ALA 218 N -2.89 3.76 0.03 -1.41 0.00 -0.59 -4.73 121.76 115.94 3h7f s ALA 218 Ca -0.08 -0.55 -0.21 0.00 0.00 0.00 0.00 51.96 51.12 3h7f s ALA 218 Cb 0.09 -2.16 -0.15 0.00 0.00 0.00 0.00 23.12 20.90 3h7f s ALA 218 CO 0.75 0.62 1.34 -0.44 0.00 0.00 0.00 175.76 178.02 3h7f h ASP 219 N 2.68 0.35 -4.54 0.00 3.32 -1.67 -3.42 116.42 113.14 3h7f h ASP 219 Ca -0.46 -0.48 -0.19 0.00 0.02 0.00 0.00 57.03 55.92 3h7f h ASP 219 Cb 1.17 -0.10 -0.23 0.00 0.22 0.00 0.00 39.33 40.39 3h7f h ASP 219 CO 0.72 0.76 -0.67 -0.69 -1.72 0.00 0.00 179.24 177.63 3h7f s VAL 220 N -4.29 0.07 -0.11 -1.35 1.01 -1.17 -1.87 120.40 112.68 3h7f s VAL 220 Ca -0.14 -0.56 0.00 0.00 0.00 0.00 0.00 61.98 61.28 3h7f s VAL 220 Cb 0.05 -0.20 0.02 0.00 0.00 0.00 0.00 36.38 36.25 3h7f s VAL 220 CO 0.75 -0.31 -0.10 -0.69 0.00 0.00 0.00 175.10 174.75 3h7f s VAL 221 N -0.93 1.14 0.13 2.92 1.01 0.09 -2.03 120.40 122.73 3h7f s VAL 221 Ca -0.10 -0.39 0.03 0.00 0.00 0.00 0.00 61.98 61.52 3h7f s VAL 221 Cb -0.06 -1.11 -0.04 0.00 0.00 0.00 0.00 36.38 35.17 3h7f s VAL 221 CO -0.00 0.38 0.18 -0.94 0.00 0.00 0.00 175.10 174.71 3h7f s SER 222 N 1.44 5.88 0.15 3.32 1.04 -0.62 -1.31 113.70 123.60 3h7f s SER 222 Ca 0.01 0.04 -0.23 0.00 0.48 0.00 0.00 55.95 56.25 3h7f s SER 222 Cb -0.13 -1.66 0.07 0.00 0.10 0.00 0.00 66.02 64.39 3h7f s SER 222 CO -0.06 0.10 0.59 0.28 0.98 0.00 0.00 173.24 175.13 3h7f s THR 223 N -1.63 0.00 0.42 2.02 -1.32 -0.58 -1.52 115.64 113.03 3h7f s THR 223 Ca 0.32 -0.04 -0.19 0.00 -1.21 0.00 0.00 61.69 60.58 3h7f s THR 223 Cb -0.11 -1.01 -0.10 0.00 -1.51 0.00 0.00 72.50 69.77 3h7f s THR 223 CO 0.25 -0.02 0.91 0.42 -2.21 0.00 0.00 174.62 173.97 3h7f s THR 224 N -3.61 4.48 -0.06 5.08 -4.23 -1.26 -1.39 115.64 114.65 3h7f s THR 224 Ca 0.00 1.31 0.14 0.00 -1.18 0.00 0.00 61.69 61.96 3h7f s THR 224 Cb -0.01 -3.63 -0.18 0.00 1.34 0.00 0.00 72.50 70.03 3h7f s THR 224 CO -0.12 -0.37 0.83 0.58 -0.54 0.00 0.00 174.62 175.01 3h7f h VAL 225 N 1.71 0.82 -2.97 2.29 2.07 -1.49 -3.46 116.25 115.22 3h7f h VAL 225 Ca -0.48 -2.50 -0.57 0.00 0.82 0.00 0.00 66.70 63.97 3h7f h VAL 225 Cb 1.18 2.33 -0.04 0.00 -1.52 0.00 0.00 31.29 33.24 3h7f h VAL 225 CO 0.62 0.47 1.14 -1.38 0.02 0.00 0.00 177.57 178.44 3h7f s HIS 226 N -2.75 2.16 0.09 1.57 -3.43 -1.23 -0.97 115.29 110.74 3h7f s HIS 226 Ca -0.03 0.64 0.05 0.00 -0.80 0.00 0.00 55.06 54.93 3h7f s HIS 226 Cb 0.08 -4.16 0.18 0.00 -1.43 0.00 0.00 32.58 27.25 3h7f s HIS 226 CO 0.81 -2.47 0.22 0.25 -2.00 0.00 0.00 174.74 171.55 3h7f n THR 228 N 7.02 0.00 0.30 -5.38 -2.24 -1.25 -4.50 114.28 108.24 3h7f n THR 228 Ca 0.19 0.21 0.17 0.00 -2.27 0.00 0.00 64.05 62.35 3h7f n THR 228 Cb 0.47 -0.37 0.97 0.00 -2.10 0.00 0.00 70.33 69.30 3h7f n THR 228 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 3h7f h LEU 229 N 0.00 0.00 0.00 3.22 5.85 -1.86 -3.38 115.31 119.14 3h7f h LEU 229 Ca 0.10 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.82 3h7f h LEU 229 Cb 0.50 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.53 3h7f h LEU 229 CO -0.00 0.02 0.00 0.61 -0.34 0.00 0.00 178.44 178.73 3h7f n GLY 230 N -1.05 0.54 0.00 3.75 0.00 -1.19 -4.89 105.19 102.34 3h7f n GLY 230 Ca -0.03 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.65 3h7f n GLY 230 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h7f n GLY 231 N -2.85 2.28 3.80 -0.02 0.00 -0.14 -4.57 105.19 103.69 3h7f n GLY 231 Ca 0.00 -2.12 -0.33 0.00 0.00 0.00 0.00 46.02 43.57 3h7f n GLY 231 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3h7f s GLY 232 N -1.71 2.24 -0.25 -0.02 0.00 -1.26 -3.81 107.32 102.51 3h7f s GLY 232 Ca 0.00 0.47 -0.29 0.00 0.00 0.00 0.00 44.72 44.90 3h7f s GLY 232 CO 0.00 0.79 1.83 -1.60 0.00 0.00 0.00 173.10 174.12 3h7f s ARG 233 N -3.84 3.51 0.00 2.90 3.52 -1.26 -3.56 118.95 120.21 3h7f s ARG 233 Ca 0.65 1.71 0.00 0.00 -0.13 0.00 0.00 55.73 57.96 3h7f s ARG 233 Cb -0.17 -4.18 0.00 0.00 -1.56 0.00 0.00 34.95 29.05 3h7f s ARG 233 CO 0.33 -1.65 0.00 -1.13 -0.81 0.00 0.00 175.30 172.03 3h7f n SER 234 N 9.74 0.00 -4.71 -2.12 3.41 -1.26 -4.89 113.62 113.80 3h7f n SER 234 Ca 0.23 0.00 -0.29 0.00 -0.26 0.00 0.00 58.87 58.54 3h7f n SER 234 Cb 0.45 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 64.32 3h7f n SER 234 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 3h7f s GLY 235 N 0.00 2.69 -0.11 5.00 0.00 -0.77 -1.45 107.32 112.67 3h7f s GLY 235 Ca 0.00 -1.44 -0.26 0.00 0.00 0.00 0.00 44.72 43.01 3h7f s GLY 235 CO 0.00 -2.11 0.63 -2.27 0.00 0.00 0.00 173.10 169.36 3h7f s LEU 236 N -3.84 -0.45 -0.04 0.66 2.96 -0.48 -4.22 118.68 113.28 3h7f s LEU 236 Ca 0.24 0.86 0.04 0.00 -0.22 0.00 0.00 54.13 55.05 3h7f s LEU 236 Cb 0.05 2.31 -0.00 0.00 0.50 0.00 0.00 46.19 49.05 3h7f s LEU 236 CO 0.13 -0.46 -0.14 -0.63 -1.32 0.00 0.00 176.35 173.93 3h7f s ILE 237 N -0.67 1.19 0.14 6.68 1.01 -0.74 -1.53 121.20 127.28 3h7f s ILE 237 Ca -0.07 -0.58 0.04 0.00 0.00 0.00 0.00 60.65 60.03 3h7f s ILE 237 Cb -0.02 -1.03 -0.04 0.00 0.01 0.00 0.00 42.46 41.37 3h7f s ILE 237 CO 0.06 0.35 -0.09 0.68 0.00 0.00 0.00 174.94 175.94 3h7f s VAL 238 N 0.09 1.06 -1.61 2.92 -7.23 -0.42 -0.82 120.40 114.39 3h7f s VAL 238 Ca -0.03 -2.03 0.00 0.00 -1.81 0.00 0.00 61.98 58.10 3h7f s VAL 238 Cb -0.10 -1.83 0.00 0.00 0.56 0.00 0.00 36.38 35.01 3h7f s VAL 238 CO 0.01 -0.76 0.00 0.61 -0.31 0.00 0.00 175.10 174.66 3h7f n GLY 239 N -0.17 -0.85 3.77 2.32 0.00 -0.84 -0.73 105.19 108.69 3h7f n GLY 239 Ca -0.10 -0.83 -0.38 0.00 0.00 0.00 0.00 46.02 44.70 3h7f n GLY 239 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h7f s LYS 240 N -0.65 4.18 0.49 1.61 -0.14 -0.78 -1.76 119.74 122.69 3h7f s LYS 240 Ca 0.00 1.68 0.14 0.00 -1.36 0.00 0.00 55.97 56.43 3h7f s LYS 240 Cb 0.00 -2.68 1.15 0.00 -1.68 0.00 0.00 37.83 34.62 3h7f s LYS 240 CO 0.00 -0.16 2.11 0.37 -0.76 0.00 0.00 175.35 176.90 3h7f h GLN 241 N 2.73 0.17 -1.07 1.68 5.75 -1.91 -2.22 115.11 120.24 3h7f h GLN 241 Ca -0.48 -0.01 0.36 0.00 -0.15 0.00 0.00 58.65 58.37 3h7f h GLN 241 Cb 1.22 -0.04 -0.15 0.00 1.07 0.00 0.00 27.48 29.59 3h7f h GLN 241 CO 0.63 0.11 0.63 0.37 -2.65 0.00 0.00 178.83 177.92 3h7f h GLN 242 N 0.18 0.21 -0.06 1.69 4.15 -1.96 -1.86 115.11 117.45 3h7f h GLN 242 Ca 0.07 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.48 3h7f h GLN 242 Cb 0.06 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 27.70 3h7f h GLN 242 CO -0.01 0.14 0.00 0.66 -1.93 0.00 0.00 178.83 177.69 3h7f n TYR 243 N -5.00 0.04 -0.03 3.99 4.01 -0.84 -4.67 117.16 114.67 3h7f n TYR 243 Ca 0.34 -0.02 -0.10 0.00 -0.16 0.00 0.00 57.90 57.95 3h7f n TYR 243 Cb 1.13 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 40.12 3h7f n TYR 243 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3h7f h ALA 244 N 4.65 0.21 -0.48 -0.72 0.00 -1.40 -1.64 119.26 119.88 3h7f h ALA 244 Ca 0.00 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 3h7f h ALA 244 Cb 0.94 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 3h7f h ALA 244 CO 0.00 -0.29 0.10 -0.22 0.00 0.00 0.00 179.25 178.84 3h7f h LYS 245 N 0.20 0.78 -0.52 0.00 3.64 -1.83 -1.34 116.57 117.51 3h7f h LYS 245 Ca 0.06 -0.20 -0.06 0.00 -1.27 0.00 