#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 0.63 -0.10 1.61 3.41 -1.26 -3.40 113.62 114.51 3h7f n SER 0 Ca 0.00 0.62 0.13 0.00 -0.26 0.00 0.00 58.87 59.36 3h7f n SER 0 Cb 0.00 -0.76 0.51 0.00 -0.26 0.00 0.00 64.21 63.69 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 0.39 -0.42 4.33 2.07 -2.07 -2.44 114.93 116.79 3h7f h MET 1 Ca 0.00 -0.02 0.00 0.00 -2.07 0.00 0.00 59.70 57.61 3h7f h MET 1 Cb 0.49 -0.09 0.00 0.00 -1.87 0.00 0.00 31.60 30.13 3h7f h MET 1 CO 0.00 0.26 0.00 0.43 1.07 0.00 0.00 176.91 178.67 3h7f n SER 2 N -4.47 3.40 -4.75 1.22 7.64 -1.22 -5.02 113.62 110.42 3h7f n SER 2 Ca 0.11 -2.20 -0.40 0.00 1.01 0.00 0.00 58.87 57.39 3h7f n SER 2 Cb 0.42 -0.35 -0.05 0.00 -1.01 0.00 0.00 64.21 63.22 3h7f n SER 2 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3h7f s ALA 3 N -1.36 3.37 0.60 -0.43 0.00 -0.92 -5.05 121.76 117.97 3h7f s ALA 3 Ca 0.32 0.41 -0.18 0.00 0.00 0.00 0.00 51.96 52.51 3h7f s ALA 3 Cb 0.19 -3.06 -0.03 0.00 0.00 0.00 0.00 23.12 20.22 3h7f s ALA 3 CO 0.18 0.16 1.20 -1.25 0.00 0.00 0.00 175.76 176.05 3h7f s PRO 4 N -0.62 2.92 0.33 0.00 0.04 -1.26 -4.80 135.00 131.61 3h7f s PRO 4 Ca 0.39 1.80 0.11 0.