0.00 60.65 59.19 3h7f h LYS 245 Cb 0.01 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 31.71 3h7f h LYS 245 CO -0.01 0.78 0.11 0.00 -2.27 0.00 0.00 179.45 178.05 3h7f h ALA 246 N 0.97 0.68 -0.17 5.00 0.00 -1.86 -2.38 119.26 121.50 3h7f h ALA 246 Ca 0.15 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 3h7f h ALA 246 Cb 0.36 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 3h7f h ALA 246 CO 0.01 0.40 -0.05 0.82 0.00 0.00 0.00 179.25 180.42 3h7f h ILE 247 N 0.72 1.29 -0.32 0.00 1.08 -1.18 -1.39 117.51 117.71 3h7f h ILE 247 Ca 0.16 -1.04 0.06 0.00 -0.39 0.00 0.00 64.86 63.64 3h7f h ILE 247 Cb 0.36 1.63 -0.05 0.00 -3.07 0.00 0.00 36.82 35.69 3h7f h ILE 247 CO 0.01 0.31 0.01 0.78 -0.69 0.00 0.00 178.15 178.56 3h7f h ASN 248 N 0.04 -0.11 -0.22 1.72 2.35 -1.26 -2.14 115.58 115.97 3h7f h ASN 248 Ca 0.04 0.07 -0.05 0.00 -0.55 0.00 0.00 56.30 55.82 3h7f h ASN 248 Cb 0.50 0.12 -0.02 0.00 0.05 0.00 0.00 38.32 38.98 3h7f h ASN 248 CO 0.02 -0.02 0.01 -1.28 -1.65 0.00 0.00 177.43 174.50 3h7f h SER 249 N 0.10 0.46 -0.37 5.81 0.87 -1.40 -2.61 113.55 116.41 3h7f h SER 249 Ca 0.15 -0.08 -0.09 0.00 -1.23 0.00 0.00 61.79 60.54 3h7f h SER 249 Cb 0.21 -0.12 -0.02 0.00 -0.44 0.00 0.00 62.40 62.03 3h7f h SER 249 CO -0.25 0.52 -0.08 0.00 -0.53 0.00 0.00 176.83 176.49 3h7f h ALA 250 N 1.54 1.00 0.11 6.23 0.00 -0.84 -1.60 119.26 125.70 3h7f h ALA 250 Ca 0.10 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.70 3h7f h ALA 250 Cb 0.30 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.91 3h7f h ALA 250 CO 0.01 0.60 -0.05 0.28 0.00 0.00 0.00 179.25 180.09 3h7f h VAL 251 N 0.73 1.09 -3.09 0.00 2.07 -1.23 -1.08 116.25 114.74 3h7f h VAL 251 Ca 0.13 -0.83 -0.26 0.00 0.82 0.00 0.00 66.70 66.56 3h7f h VAL 251 Cb 0.56 1.61 -0.34 0.00 -1.52 0.00 0.00 31.29 31.60 3h7f h VAL 251 CO 0.03 0.20 -0.60 0.12 0.02 0.00 0.00 177.57 177.35 3h7f s PHE 252 N -4.57 -0.23 -1.42 1.57 5.36 -1.00 -1.08 117.98 116.61 3h7f s PHE 252 Ca -0.15 0.65 0.13 0.00 -0.96 0.00 0.00 56.93 56.60 3h7f s PHE 252 Cb 0.02 -0.15 0.48 0.00 -0.34 0.00 0.00 43.02 43.04 3h7f s PHE 252 CO 0.62 -0.25 1.36 -0.35 -1.46 0.00 0.00 175.22 175.13 3h7f n PRO 253 N 4.93 2.72 0.12 10.12 -0.04 -1.07 -4.18 135.00 147.59 3h7f n PRO 253 Ca -0.13 -1.91 -0.14 0.00 -0.04 0.00 0.00 63.50 61.28 3h7f n PRO 253 Cb 0.51 -1.63 -0.08 0.00 -0.04 0.00 0.00 33.50 32.26 3h7f n PRO 253 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 3h7f h GLY 254 N 4.70 -0.25 0.00 0.55 0.00 -1.31 -3.41 103.07 103.35 3h7f h GLY 254 Ca 0.00 0.09 -0.05 0.00 0.00 0.00 0.00 47.33 47.37 3h7f h GLY 254 CO 0.13 -0.09 -1.17 -1.06 0.00 0.00 0.00 176.54 174.35 3h7f n GLN 255 N -5.18 0.07 -4.07 4.80 1.13 -0.41 -4.99 117.38 108.72 3h7f n GLN 255 Ca -0.09 0.02 -0.23 0.00 -1.94 0.00 0.00 57.00 54.76 3h7f n GLN 255 Cb 0.13 -0.88 -0.06 0.00 0.11 0.00 0.00 30.24 29.54 3h7f n GLN 255 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 3h7f s GLN 256 N -2.06 2.37 0.00 -1.09 -0.21 -0.24 -5.05 119.66 113.38 3h7f s GLN 256 Ca -0.04 -1.58 0.00 0.00 0.02 0.00 0.00 55.36 53.76 3h7f s GLN 256 Cb 0.01 -2.17 0.00 0.00 1.00 0.00 0.00 33.01 31.86 3h7f s GLN 256 CO 0.06 0.07 0.00 0.41 -2.12 0.00 0.00 175.29 173.71 3h7f n GLY 257 N -1.18 0.60 3.76 3.09 0.00 -1.26 -4.64 105.19 105.56 3h7f n GLY 257 Ca -0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.58 3h7f n GLY 257 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3h7f s GLY 258 N 0.00 2.60 0.59 -0.02 0.00 -1.26 -4.79 107.32 104.44 3h7f s GLY 258 Ca 0.00 1.31 -0.14 0.00 0.00 0.00 0.00 44.72 45.89 3h7f s GLY 258 CO 0.00 2.14 1.02 2.56 0.00 0.00 0.00 173.10 178.82 3h7f s PRO 259 N -0.96 3.57 -0.89 2.90 0.04 -1.26 -5.01 135.00 133.39 3h7f s PRO 259 Ca 0.55 0.92 -0.21 0.00 0.04 0.00 0.00 61.00 62.31 3h7f s PRO 259 Cb -0.41 -2.08 0.10 0.00 0.04 0.00 0.00 34.50 32.15 3h7f s PRO 259 CO 0.48 -0.59 1.17 -0.51 0.04 0.00 0.00 177.00 177.59 3h7f s LEU 260 N -4.74 4.53 0.34 -3.56 1.43 -1.26 -4.80 118.68 110.61 3h7f s LEU 260 Ca 0.58 -1.67 0.09 0.00 -1.03 0.00 0.00 54.13 52.10 3h7f s LEU 260 Cb -0.12 -2.45 0.62 0.00 0.03 0.00 0.00 46.19 44.28 3h7f s LEU 260 CO 0.44 -1.26 1.80 0.24 0.23 0.00 0.00 176.35 177.80 3h7f h MET 261 N 9.22 0.19 -0.51 1.70 2.86 -1.86 -1.47 114.93 125.05 3h7f h MET 261 Ca 0.07 -0.07 -0.02 0.00 -2.06 0.00 0.00 59.70 57.63 3h7f h MET 261 Cb 1.03 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 32.65 3h7f h MET 261 CO 1.20 0.48 0.26 1.12 1.06 0.00 0.00 176.91 181.03 3h7f h HIS 262 N 0.17 0.73 -0.50 -0.22 -0.00 -1.86 -1.34 115.15 112.12 3h7f h HIS 262 Ca 0.02 -0.03 -0.11 0.00 -0.00 0.00 0.00 60.37 60.25 3h7f h HIS 262 Cb 0.63 -0.23 -0.02 0.00 -0.00 0.00 0.00 27.41 27.79 3h7f h HIS 262 CO 0.01 0.56 -0.13 0.28 -0.00 0.00 0.00 177.93 178.64 3h7f h VAL 263 N 0.68 1.27 -0.82 6.12 2.07 -1.71 -2.91 116.25 120.95 3h7f h VAL 263 Ca 0.18 -1.27 -0.02 0.00 0.82 0.00 0.00 66.70 66.41 3h7f h VAL 263 Cb 0.09 1.02 -0.04 0.00 -1.52 0.00 0.00 31.29 30.84 3h7f h VAL 263 CO -0.03 0.44 0.44 0.40 0.02 0.00 0.00 177.57 178.85 3h7f h ILE 264 N 0.85 1.24 -0.70 4.57 2.04 -1.12 -1.24 117.51 123.14 3h7f h ILE 264 Ca 0.13 -0.61 0.06 0.00 1.00 0.00 0.00 64.86 65.44 3h7f h ILE 264 Cb 0.68 0.14 -0.06 0.00 -0.74 0.00 0.00 36.82 36.84 3h7f h ILE 264 CO 0.05 0.27 0.40 0.00 0.00 0.00 0.00 178.15 178.87 3h7f h ALA 265 N 1.34 0.95 -0.05 1.87 0.00 -1.15 -1.78 119.26 120.43 3h7f h ALA 265 Ca 0.29 0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.15 3h7f h ALA 265 Cb 0.04 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 3h7f h ALA 265 CO -0.05 0.09 -0.25 0.78 0.00 0.00 0.00 179.25 179.82 3h7f h GLY 266 N 0.73 0.08 0.97 0.00 0.00 -1.22 -2.57 103.07 101.07 3h7f h GLY 266 Ca 0.31 -0.06 -0.03 0.00 0.00 0.00 0.00 47.33 47.56 3h7f h GLY 266 CO -0.18 0.05 0.20 0.50 0.00 0.00 0.00 176.54 177.11 3h7f h LYS 267 N 0.07 0.75 -0.72 4.80 1.57 -0.40 -1.42 116.57 121.22 3h7f h LYS 267 Ca 0.01 -0.14 0.03 0.00 -1.87 0.00 0.00 60.65 58.69 3h7f h LYS 267 Cb 0.49 -0.12 -0.05 0.00 0.08 0.00 0.00 32.23 32.63 3h7f h LYS 267 CO 0.03 0.67 0.45 0.00 -0.57 0.00 0.00 179.45 180.03 3h7f h ALA 268 N 1.05 0.95 -0.14 3.86 0.00 -1.15 -1.48 119.26 122.35 3h7f h ALA 268 Ca 0.17 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 3h7f h ALA 268 Cb 0.19 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 3h7f h ALA 268 CO -0.01 0.22 0.09 0.28 0.00 0.00 0.00 179.25 179.82 3h7f h VAL 269 N 0.87 1.06 -0.42 0.00 2.07 -1.23 -2.29 116.25 116.33 3h7f h VAL 269 Ca 0.29 -0.15 -0.07 0.00 0.82 0.00 0.00 66.70 67.59 3h7f h VAL 269 Cb 0.04 0.92 -0.02 0.00 -1.52 0.00 0.00 31.29 30.71 3h7f h VAL 269 CO -0.12 0.06 -0.03 0.00 0.02 0.00 0.00 177.57 177.50 3h7f h ALA 270 N 1.02 1.17 -0.55 1.67 0.00 -0.99 -2.16 119.26 119.41 3h7f h ALA 270 Ca 0.05 -0.26 -0.09 0.00 0.00 0.00 0.00 54.91 54.61 3h7f h ALA 270 Cb 0.02 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 3h7f h ALA 270 CO -0.01 0.54 -0.02 -0.07 0.00 0.00 0.00 179.25 179.69 3h7f h LEU 271 N 0.64 0.94 -0.21 0.00 3.38 -1.15 -1.69 115.31 117.23 3h7f h LEU 271 Ca 0.13 -0.26 -0.00 0.00 0.09 0.00 0.00 57.88 57.83 3h7f h LEU 271 Cb 0.45 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 3h7f h LEU 271 CO 0.02 1.01 0.11 0.50 0.09 0.00 0.00 178.44 180.17 3h7f h LYS 272 N 0.88 0.28 -0.98 1.13 3.64 -1.13 -3.05 116.57 117.35 3h7f h LYS 272 Ca 0.16 -0.03 0.03 0.00 -1.27 0.00 0.00 60.65 59.54 3h7f h LYS 272 Cb 0.55 -0.06 -0.06 0.00 -0.41 0.00 0.00 32.23 32.25 3h7f h LYS 272 CO 0.03 0.26 0.64 0.82 -2.27 0.00 0.00 179.45 178.94 3h7f h ILE 273 N 0.23 1.18 0.00 2.00 2.04 -1.34 -2.89 117.51 118.73 3h7f h ILE 273 Ca 0.07 -0.43 0.00 0.00 1.00 0.00 0.00 64.86 65.50 3h7f h ILE 273 Cb 0.06 -0.18 0.00 0.00 -0.74 0.00 0.00 36.82 35.96 3h7f h ILE 273 CO -0.01 0.23 0.00 0.00 0.00 0.00 0.00 178.15 178.37 3h7f h ALA 274 N 1.43 1.00 -0.00 1.87 0.00 -1.19 -2.14 119.26 120.23 3h7f h ALA 274 Ca 0.39 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.30 3h7f h ALA 274 Cb -0.01 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.78 3h7f h ALA 274 CO -0.12 0.00 -0.37 0.00 0.00 0.00 0.00 179.25 178.77 3h7f n ALA 275 N -1.85 3.24 -1.92 0.00 0.00 -1.09 -4.60 120.51 114.29 3h7f n ALA 275 Ca 0.01 -0.29 -0.32 0.00 0.00 0.00 0.00 53.44 52.83 3h7f n ALA 275 Cb 0.18 -1.20 -0.05 0.00 0.00 0.00 0.00 19.45 18.38 3h7f n ALA 275 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3h7f s THR 276 N -2.96 4.54 0.39 0.00 -4.23 -0.80 -4.98 115.64 107.59 3h7f s THR 276 Ca 0.13 1.19 0.09 0.00 -1.18 0.00 0.00 61.69 61.91 3h7f s THR 276 Cb 0.18 -3.67 0.31 0.00 1.34 0.00 0.00 72.50 70.66 3h7f s THR 276 CO 0.65 -0.49 1.96 -0.65 -0.54 0.00 0.00 174.62 175.55 3h7f h PRO 277 N 1.44 0.61 -0.55 3.99 0.11 -1.94 -2.49 132.00 133.16 3h7f h PRO 277 Ca -0.48 -0.04 0.03 0.00 0.11 0.00 0.00 66.00 65.63 3h7f h PRO 277 Cb 1.18 -0.14 -0.04 0.00 0.11 0.00 0.00 31.00 32.12 3h7f h PRO 277 CO 0.62 0.40 0.31 1.49 -0.21 0.00 0.00 178.00 180.62 3h7f h GLU 278 N 0.62 0.60 -0.59 1.05 4.81 -1.94 -1.67 114.58 117.46 3h7f h GLU 278 Ca 0.31 -0.04 -0.09 0.00 -0.13 0.00 0.00 59.36 59.42 3h7f h GLU 278 Cb 0.40 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.62 3h7f h GLU 278 CO -0.10 0.40 0.03 0.35 -0.73 0.00 0.00 179.01 178.95 3h7f h PHE 279 N 0.62 1.09 -0.70 0.92 3.57 -1.69 -2.21 116.94 118.54 3h7f h PHE 279 Ca 0.23 -0.17 -0.03 0.00 3.53 0.00 0.00 57.97 61.53 3h7f h PHE 279 Cb 0.07 -0.29 -0.03 0.00 2.79 0.00 0.00 35.95 38.49 3h7f h PHE 279 CO -0.07 0.96 0.31 0.00 -2.23 0.00 0.00 178.31 177.28 3h7f h ALA 280 N 1.08 0.91 -0.96 2.41 0.00 -1.16 -1.92 119.26 119.62 3h7f h ALA 280 Ca 0.17 -0.16 0.02 0.00 0.00 0.00 0.00 54.91 54.95 3h7f h ALA 280 Cb 0.51 -0.28 -0.05 0.00 0.00 0.00 0.00 17.79 17.97 3h7f h ALA 280 CO 0.02 0.50 0.63 0.22 0.00 0.00 0.00 179.25 180.62 3h7f h ASP 281 N 0.99 1.07 -0.78 0.00 3.58 -1.16 -1.23 116.42 118.88 3h7f h ASP 281 Ca 0.24 -0.02 -0.01 0.00 0.42 0.00 0.00 57.03 57.66 3h7f h ASP 281 Cb 0.16 -0.25 -0.04 0.00 1.72 0.00 0.00 39.33 40.92 3h7f h ASP 281 CO -0.03 0.75 0.45 -0.09 -2.88 0.00 0.00 179.24 177.45 3h7f h ARG 282 N 1.25 1.07 -0.43 0.28 2.43 -0.92 -1.47 114.38 116.60 3h7f h ARG 282 Ca 0.37 -0.11 -0.12 0.00 -0.81 0.00 0.00 59.98 59.30 3h7f h ARG 282 Cb -0.06 -0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 29.25 3h7f h ARG 282 CO -0.10 0.77 -0.23 1.96 -1.51 0.00 0.00 179.97 180.86 3h7f h GLN 283 N 1.08 0.87 -0.61 0.20 1.08 -1.16 -1.24 115.11 115.32 3h7f h GLN 283 Ca 0.28 -0.37 0.03 0.00 -1.45 0.00 0.00 58.65 57.14 3h7f h GLN 283 Cb -0.01 -0.03 -0.04 0.00 -0.05 0.00 0.00 27.48 27.35 3h7f h GLN 283 CO -0.05 1.01 0.38 -0.09 -0.95 0.00 0.00 178.83 179.13 3h7f h ARG 284 N 0.75 0.72 -0.58 1.46 2.43 -0.83 -2.18 114.38 116.16 3h7f h ARG 284 Ca 0.10 -0.04 -0.08 0.00 -0.81 0.00 0.00 59.98 59.15 3h7f h ARG 284 Cb 0.77 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 30.14 3h7f h ARG 284 CO 0.06 0.48 0.06 0.00 -1.51 0.00 0.00 179.97 179.06 3h7f h ARG 285 N 0.74 0.96 -0.34 0.20 3.08 -1.15 -1.46 114.38 116.41 3h7f h ARG 285 Ca 0.25 -0.26 0.05 0.00 0.07 0.00 0.00 59.98 60.10 3h7f h ARG 285 Cb 0.02 -0.11 -0.05 0.00 0.08 0.00 0.00 29.97 29.91 3h7f h ARG 285 CO -0.10 0.91 0.04 1.15 -1.07 0.00 0.00 179.97 180.90 3h7f h THR 286 N 0.89 0.80 -0.18 2.04 2.02 -1.02 -1.31 112.91 116.15 3h7f h THR 286 Ca 0.18 -0.05 -0.11 0.00 0.77 0.00 0.00 66.41 67.19 3h7f h THR 286 Cb 0.44 0.64 0.00 0.00 -1.74 0.00 0.00 68.15 67.49 3h7f h THR 286 CO 0.02 0.03 -0.33 -0.07 0.37 0.00 0.00 175.52 175.53 3h7f h LEU 287 N 0.14 0.60 -0.86 2.58 3.38 -1.18 -2.61 115.31 117.37 3h7f h LEU 287 Ca 0.16 -0.54 -0.11 0.00 0.09 0.00 0.00 57.88 57.48 3h7f h LEU 287 Cb 0.20 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 3h7f h LEU 287 CO -0.24 1.03 -0.35 0.77 0.09 0.00 0.00 178.44 179.75 3h7f h SER 288 N 0.19 0.44 -0.62 -0.43 4.64 -1.26 -2.51 113.55 114.01 3h7f h SER 288 Ca 0.01 -0.18 -0.01 0.00 -0.47 0.00 0.00 61.79 61.14 3h7f h SER 288 Cb 0.92 -0.12 -0.03 0.00 -0.31 0.00 0.00 62.40 62.86 3h7f h SER 288 CO 0.07 0.76 0.35 1.23 -0.87 0.00 0.00 176.83 178.38 3h7f h GLY 289 N 1.09 0.91 1.04 -0.77 0.00 -1.23 -1.87 103.07 102.24 3h7f h GLY 289 Ca 0.04 -0.40 -0.06 0.00 0.00 0.00 0.00 47.33 46.91 3h7f h GLY 289 CO 0.06 0.39 0.20 0.00 0.00 0.00 0.00 176.54 177.19 3h7f h ALA 290 N 1.17 0.89 -0.76 3.60 0.00 -1.31 -2.25 119.26 120.61 3h7f h ALA 290 Ca 0.22 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 3h7f h ALA 290 Cb 0.02 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 17.52 3h7f h ALA 290 CO -0.04 0.58 0.41 0.00 0.00 0.00 0.00 179.25 180.20 3h7f h ARG 291 N 1.00 1.05 -0.73 0.00 2.47 -1.31 -1.97 114.38 114.89 3h7f h ARG 291 Ca 0.22 -0.12 -0.03 0.00 -1.26 0.00 0.00 59.98 58.80 3h7f h ARG 291 Cb 0.31 -0.21 -0.03 0.00 -1.65 0.00 0.00 29.97 28.39 3h7f h ARG 291 CO -0.01 0.77 0.35 0.82 0.56 0.00 0.00 179.97 182.47 3h7f h ILE 292 N 1.05 1.24 -0.27 2.04 2.04 -1.08 -1.73 117.51 120.81 3h7f h ILE 292 Ca 0.27 -0.66 -0.04 0.00 1.00 0.00 0.00 64.86 65.43 3h7f h ILE 292 Cb 0.03 0.33 -0.01 0.00 -0.74 0.00 0.00 36.82 36.42 3h7f h ILE 292 CO -0.04 0.28 0.03 0.40 0.00 0.00 0.00 178.15 178.81 3h7f h ILE 293 N 1.02 1.24 -0.65 -0.67 2.04 -1.17 -2.21 117.51 117.11 3h7f h ILE 293 Ca 0.25 -0.84 0.02 0.00 1.00 0.00 0.00 64.86 65.30 3h7f h ILE 293 Cb 0.11 1.27 -0.04 0.00 -0.74 0.00 0.00 36.82 37.43 3h7f h ILE 293 CO -0.03 0.27 0.41 0.00 0.00 0.00 0.00 178.15 178.79 3h7f h ALA 294 N 0.85 0.84 -0.68 1.87 0.00 -1.29 -2.42 119.26 118.42 3h7f h ALA 294 Ca 0.08 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 3h7f h ALA 294 Cb 0.37 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 3h7f h ALA 294 CO 0.01 0.18 0.21 0.22 0.00 0.00 0.00 179.25 179.86 3h7f h ASP 295 N 0.81 1.00 -0.50 0.00 3.58 -1.23 -2.11 116.42 117.97 3h7f h ASP 295 Ca 0.26 -0.21 -0.08 0.00 0.42 0.00 0.00 57.03 57.42 3h7f h ASP 295 Cb -0.01 -0.26 -0.02 0.00 1.72 0.00 0.00 39.33 40.76 3h7f h ASP 295 CO -0.09 0.94 0.03 -0.09 -2.88 0.00 0.00 179.24 177.15 3h7f h ARG 296 N 1.00 0.92 0.00 0.28 9.65 -1.28 -2.90 114.38 122.05 3h7f h ARG 296 Ca 0.22 -0.25 -0.07 0.00 -1.10 0.00 0.00 59.98 58.78 3h7f h ARG 296 Cb 0.31 -0.10 -0.01 0.00 -1.39 0.00 0.00 29.97 28.77 3h7f h ARG 296 CO -0.01 0.89 -0.31 -0.07 2.80 0.00 0.00 179.97 183.27 3h7f h LEU 297 N 0.85 0.00 -6.98 3.80 3.38 -1.22 -3.34 115.31 111.80 3h7f h LEU 297 Ca 0.17 0.00 -0.76 0.00 0.09 0.00 0.00 57.88 57.38 3h7f h LEU 297 Cb 0.46 0.00 -0.18 0.00 0.09 0.00 0.00 40.66 41.03 3h7f h LEU 297 CO 0.02 0.31 1.63 0.23 0.09 0.00 0.00 178.44 180.72 3h7f n MET 298 N -3.54 3.60 -3.79 1.13 2.81 -0.81 -4.50 117.12 112.01 3h7f n MET 298 Ca -0.00 -3.76 -0.10 0.00 -1.81 0.00 0.00 57.70 52.03 3h7f n MET 298 Cb 0.46 -2.92 -0.07 0.00 -0.71 0.00 0.00 33.22 29.98 3h7f n MET 298 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3h7f s ALA 299 N 0.49 -0.49 0.23 3.04 0.00 -1.26 -4.94 121.76 118.83 3h7f s ALA 299 Ca 0.40 -0.31 -0.08 0.00 0.00 0.00 0.00 51.96 51.97 3h7f s ALA 299 Cb 0.04 0.45 0.23 0.00 0.00 0.00 0.00 23.12 23.84 3h7f s ALA 299 CO 0.01 -0.49 1.88 -1.35 0.00 0.00 0.00 175.76 175.81 3h7f h PRO 300 N 2.90 1.01 -0.69 0.00 0.11 -1.92 -1.89 132.00 131.52 3h7f h PRO 300 Ca -0.33 -0.06 0.05 0.00 0.11 0.00 0.00 66.00 65.77 3h7f h PRO 300 Cb 1.21 -0.23 -0.05 0.00 0.11 0.00 0.00 31.00 32.04 3h7f h PRO 300 CO 0.51 0.67 0.40 0.38 -0.21 0.00 0.00 178.00 179.75 3h7f h ASP 301 N 1.04 0.61 -0.10 -2.05 2.03 -1.96 -1.39 116.42 114.60 3h7f h ASP 301 Ca 0.32 0.02 -0.16 0.00 -0.73 0.00 0.00 57.03 56.48 3h7f h ASP 301 Cb -0.02 -0.11 0.01 0.00 -0.83 0.00 0.00 39.33 38.38 3h7f h ASP 301 CO -0.10 0.41 -0.56 0.58 -1.03 0.00 0.00 179.24 178.54 3h7f h VAL 302 N 0.75 1.36 -0.67 4.15 2.07 -1.79 -2.95 116.25 119.16 3h7f h VAL 302 Ca 0.30 -1.87 0.02 0.00 0.82 0.00 0.00 66.70 65.97 3h7f h VAL 302 Cb 0.14 2.19 -0.04 0.00 -1.52 0.00 0.00 31.29 32.06 3h7f h VAL 302 CO -0.16 0.56 0.42 0.00 0.02 0.00 0.00 177.57 178.42 3h7f h ALA 303 N 0.47 0.87 0.00 1.67 0.00 -1.27 -2.61 119.26 118.39 3h7f h ALA 303 Ca -0.04 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 3h7f h ALA 303 Cb 1.20 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.76 3h7f h ALA 303 CO 0.11 0.20 -0.12 0.87 0.00 0.00 0.00 179.25 180.31 3h7f h LYS 304 N 0.83 0.00 0.00 0.00 1.57 -1.25 -1.55 116.57 116.17 3h7f h LYS 304 Ca 0.26 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.04 3h7f h LYS 304 Cb -0.01 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.30 3h7f h LYS 304 CO -0.10 0.12 0.00 0.00 -0.57 0.00 0.00 179.45 178.91 3h7f n ALA 305 N -2.38 2.56 -0.58 3.86 0.00 -0.99 -4.93 120.51 118.04 3h7f n ALA 305 Ca -0.02 -0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.24 3h7f n ALA 305 Cb 0.21 -1.47 0.00 0.00 0.00 0.00 0.00 19.45 18.19 3h7f n ALA 305 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h7f n GLY 306 N 0.85 1.16 3.29 0.00 0.00 -0.58 -4.12 105.19 105.78 3h7f n GLY 306 Ca 0.21 -0.35 -0.31 0.00 0.00 0.00 0.00 46.02 45.57 3h7f n GLY 306 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3h7f s VAL 307 N -2.00 2.01 0.28 1.61 1.01 -1.14 -2.95 120.40 119.23 3h7f s VAL 307 Ca 0.00 -1.07 0.02 0.00 0.00 0.00 0.00 61.98 60.93 3h7f s VAL 307 Cb 0.00 -1.68 -0.04 0.00 0.00 0.00 0.00 36.38 34.66 3h7f s VAL 307 CO 0.00 0.57 0.15 -0.94 0.00 0.00 0.00 175.10 174.88 3h7f s SER 308 N -0.43 1.29 -0.20 3.32 1.04 -0.63 -3.95 113.70 114.14 3h7f s SER 308 Ca 0.05 -1.52 -0.04 0.00 0.48 0.00 0.00 55.95 54.92 3h7f s SER 308 Cb -0.11 0.36 -0.02 0.00 0.10 0.00 0.00 66.02 66.35 3h7f s SER 308 CO 0.01 -0.86 -0.03 -0.69 0.98 0.00 0.00 173.24 172.65 3h7f s VAL 309 N -3.70 3.65 0.16 5.02 1.01 -1.26 -0.99 120.40 124.28 3h7f s VAL 309 Ca 0.37 -0.41 -0.32 0.00 0.00 0.00 0.00 61.98 61.62 3h7f s VAL 309 Cb 0.06 -2.65 -0.11 0.00 0.00 0.00 0.00 36.38 33.68 3h7f s VAL 309 CO 0.17 0.43 1.79 0.52 0.00 0.00 0.00 175.10 178.01 3h7f n VAL 310 N 4.41 0.22 -0.87 2.92 0.31 -0.12 -1.55 118.33 123.65 3h7f n VAL 310 Ca -0.18 -0.04 0.00 0.00 -0.01 0.00 0.00 64.34 64.12 3h7f n VAL 310 Cb 0.51 -2.05 0.00 0.00 -0.91 0.00 0.00 33.84 31.39 3h7f n VAL 310 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 3h7f n SER 311 N 4.94 -0.23 -1.81 4.52 3.41 -1.26 -3.93 113.62 119.25 3h7f n SER 311 Ca 0.17 0.00 -0.14 0.00 -0.26 0.00 0.00 58.87 58.64 3h7f n SER 311 Cb 0.36 -0.75 0.01 0.00 -0.26 0.00 0.00 64.21 63.57 3h7f n SER 311 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3h7f n GLY 312 N -1.99 -0.14 0.00 5.00 0.00 -0.59 -4.89 105.19 102.58 3h7f n GLY 312 Ca 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.77 3h7f n GLY 312 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h7f n GLY 313 N -1.15 0.20 3.35 -0.02 0.00 -1.25 -5.08 105.19 101.24 3h7f n GLY 313 Ca -0.11 -1.60 -0.15 0.00 0.00 0.00 0.00 46.02 44.16 3h7f n GLY 313 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3h7f s THR 314 N -2.72 0.04 -0.00 2.61 -1.32 -1.26 -4.86 115.64 108.13 3h7f s THR 314 Ca 0.00 -0.30 0.00 0.00 -1.21 0.00 0.00 61.69 60.18 3h7f s THR 314 Cb 0.00 -0.80 0.00 0.00 -1.51 0.00 0.00 72.50 70.20 3h7f s THR 314 CO 0.00 -0.17 0.99 0.47 -2.21 0.00 0.00 174.62 173.71 3h7f n ASP 315 N 1.03 1.98 -0.65 8.08 8.00 -0.70 -4.83 116.55 129.46 3h7f n ASP 315 Ca -0.20 -2.00 0.00 0.00 0.71 0.00 0.00 54.79 53.30 3h7f n ASP 315 Cb 0.57 -0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.66 3h7f n ASP 315 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 3h7f n VAL 316 N -0.50 0.00 1.00 2.53 0.24 -1.26 -4.93 118.33 115.41 3h7f n VAL 316 Ca 0.00 0.00 0.02 0.00 -2.04 0.00 0.00 64.34 62.32 3h7f n VAL 316 Cb 0.26 0.00 0.07 0.00 -1.47 0.00 0.00 33.84 32.70 3h7f n VAL 316 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3h7f n HIS 317 N 0.00 0.32 -3.88 6.34 1.44 -1.26 -4.75 115.22 113.43 3h7f n HIS 317 Ca 0.00 -0.12 -0.09 0.00 -2.01 0.00 0.00 57.72 55.49 3h7f n HIS 317 Cb 0.00 -0.11 -0.06 0.00 0.12 0.00 0.00 29.99 29.94 3h7f n HIS 317 CO 0.00 0.00 0.00 -0.48 -2.81 0.00 0.00 176.34 173.05 3h7f s LEU 318 N -0.73 0.85 -0.05 2.39 0.05 -1.26 -2.02 118.68 117.91 3h7f s LEU 318 Ca 0.10 -0.72 0.03 0.00 0.05 0.00 0.00 54.13 53.59 3h7f s LEU 318 Cb 0.07 1.38 0.00 0.00 -2.05 0.00 0.00 46.19 45.59 3h7f s LEU 318 CO 0.05 -0.89 -0.14 -0.69 -0.55 0.00 0.00 176.35 174.13 3h7f s VAL 319 N -3.92 1.20 -0.30 1.48 1.01 -0.17 -4.83 120.40 114.87 3h7f s VAL 319 Ca 0.13 -0.56 -0.09 0.00 0.00 0.00 0.00 61.98 61.45 3h7f s VAL 319 Cb 0.03 -1.06 -0.01 0.00 0.00 0.00 0.00 36.38 35.33 3h7f s VAL 319 CO -0.03 0.36 0.14 -0.76 0.00 0.00 0.00 175.10 174.81 3h7f s LEU 320 N 0.31 3.98 -0.16 3.92 1.43 -1.26 -1.56 118.68 125.34 3h7f s LEU 320 Ca -0.08 -0.43 -0.09 0.00 -1.03 0.00 0.00 54.13 52.50 3h7f s LEU 320 Cb -0.13 -1.99 -0.04 0.00 0.03 0.00 0.00 46.19 44.05 3h7f s LEU 320 CO 0.03 -0.15 0.14 -0.69 0.23 0.00 0.00 176.35 175.90 3h7f s VAL 321 N 1.62 5.45 -0.28 -1.59 1.01 -0.36 -0.95 120.40 125.30 3h7f s VAL 321 Ca 0.05 0.22 -0.06 0.00 0.00 0.00 0.00 61.98 62.19 3h7f s VAL 321 Cb -0.17 -3.44 0.01 0.00 0.00 0.00 0.00 36.38 32.78 3h7f s VAL 321 CO 0.06 0.53 0.05 -0.62 0.00 0.00 0.00 175.10 175.13 3h7f s ASP 322 N -0.36 4.97 0.00 3.32 -1.08 -0.17 -2.19 116.67 121.16 3h7f s ASP 322 Ca 0.12 -0.66 0.16 0.00 -0.52 0.00 0.00 52.55 51.66 3h7f s ASP 322 Cb -0.12 -1.85 0.10 0.00 -1.46 0.00 0.00 42.92 39.59 3h7f s ASP 322 CO 0.01 -0.16 0.98 0.18 0.52 0.00 0.00 175.17 176.70 3h7f n LEU 323 N 4.84 2.18 0.10 -1.34 4.77 0.03 -1.60 117.00 125.99 3h7f n LEU 323 Ca -0.15 -0.94 0.05 0.00 -0.03 0.00 0.00 56.01 54.93 3h7f n LEU 323 Cb 0.48 0.00 0.47 0.00 -2.33 0.00 0.00 43.42 42.05 3h7f n LEU 323 CO 0.31 0.39 1.06 0.08 -1.33 0.00 0.00 177.39 177.90 3h7f h ARG 324 N 2.86 0.31 -0.01 3.23 0.11 -1.75 0.34 114.38 119.47 3h7f h ARG 324 Ca 0.00 -0.03 0.00 0.00 0.10 0.00 0.00 59.98 60.05 3h7f h ARG 324 Cb 0.65 -0.06 0.00 0.00 1.11 0.00 0.00 29.97 31.67 3h7f h ARG 324 CO 0.00 0.27 0.00 -0.25 0.10 0.00 0.00 179.97 180.09 3h7f n ASP 325 N -4.44 0.16 -4.98 0.08 8.00 -1.19 -4.89 116.55 109.29 3h7f n ASP 325 Ca 0.00 -1.27 -0.19 0.00 0.71 0.00 0.00 54.79 54.04 3h7f n ASP 325 Cb 0.13 -0.01 0.01 0.00 -0.02 0.00 0.00 41.12 41.23 3h7f n ASP 325 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 3h7f s SER 326 N -1.77 5.34 0.55 -2.24 1.04 0.11 -4.47 113.70 112.27 3h7f s SER 326 Ca 0.37 -0.63 0.30 0.00 0.48 0.00 0.00 55.95 56.47 3h7f s SER 326 Cb 0.17 -0.37 1.61 0.00 0.10 0.00 0.00 66.02 67.53 3h7f s SER 326 CO 0.29 -0.88 2.13 -0.65 0.98 0.00 0.00 173.24 175.10 3h7f h PRO 327 N 0.63 0.00 -5.68 4.02 0.11 -1.83 -3.44 132.00 125.81 3h7f h PRO 327 Ca -0.38 0.00 -0.58 0.00 0.11 0.00 0.00 66.00 65.15 3h7f h PRO 327 Cb 1.28 0.00 -0.09 0.00 0.11 0.00 0.00 31.00 32.30 3h7f h PRO 327 CO 0.48 0.08 -0.12 -0.51 -0.21 0.00 0.00 178.00 177.71 3h7f s LEU 328 N -7.10 4.24 0.81 2.35 1.43 -1.26 -5.09 118.68 114.07 3h7f s LEU 328 Ca -0.03 0.77 -0.12 0.00 -1.03 0.00 0.00 54.13 53.72 3h7f s LEU 328 Cb 0.13 -2.69 0.09 0.00 0.03 0.00 0.00 46.19 43.76 3h7f s LEU 328 CO 0.55 -0.04 1.17 1.51 0.23 0.00 0.00 176.35 179.78 3h7f s ASP 329 N 0.75 4.36 0.18 2.29 1.47 -1.26 -4.69 116.67 119.78 3h7f s ASP 329 Ca 0.25 0.65 -0.13 0.00 1.18 0.00 0.00 52.55 54.51 3h7f s ASP 329 Cb -0.15 -1.10 0.13 0.00 -0.34 0.00 0.00 42.92 41.45 3h7f s ASP 329 CO 0.10 -1.98 1.80 1.23 0.68 0.00 0.00 175.17 177.01 3h7f h GLY 330 N -1.07 0.75 1.01 2.12 0.00 -1.31 -1.59 103.07 102.97 3h7f h GLY 330 Ca -0.45 -0.21 0.00 0.00 0.00 0.00 0.00 47.33 46.66 3h7f h GLY 330 CO 0.61 0.16 0.54 -1.61 0.00 0.00 0.00 176.54 176.24 3h7f h GLN 331 N 0.58 1.15 -0.58 4.80 5.75 -1.76 -1.14 115.11 123.91 3h7f h GLN 331 Ca 0.22 -0.09 -0.03 0.00 -0.15 0.00 0.00 58.65 58.60 3h7f h GLN 331 Cb 0.08 -0.25 -0.03 0.00 1.07 0.00 0.00 27.48 28.35 3h7f h GLN 331 CO -0.12 0.79 0.24 0.00 -2.65 0.00 0.00 178.83 177.08 3h7f h ALA 332 N 1.29 0.76 -0.43 3.38 0.00 -1.84 -1.22 119.26 121.21 3h7f h ALA 332 Ca 0.31 -0.16 -0.08 0.00 0.00 0.00 0.00 54.91 54.97 3h7f h ALA 332 Cb -0.08 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 3h7f h ALA 332 CO -0.06 0.37 -0.06 0.00 0.00 0.00 0.00 179.25 179.50 3h7f h ALA 333 N 1.08 0.58 -0.45 0.00 0.00 -1.19 -1.19 119.26 118.10 3h7f h ALA 333 Ca 0.20 -0.30 0.04 0.00 0.00 0.00 0.00 54.91 54.85 3h7f h ALA 333 Cb 0.20 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.79 3h7f h ALA 333 CO -0.02 0.42 0.21 1.49 0.00 0.00 0.00 179.25 181.35 3h7f h GLU 334 N 0.62 0.40 -0.53 0.00 4.81 -1.09 -1.95 114.58 116.84 3h7f h GLU 334 Ca 0.11 -0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.27 3h7f h GLU 334 Cb 0.57 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.84 3h7f h GLU 334 CO 0.03 0.27 0.13 -0.44 -0.73 0.00 0.00 179.01 178.27 3h7f h ASP 335 N 0.41 0.81 -0.28 1.04 3.32 -1.11 -2.49 116.42 118.13 3h7f h ASP 335 Ca 0.20 -0.23 0.01 0.00 0.02 0.00 0.00 57.03 57.02 3h7f h ASP 335 Cb 0.13 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.45 3h7f h ASP 335 CO -0.16 0.83 0.16 0.25 -1.72 0.00 0.00 179.24 178.61 3h7f h LEU 336 N 0.75 0.26 -1.28 1.55 5.85 -1.07 -2.71 115.31 118.66 3h7f h LEU 336 Ca 0.17 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.84 3h7f h LEU 336 Cb 0.34 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.30 3h7f h LEU 336 CO 0.00 0.19 -0.01 -0.07 -0.34 0.00 0.00 178.44 178.22 3h7f h LEU 337 N 0.34 0.44 -1.27 2.25 3.38 -1.32 -1.94 115.31 117.18 3h7f h LEU 337 Ca 0.11 -0.08 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 3h7f h LEU 337 Cb -0.00 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.60 3h7f h LEU 337 CO -0.05 0.51 0.40 -0.74 0.09 0.00 0.00 178.44 178.66 3h7f h HIS 338 N 0.46 0.87 0.00 1.13 2.76 -1.21 -1.41 115.15 117.75 3h7f h HIS 338 Ca 0.10 0.00 -0.04 0.00 -2.20 0.00 0.00 60.37 58.23 3h7f h HIS 338 Cb 0.31 -0.29 -0.01 0.00 1.55 0.00 0.00 27.41 28.98 3h7f h HIS 338 CO 0.01 0.58 -0.21 0.93 -1.30 0.00 0.00 177.93 177.94 3h7f h GLU 339 N 0.91 0.00 -0.65 5.26 4.39 -1.05 -2.80 114.58 120.65 3h7f h GLU 339 Ca 0.24 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.94 3h7f h GLU 339 Cb -0.04 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.61 3h7f h GLU 339 CO -0.05 0.21 0.00 1.33 -1.16 0.00 0.00 179.01 179.34 3h7f n VAL 340 N -3.54 1.71 -0.55 3.13 0.24 -0.85 -4.79 118.33 113.68 3h7f n VAL 340 Ca -0.01 -1.08 0.00 0.00 -2.04 0.00 0.00 64.34 61.22 3h7f n VAL 340 Cb 0.36 0.06 0.00 0.00 -1.47 0.00 0.00 33.84 32.78 3h7f n VAL 340 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3h7f n GLY 341 N 1.04 0.71 3.22 7.63 0.00 -1.05 -4.11 105.19 112.63 3h7f n GLY 341 Ca 0.24 -0.16 -0.32 0.00 0.00 0.00 0.00 46.02 45.77 3h7f n GLY 341 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3h7f s ILE 342 N -2.00 2.25 -0.32 -0.61 1.01 -0.59 -1.48 121.20 119.46 3h7f s ILE 342 Ca 0.00 -0.93 -0.15 0.00 0.00 0.00 0.00 60.65 59.57 3h7f s ILE 342 Cb 0.00 -1.90 -0.02 0.00 0.01 0.00 0.00 42.46 40.55 3h7f s ILE 342 CO 0.00 0.54 0.37 -0.89 0.00 0.00 0.00 174.94 174.97 3h7f s THR 343 N 0.62 5.16 0.22 2.92 2.01 -0.58 -2.77 115.64 123.21 3h7f s THR 343 Ca -0.11 0.19 0.02 0.00 0.31 0.00 0.00 61.69 62.10 3h7f s THR 343 Cb -0.16 -3.80 -0.01 0.00 0.01 0.00 0.00 72.50 68.54 3h7f s THR 343 CO 0.03 -0.04 0.07 1.33 -0.69 0.00 0.00 174.62 175.32 3h7f n VAL 344 N 5.23 0.00 -4.07 3.82 0.24 -1.26 -0.85 118.33 121.44 3h7f n VAL 344 Ca -0.09 -1.24 -0.13 0.00 -2.04 0.00 0.00 64.34 60.84 3h7f n VAL 344 Cb 0.50 0.43 -0.11 0.00 -1.47 0.00 0.00 33.84 33.18 3h7f n VAL 344 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 3h7f s ASN 345 N -2.32 0.88 0.67 -1.34 4.22 -1.21 -4.86 114.94 110.98 3h7f s ASN 345 Ca 0.10 -0.56 -0.16 0.00 -2.14 0.00 0.00 52.86 50.10 3h7f s ASN 345 Cb 0.00 0.03 0.01 0.00 1.28 0.00 0.00 41.25 42.58 3h7f s ASN 345 CO 0.07 -0.20 1.19 0.00 -2.04 0.00 0.00 177.10 176.11 3h7f s ARG 346 N -1.61 2.52 -0.20 3.55 1.70 -1.26 -1.21 118.95 122.44 3h7f s ARG 346 Ca -0.10 1.70 -0.13 0.00 -0.47 0.00 0.00 55.73 56.73 3h7f s ARG 346 Cb -0.10 -1.89 0.06 0.00 -0.57 0.00 0.00 34.95 32.46 3h7f s ARG 346 CO 0.00 -1.53 0.50 1.21 -1.08 0.00 0.00 175.30 174.41 3h7f s ASN 347 N -2.02 -0.61 0.26 -2.89 3.84 -0.53 -4.67 114.94 108.32 3h7f s ASN 347 Ca 0.74 1.06 -0.29 0.00 0.21 0.00 0.00 52.86 54.58 3h7f s ASN 347 Cb -0.28 0.99 -0.09 0.00 -0.55 0.00 0.00 41.25 41.32 3h7f s ASN 347 CO 0.41 -0.20 1.27 0.00 -2.79 0.00 0.00 177.10 175.79 3h7f s ALA 348 N 1.06 3.49 0.34 1.71 0.00 -1.26 -2.05 121.76 125.05 3h7f s ALA 348 Ca -0.06 1.12 0.05 0.00 0.00 0.00 0.00 51.96 53.07 3h7f s ALA 348 Cb -0.06 -3.45 -0.01 0.00 0.00 0.00 0.00 23.12 19.60 3h7f s ALA 348 CO -0.10 -0.50 0.49 0.14 0.00 0.00 0.00 175.76 175.79 3h7f s VAL 349 N -0.60 4.25 0.20 0.00 -7.23 -1.26 -4.93 120.40 110.84 3h7f s VAL 349 Ca 0.51 -0.91 -0.32 0.00 -1.81 0.00 0.00 61.98 59.45 3h7f s VAL 349 Cb -0.37 -3.49 -0.12 0.00 0.56 0.00 0.00 36.38 32.96 3h7f s VAL 349 CO 0.44 -0.21 1.71 -2.65 -0.31 0.00 0.00 175.10 174.08 3h7f n PRO 350 N -1.67 2.72 -3.86 4.82 -0.02 -1.26 -2.08 135.00 133.64 3h7f n PRO 350 Ca -0.01 0.98 -0.28 0.00 -2.02 0.00 0.00 63.50 62.17 3h7f n PRO 350 Cb 0.58 -2.82 0.03 0.00 -0.02 0.00 0.00 33.50 31.26 3h7f n PRO 350 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3h7f n ASN 351 N 3.95 -3.64 -4.68 2.55 3.02 -1.26 -4.89 115.26 110.30 3h7f n ASN 351 Ca 0.16 -0.80 -0.45 0.00 -0.03 0.00 0.00 54.58 53.47 3h7f n ASN 351 Cb 0.34 -3.90 -0.04 0.00 -0.61 0.00 0.00 39.78 35.58 3h7f n ASN 351 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 3h7f n ASP 352 N -2.90 3.65 0.15 6.41 -0.08 -0.89 -4.92 116.55 117.97 3h7f n ASP 352 Ca -0.06 1.02 0.13 0.00 -1.51 0.00 0.00 54.79 54.36 3h7f n ASP 352 Cb 0.57 -1.48 0.42 0.00 2.34 0.00 0.00 41.12 42.98 3h7f n ASP 352 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 3h7f h PRO 353 N 7.81 0.00 -6.74 -0.67 0.13 -1.91 -3.46 132.00 127.16 3h7f h PRO 353 Ca -0.46 0.00 -0.49 0.00 -0.87 0.00 0.00 66.00 64.17 3h7f h PRO 353 Cb 1.24 0.00 0.02 0.00 0.13 0.00 0.00 31.00 32.39 3h7f h PRO 353 CO 0.93 0.00 -0.01 1.03 -0.23 0.00 0.00 178.00 179.73 3h7f s ARG 354 N -3.24 3.59 0.61 0.86 3.00 -1.26 -5.07 118.95 117.43 3h7f s ARG 354 Ca 0.07 0.09 -0.19 0.00 0.00 0.00 0.00 55.73 55.70 3h7f s ARG 354 Cb 0.10 -2.50 -0.03 0.00 0.00 0.00 0.00 34.95 32.53 3h7f s ARG 354 CO 0.54 -0.02 1.25 -2.14 0.00 0.00 0.00 175.30 174.93 3h7f s PRO 355 N -4.26 2.85 0.59 3.54 0.02 -1.26 -4.62 135.00 131.85 3h7f s PRO 355 Ca 0.46 1.93 0.29 0.00 0.02 0.00 0.00 61.00 63.69 3h7f s PRO 355 Cb -0.10 -1.92 1.72 0.00 0.02 0.00 0.00 34.50 34.21 3h7f s PRO 355 CO 0.38 -1.33 2.18 -1.35 -0.33 0.00 0.00 177.00 176.54 3h7f h PRO 356 N 0.82 0.00 0.00 5.54 0.11 -1.97 -0.55 132.00 135.94 3h7f h PRO 356 Ca -0.51 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3h7f h PRO 356 Cb 1.31 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.42 3h7f h PRO 356 CO 0.55 0.00 -0.07 -1.33 -0.21 0.00 0.00 178.00 176.93 3h7f n MET 357 N -3.87 0.07 -0.06 1.05 2.81 -1.26 -4.36 117.12 111.50 3h7f n MET 357 Ca -0.01 0.05 -0.13 0.00 -1.81 0.00 0.00 57.70 55.80 3h7f n MET 357 Cb 0.20 -1.57 -0.04 0.00 -0.71 0.00 0.00 33.22 31.10 3h7f n MET 357 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 3h7f n VAL 358 N -1.68 1.05 -0.87 2.03 0.31 -0.42 -4.93 118.33 113.82 3h7f n VAL 358 Ca 0.06 -0.05 0.11 0.00 -0.01 0.00 0.00 64.34 64.45 3h7f n VAL 358 Cb 0.36 -1.82 -0.04 0.00 -0.91 0.00 0.00 33.84 31.43 3h7f n VAL 358 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 3h7f n THR 359 N -3.83 -0.03 -1.69 2.52 -2.24 -0.35 -2.94 114.28 105.72 3h7f n THR 359 Ca -0.23 0.31 -0.02 0.00 -2.27 0.00 0.00 64.05 61.84 3h7f n THR 359 Cb 0.57 -0.60 0.16 0.00 -2.10 0.00 0.00 70.33 68.36 3h7f n THR 359 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 3h7f n SER 360 N -3.58 2.54 -3.48 3.42 7.64 -1.26 -1.36 113.62 117.54 3h7f n SER 360 Ca -0.03 -3.87 -0.12 0.00 1.01 0.00 0.00 58.87 55.87 3h7f n SER 360 Cb 0.40 -0.49 -0.04 0.00 -1.01 0.00 0.00 64.21 63.08 3h7f n SER 360 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 3h7f s GLY 361 N -3.29 0.97 0.08 0.23 0.00 -0.87 -0.79 107.32 103.65 3h7f s GLY 361 Ca 0.42 -1.17 0.05 0.00 0.00 0.00 0.00 44.72 44.02 3h7f s GLY 361 CO -0.04 -0.76 -0.14 1.08 0.00 0.00 0.00 173.10 173.24 3h7f s LEU 362 N -3.13 2.30 -0.20 0.66 1.43 -0.93 -1.45 118.68 117.36 3h7f s LEU 362 Ca 0.25 -0.65 -0.02 0.00 -1.03 0.00 0.00 54.13 52.68 3h7f s LEU 362 Cb -0.01 -0.50 -0.00 0.00 0.03 0.00 0.00 46.19 45.70 3h7f s LEU 362 CO 0.15 -0.10 -0.08 -0.60 0.23 0.00 0.00 176.35 175.95 3h7f s ARG 363 N -1.91 3.32 -0.15 1.70 3.52 -0.35 -1.23 118.95 123.84 3h7f s ARG 363 Ca -0.00 -0.67 0.02 0.00 -0.13 0.00 0.00 55.73 54.95 3h7f s ARG 363 Cb -0.09 -2.88 0.02 0.00 -1.56 0.00 0.00 34.95 30.44 3h7f s ARG 363 CO 0.02 -0.13 -0.20 0.42 -0.81 0.00 0.00 175.30 174.60 3h7f s ILE 364 N 1.26 1.96 0.20 4.11 1.01 -0.60 -3.34 121.20 125.80 3h7f s ILE 364 Ca 0.03 -0.90 0.09 0.00 0.00 0.00 0.00 60.65 59.87 3h7f s ILE 364 Cb -0.14 -1.76 -0.04 0.00 0.01 0.00 0.00 42.46 40.52 3h7f s ILE 364 CO -0.04 0.53 -0.09 -0.83 0.00 0.00 0.00 174.94 174.51 3h7f s GLY 365 N 1.07 1.72 -0.00 6.18 0.00 -0.08 -1.00 107.32 115.22 3h7f s GLY 365 Ca -0.01 -1.51 0.11 0.00 0.00 0.00 0.00 44.72 43.30 3h7f s GLY 365 CO -0.07 -1.54 0.44 -1.30 0.00 0.00 0.00 173.10 170.63 3h7f n THR 366 N -0.11 0.00 -0.12 0.90 -2.24 -0.85 -4.52 114.28 107.34 3h7f n THR 366 Ca -0.10 -0.24 -0.05 0.00 -2.27 0.00 0.00 64.05 61.39 3h7f n THR 366 Cb 0.56 0.88 0.03 0.00 -2.10 0.00 0.00 70.33 69.70 3h7f n THR 366 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 3h7f h PRO 367 N 0.00 0.21 -0.44 -0.78 0.11 -1.87 -2.03 132.00 127.20 3h7f h PRO 367 Ca 0.00 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 66.10 3h7f h PRO 367 Cb 0.30 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 31.35 3h7f h PRO 367 CO 0.00 0.14 0.27 0.00 -0.21 0.00 0.00 178.00 178.20 3h7f h ALA 368 N 1.30 0.57 -0.23 -0.75 0.00 -1.82 -1.48 119.26 116.85 3h7f h ALA 368 Ca 0.19 -0.06 -0.11 0.00 0.00 0.00 0.00 54.91 54.94 3h7f h ALA 368 Cb 0.23 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 3h7f h ALA 368 CO -0.25 0.05 -0.33 -0.07 0.00 0.00 0.00 179.25 178.64 3h7f h LEU 369 N 0.59 0.50 -0.50 0.00 3.38 -1.69 -2.38 115.31 115.21 3h7f h LEU 369 Ca 0.16 -0.20 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 3h7f h LEU 369 Cb -0.01 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 3h7f h LEU 369 CO -0.03 0.81 0.23 0.00 0.09 0.00 0.00 178.44 179.54 3h7f h ALA 370 N 1.23 0.65 -0.88 1.53 0.00 -1.13 -1.94 119.26 118.71 3h7f h ALA 370 Ca 0.05 -0.13 0.07 0.00 0.00 0.00 0.00 54.91 54.90 3h7f h ALA 370 Cb 0.79 -0.20 -0.06 0.00 0.00 0.00 0.00 17.79 18.32 3h7f h ALA 370 CO 0.06 0.22 0.57 1.15 0.00 0.00 0.00 179.25 181.26 3h7f h THR 371 N 0.67 1.04 0.00 0.00 2.02 -1.14 -1.34 112.91 114.15 3h7f h THR 371 Ca 0.17 -0.33 0.00 0.00 0.77 0.00 0.00 66.41 67.02 3h7f h THR 371 Cb 0.14 -0.01 0.00 0.00 -1.74 0.00 0.00 68.15 66.54 3h7f h THR 371 CO -0.02 0.18 0.00 -0.09 0.37 0.00 0.00 175.52 175.96 3h7f h ARG 372 N 0.97 0.00 0.00 6.66 2.43 -1.11 -3.47 114.38 119.86 3h7f h ARG 372 Ca 0.38 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.55 3h7f h ARG 372 Cb 0.24 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.79 3h7f h ARG 372 CO -0.15 0.00 0.00 0.41 -1.51 0.00 0.00 179.97 178.72 3h7f n GLY 373 N 0.20 1.02 3.77 2.80 0.00 -0.51 -4.88 105.19 107.60 3h7f n GLY 373 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 3h7f n GLY 373 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3h7f s PHE 374 N -2.00 2.79 0.00 1.61 0.40 -0.77 -4.99 117.98 115.01 3h7f s PHE 374 Ca 0.00 1.15 0.00 0.00 -0.60 0.00 0.00 56.93 57.48 3h7f s PHE 374 Cb 0.00 -3.92 0.00 0.00 0.51 0.00 0.00 43.02 39.61 3h7f s PHE 374 CO 0.00 -2.75 0.00 0.41 0.70 0.00 0.00 175.22 173.58 3h7f n GLY 375 N 1.04 7.03 0.35 4.36 0.00 -1.26 -4.57 105.19 112.15 3h7f n GLY 375 Ca 0.03 -2.02 0.01 0.00 0.00 0.00 0.00 46.02 44.03 3h7f n GLY 375 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3h7f h ASP 376 N 0.00 0.98 -0.37 1.61 5.19 -1.96 -0.84 116.42 121.02 3h7f h ASP 376 Ca 0.00 0.01 0.03 0.00 -0.62 0.00 0.00 57.03 56.45 3h7f h ASP 376 Cb 0.00 -0.20 -0.04 0.00 0.18 0.00 0.00 39.33 39.27 3h7f h ASP 376 CO 0.00 0.64 0.16 0.74 -3.12 0.00 0.00 179.24 177.66 3h7f h THR 377 N 1.12 0.94 -0.30 0.35 2.02 -2.00 -1.33 112.91 113.71 3h7f h THR 377 Ca 0.40 -0.12 -0.13 0.00 0.77 0.00 0.00 66.41 67.34 3h7f h THR 377 Cb 0.11 0.57 -0.00 0.00 -1.74 0.00 0.00 68.15 67.09 3h7f h THR 377 CO -0.15 0.06 -0.30 -0.33 0.37 0.00 0.00 175.52 175.17 3h7f h GLU 378 N 0.34 0.74 -0.09 6.66 3.07 -1.79 -2.97 114.58 120.54 3h7f h GLU 378 Ca 0.16 -0.39 -0.05 0.00 -0.50 0.00 0.00 59.36 58.59 3h7f h GLU 378 Cb 0.10 0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.02 3h7f h GLU 378 CO -0.14 1.01 -0.16 0.74 -1.40 0.00 0.00 179.01 179.06 3h7f h PHE 379 N 0.49 0.14 -0.73 4.33 0.04 -1.09 -1.87 116.94 118.26 3h7f h PHE 379 Ca 0.05 -0.02 -0.04 0.00 2.80 0.00 0.00 57.97 60.76 3h7f h PHE 379 Cb 0.87 -0.04 -0.03 0.00 2.20 0.00 0.00 35.95 38.95 3h7f h PHE 379 CO 0.07 0.30 0.29 1.15 -0.60 0.00 0.00 178.31 179.52 3h7f h THR 380 N 0.13 1.25 -0.21 -1.55 2.02 -1.15 -1.22 112.91 112.19 3h7f h THR 380 Ca 0.03 -0.79 -0.04 0.00 0.77 0.00 0.00 66.41 66.37 3h7f h THR 380 Cb 0.37 0.40 -0.01 0.00 -1.74 0.00 0.00 68.15 67.17 3h7f h THR 380 CO 0.02 0.32 -0.04 -0.08 0.37 0.00 0.00 175.52 176.11 3h7f h GLU 381 N 1.05 0.40 -0.41 6.66 4.57 -1.34 -2.51 114.58 123.01 3h7f h GLU 381 Ca 0.24 -0.15 -0.09 0.00 -1.18 0.00 0.00 59.36 58.18 3h7f h GLU 381 Cb 0.21 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 28.76 3h7f h GLU 381 CO -0.02 0.64 -0.12 -0.39 -1.18 0.00 0.00 179.01 177.94 3h7f h VAL 382 N 0.13 1.26 -0.57 0.32 -1.51 -1.26 -2.07 116.25 112.55 3h7f h VAL 382 Ca 0.05 -1.16 0.05 0.00 -1.23 0.00 0.00 66.70 64.41 3h7f h VAL 382 Cb 0.49 1.07 -0.05 0.00 -2.13 0.00 0.00 31.29 30.67 3h7f h VAL 382 CO 0.02 0.39 0.30 0.00 -1.23 0.00 0.00 177.57 177.06 3h7f h ALA 383 N 1.20 0.73 -0.64 5.19 0.00 -1.22 -1.89 119.26 122.63 3h7f h ALA 383 Ca 0.11 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 3h7f h ALA 383 Cb 0.58 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.25 3h7f h ALA 383 CO 0.04 -0.02 0.24 0.22 0.00 0.00 0.00 179.25 179.73 3h7f h ASP 384 N 0.58 0.90 -0.07 0.00 3.58 -1.14 -1.58 116.42 118.69 3h7f h ASP 384 Ca 0.25 -0.18 0.04 0.00 0.42 0.00 0.00 57.03 57.55 3h7f h ASP 384 Cb 0.13 -0.23 -0.05 0.00 1.72 0.00 0.00 39.33 40.90 3h7f h ASP 384 CO -0.16 0.83 -0.24 0.40 -2.88 0.00 0.00 179.24 177.20 3h7f h ILE 385 N 0.90 0.43 -0.02 2.25 2.04 -1.11 -1.60 117.51 120.41 3h7f h ILE 385 Ca 0.21 0.00 0.01 0.00 1.00 0.00 0.00 64.86 66.08 3h7f h ILE 385 Cb 0.23 0.43 -0.01 0.00 -0.74 0.00 0.00 36.82 36.73 3h7f h ILE 385 CO -0.01 0.00 -0.04 0.40 0.00 0.00 0.00 178.15 178.49 3h7f h ILE 386 N -0.34 0.88 -0.93 -0.67 2.04 -1.28 -1.98 117.51 115.23 3h7f h ILE 386 Ca 0.08 0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.98 3h7f h ILE 386 Cb 0.46 0.88 -0.06 0.00 -0.74 0.00 0.00 36.82 37.36 3h7f h ILE 386 CO -0.26 0.00 0.60 0.00 0.00 0.00 0.00 178.15 178.49 3h7f h ALA 387 N 0.94 1.24 -0.29 1.87 0.00 -1.25 -2.06 119.26 119.72 3h7f h ALA 387 Ca 0.02 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 3h7f h ALA 387 Cb 0.10 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 3h7f h ALA 387 CO -0.06 0.45 0.03 1.15 0.00 0.00 0.00 179.25 180.82 3h7f h THR 388 N 1.15 1.24 -0.65 0.00 2.02 -1.17 -2.01 112.91 113.49 3h7f h THR 388 Ca 0.38 -0.86 0.06 0.00 0.77 0.00 0.00 66.41 66.75 3h7f h THR 388 Cb 0.03 1.24 -0.05 0.00 -1.74 0.00 0.00 68.15 67.63 3h7f h THR 388 CO -0.13 0.28 0.37 0.00 0.37 0.00 0.00 175.52 176.40 3h7f h ALA 389 N 0.86 0.87 0.00 6.16 0.00 -1.13 -2.75 119.26 123.27 3h7f h ALA 389 Ca 0.09 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 3h7f h ALA 389 Cb 0.38 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 3h7f h ALA 389 CO 0.01 0.05 -0.05 -0.07 0.00 0.00 0.00 179.25 179.19 3h7f h LEU 390 N 0.68 0.00 0.00 0.00 3.38 -1.26 -3.35 115.31 114.76 3h7f h LEU 390 Ca 0.29 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.26 3h7f h LEU 390 Cb 0.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.92 3h7f h LEU 390 CO -0.17 0.05 -1.63 0.00 0.09 0.00 0.00 178.44 176.77 3h7f n ALA 391 N -2.11 3.32 1.18 1.53 0.00 -0.77 -4.61 120.51 119.05 3h7f n ALA 391 Ca 0.03 -0.51 0.12 0.00 0.00 0.00 0.00 53.44 53.09 3h7f n ALA 391 Cb 0.51 -0.71 0.24 0.00 0.00 0.00 0.00 19.45 19.49 3h7f n ALA 391 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3h7f n THR 392 N -1.99 0.00 -2.82 0.00 -2.24 -1.05 -4.79 114.28 101.39 3h7f n THR 392 Ca -0.01 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.51 3h7f n THR 392 Cb 0.47 0.86 0.00 0.00 -2.10 0.00 0.00 70.33 69.55 3h7f n THR 392 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3h7f n GLY 393 N 1.34 2.81 0.00 3.38 0.00 -1.26 -2.09 105.19 109.37 3h7f n GLY 393 Ca 0.13 -0.27 0.05 0.00 0.00 0.00 0.00 46.02 45.93 3h7f n GLY 393 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3h7f n SER 394 N 1.33 0.00 -0.50 1.61 3.41 -1.26 -2.17 113.62 116.03 3h7f n SER 394 Ca 0.00 0.47 0.11 0.00 -0.26 0.00 0.00 58.87 59.19 3h7f n SER 394 Cb 0.00 -0.48 0.42 0.00 -0.26 0.00 0.00 64.21 63.89 3h7f n SER 394 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 3h7f n SER 395 N -1.48 1.53 -4.65 4.04 7.64 -0.89 -4.98 113.62 114.83 3h7f n SER 395 Ca 0.03 -1.64 -0.45 0.00 1.01 0.00 0.00 58.87 57.82 3h7f n SER 395 Cb 0.13 -0.08 -0.03 0.00 -1.01 0.00 0.00 64.21 63.23 3h7f n SER 395 CO 0.00 0.00 0.00 0.55 -3.01 0.00 0.00 175.04 172.58 3h7f n VAL 396 N 0.22 1.18 -3.43 0.44 3.14 -0.92 -4.95 118.33 114.01 3h7f n VAL 396 Ca 0.17 -0.29 -0.44 0.00 -2.96 0.00 0.00 64.34 60.81 3h7f n VAL 396 Cb 0.32 -1.31 -0.04 0.00 -1.06 0.00 0.00 33.84 31.75 3h7f n VAL 396 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 3h7f s ASP 397 N 0.07 6.40 0.26 6.55 -1.08 -1.26 -4.95 116.67 122.66 3h7f s ASP 397 Ca 0.67 -2.76 -0.03 0.00 -0.52 0.00 0.00 52.55 49.90 3h7f s ASP 397 Cb -0.68 -2.12 0.33 0.00 -1.46 0.00 0.00 42.92 38.99 3h7f s ASP 397 CO 0.53 -0.51 1.82 0.58 0.52 0.00 0.00 175.17 178.10 3h7f h VAL 398 N 4.86 1.23 -0.35 1.11 2.07 -1.97 -2.69 116.25 120.52 3h7f h VAL 398 Ca 0.08 -0.79 -0.01 0.00 0.82 0.00 0.00 66.70 66.80 3h7f h VAL 398 Cb 1.01 0.53 -0.02 0.00 -1.52 0.00 0.00 31.29 31.30 3h7f h VAL 398 CO 0.74 0.31 0.20 -1.28 0.02 0.00 0.00 177.57 177.56 3h7f h SER 399 N 0.93 0.43 -0.68 0.57 0.87 -1.93 -0.44 113.55 113.30 3h7f h SER 399 Ca 0.21 -0.08 -0.07 0.00 -1.23 0.00 0.00 61.79 60.62 3h7f h SER 399 Cb 0.25 -0.11 -0.03 0.00 -0.44 0.00 0.00 62.40 62.07 3h7f h SER 399 CO -0.01 0.38 0.13 0.00 -0.53 0.00 0.00 176.83 176.81 3h7f h ALA 400 N 1.07 0.95 -0.18 6.23 0.00 -1.96 -1.90 119.26 123.46 3h7f h ALA 400 Ca 0.12 -0.26 -0.15 0.00 0.00 0.00 0.00 54.91 54.62 3h7f h ALA 400 Cb 0.04 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.57 3h7f h ALA 400 CO -0.02 0.66 -0.48 -0.07 0.00 0.00 0.00 179.25 179.34 3h7f h LEU 401 N 1.04 0.73 -0.73 0.00 3.38 -1.36 -2.83 115.31 115.54 3h7f h LEU 401 Ca 0.21 -0.58 -0.01 0.00 0.09 0.00 0.00 57.88 57.59 3h7f h LEU 401 Cb 0.41 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.91 3h7f h LEU 401 CO 0.01 1.18 0.42 0.50 0.09 0.00 0.00 178.44 180.64 3h7f h LYS 402 N 0.31 1.00 -0.80 1.13 3.64 -1.06 -2.22 116.57 118.59 3h7f h LYS 402 Ca -0.01 -0.10 0.04 0.00 -1.27 0.00 0.00 60.65 59.31 3h7f h LYS 402 Cb 1.10 -0.20 -0.05 0.00 -0.41 0.00 0.00 32.23 32.66 3h7f h LYS 402 CO 0.10 0.73 0.52 -0.44 -2.27 0.00 0.00 179.45 178.09 3h7f h ASP 403 N 1.00 0.82 -0.39 4.20 3.32 -1.35 -1.36 116.42 122.66 3h7f h ASP 403 Ca 0.26 -0.01 -0.12 0.00 0.02 0.00 0.00 57.03 57.18 3h7f h ASP 403 Cb -0.00 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.35 3h7f h ASP 403 CO -0.05 0.55 -0.21 0.03 -1.72 0.00 0.00 179.24 177.84 3h7f h ARG 404 N 0.94 0.88 -0.29 3.56 3.08 -1.19 -2.19 114.38 119.19 3h7f h ARG 404 Ca 0.32 -0.36 -0.05 0.00 0.07 0.00 0.00 59.98 59.96 3h7f h ARG 404 Cb 0.10 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.10 3h7f h ARG 404 CO -0.10 1.01 -0.01 0.00 -1.07 0.00 0.00 179.97 179.80 3h7f h ALA 405 N 0.98 0.39 -0.43 0.04 0.00 -1.12 -2.98 119.26 116.14 3h7f h ALA 405 Ca 0.10 -0.23 -0.06 0.00 0.00 0.00 0.00 54.91 54.71 3h7f h ALA 405 Cb 0.76 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 3h7f h ALA 405 CO 0.06 0.14 -0.00 0.00 0.00 0.00 0.00 179.25 179.45 3h7f h THR 406 N 0.29 1.23 -0.32 0.00 1.03 -1.27 -2.16 112.91 111.71 3h7f h THR 406 Ca 0.08 -0.93 0.06 0.00 -0.01 0.00 0.00 66.41 65.61 3h7f h THR 406 Cb 0.44 0.90 -0.06 0.00 -1.07 0.00 0.00 68.15 68.36 3h7f h THR 406 CO 0.02 0.33 -0.09 -0.09 -0.01 0.00 0.00 175.52 175.68 3h7f h ARG 407 N 0.66 -0.01 -0.33 0.00 2.43 -1.37 -1.36 114.38 114.40 3h7f h ARG 407 Ca 0.13 0.00 0.02 0.00 -0.81 0.00 0.00 59.98 59.33 3h7f h ARG 407 Cb 0.41 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.93 3h7f h ARG 407 CO 0.02 -0.01 0.16 -0.07 -1.51 0.00 0.00 179.97 178.56 3h7f h LEU 408 N -0.01 0.24 -0.84 3.80 3.38 -1.35 -2.19 115.31 118.33 3h7f h LEU 408 Ca 0.15 0.02 0.04 0.00 0.09 0.00 0.00 57.88 58.18 3h7f h LEU 408 Cb 0.24 -0.03 -0.05 0.00 0.09 0.00 0.00 40.66 40.91 3h7f h LEU 408 CO -0.33 0.18 0.53 0.00 0.09 0.00 0.00 178.44 178.91 3h7f h ALA 409 N 1.17 1.13 -0.06 1.53 0.00 -1.17 -2.66 119.26 119.20 3h7f h ALA 409 Ca 0.14 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.91 3h7f h ALA 409 Cb 0.05 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 3h7f h ALA 409 CO -0.09 0.33 -0.50 0.00 0.00 0.00 0.00 179.25 178.98 3h7f h ARG 410 N 1.01 0.15 0.00 0.00 3.08 -1.12 -3.15 114.38 114.34 3h7f h ARG 410 Ca 0.35 -0.08 -0.01 0.00 0.07 0.00 0.00 59.98 60.30 3h7f h ARG 410 Cb 0.08 0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.13 3h7f h ARG 410 CO -0.14 0.62 -0.07 0.00 -1.07 0.00 0.00 179.97 179.31 3h7f h ALA 411 N 1.37 0.98 -2.69 0.04 0.00 -1.07 -3.36 119.26 114.53 3h7f h ALA 411 Ca 0.00 -0.06 -0.61 0.00 0.00 0.00 0.00 54.91 54.24 3h7f h ALA 411 Cb 0.93 -0.01 -0.41 0.00 0.00 0.00 0.00 17.79 18.29 3h7f h ALA 411 CO 0.07 0.09 -0.68 1.19 0.00 0.00 0.00 179.25 179.92 3h7f n PHE 412 N -3.15 2.42 -1.73 0.00 3.72 -1.03 -5.10 117.46 112.58 3h7f n PHE 412 Ca 0.02 -4.06 -0.40 0.00 -0.05 0.00 0.00 57.45 52.95 3h7f n PHE 412 Cb 0.43 -0.45 0.02 0.00 -0.94 0.00 0.00 39.48 38.54 3h7f n PHE 412 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 176.76 174.41 3h7f n PRO 413 N 1.81 1.95 -4.24 -1.08 -0.02 -1.26 -4.88 135.00 127.29 3h7f n PRO 413 Ca 0.24 0.70 -0.34 0.00 -2.02 0.00 0.00 63.50 62.08 3h7f n PRO 413 Cb 0.40 -2.52 -0.11 0.00 -0.02 0.00 0.00 33.50 31.25 3h7f n PRO 413 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 3h7f s LEU 414 N -2.53 3.50 -1.46 2.45 2.96 -1.26 -4.65 118.68 117.69 3h7f s LEU 414 Ca 0.64 -0.03 -0.10 0.00 -0.22 0.00 0.00 54.13 54.42 3h7f s LEU 414 Cb -0.46 -1.86 0.06 0.00 0.50 0.00 0.00 46.19 44.43 3h7f s LEU 414 CO 0.55 0.18 0.96 -1.22 -1.32 0.00 0.00 176.35 175.50 3h7f n TYR 415 N 3.50 -2.31 -2.15 5.38 4.01 -1.26 -4.88 117.16 119.45 3h7f n TYR 415 Ca -0.17 0.91 -0.43 0.00 -0.16 0.00 0.00 57.90 58.05 3h7f n TYR 415 Cb 0.52 -4.23 -0.03 0.00 -0.31 0.00 0.00 39.34 35.30 3h7f n TYR 415 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 3h7f s ASP 416 N -3.54 6.69 0.00 7.72 2.15 -1.26 -2.13 116.67 126.29 3h7f s ASP 416 Ca 0.51 1.95 0.00 0.00 0.43 0.00 0.00 52.55 55.44 3h7f s ASP 416 Cb -0.25 -2.53 0.00 0.00 -0.30 0.00 0.00 42.92 39.83 3h7f s ASP 416 CO 0.81 -0.95 0.00 0.61 -0.17 0.00 0.00 175.17 175.47 3h7f n GLY 417 N 4.09 0.69 0.36 2.66 0.00 -1.26 -5.00 105.19 106.73 3h7f n GLY 417 Ca 0.17 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.27 3h7f n GLY 417 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3h7f h LEU 418 N 0.00 0.86 -0.69 0.99 6.46 -1.81 -1.83 115.31 119.29 3h7f h LEU 418 Ca 0.00 0.05 0.00 0.00 -0.12 0.00 0.00 57.88 57.81 3h7f h LEU 418 Cb 0.00 -0.12 0.00 0.00 -0.73 0.00 0.00 40.66 39.81 3h7f h LEU 418 CO 0.00 0.43 0.00 -0.62 -0.62 0.00 0.00 178.44 177.63 3h7f n GLU 419 N -4.62 0.07 -0.00 1.25 4.71 -1.26 -2.05 120.64 118.73 3h7f n GLU 419 Ca 0.19 0.56 0.05 0.00 -0.01 0.00 0.00 57.16 57.95 3h7f n GLU 419 Cb 0.41 -1.72 -0.06 0.00 -1.01 0.00 0.00 31.44 29.05 3h7f n GLU 419 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 3h7f n GLU 420 N -1.87 3.21 -2.33 3.49 4.71 -0.69 -5.04 120.64 122.11 3h7f n GLU 420 Ca -0.01 -0.00 -0.37 0.00 -0.01 0.00 0.00 57.16 56.77 3h7f n GLU 420 Cb 0.03 -1.03 -0.02 0.00 -1.01 0.00 0.00 31.44 29.40 3h7f n GLU 420 CO 0.00 0.00 0.00 -1.58 0.09 0.00 0.00 177.13 175.64 3h7f s TRP 421 N -2.08 2.97 0.25 -0.32 0.51 -0.87 -5.06 118.94 114.33 3h7f s TRP 421 Ca 0.04 1.56 -0.02 0.00 -2.12 0.00 0.00 56.10 55.56 3h7f s TRP 421 Cb 0.08 -3.31 -0.05 0.00 -0.81 0.00 0.00 33.47 29.39 3h7f s TRP 421 CO 0.46 -1.28 0.47 0.45 -0.51 0.00 0.00 176.95 176.54 3h7f s SER 422 N -1.44 6.40 0.12 2.95 0.15 -1.26 -5.04 113.70 115.58 3h7f s SER 422 Ca 0.63 0.53 -0.20 0.00 0.70 0.00 0.00 55.95 57.60 3h7f s SER 422 Cb -0.26 -2.06 -0.06 0.00 -1.71 0.00 0.00 66.02 61.92 3h7f s SER 422 CO 0.32 -0.12 1.73 -0.07 1.20 0.00 0.00 173.24 176.30 3h7f h LEU 423 N 1.77 -0.05 -8.69 3.45 3.38 -1.98 -3.45 115.31 109.74 3h7f h LEU 423 Ca -0.48 0.03 -0.39 0.00 0.09 0.00 0.00 57.88 57.13 3h7f h LEU 423 Cb 1.19 0.06 -0.16 0.00 0.09 0.00 0.00 40.66 41.84 3h7f h LEU 423 CO 0.67 -0.00 -0.74 0.68 0.09 0.00 0.00 178.44 179.14 3h7f s VAL 424 N -6.19 1.38 0.00 1.22 -7.23 -1.26 -4.80 120.40 103.52 3h7f s VAL 424 Ca -0.13 -1.97 0.00 0.00 -1.81 0.00 0.00 61.98 58.07 3h7f s VAL 424 Cb 0.09 -1.78 0.00 0.00 0.56 0.00 0.00 36.38 35.25 3h7f s VAL 424 CO 0.68 -0.58 0.00 0.61 -0.31 0.00 0.00 175.10 175.50 3h7f n GLY 425 N 0.04 -0.69 0.40 2.32 0.00 -1.26 -5.22 105.19 100.78 3h7f n GLY 425 Ca -0.12 -1.12 0.05 0.00 0.00 0.00 0.00 46.02 44.83 3h7f n GLY 425 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86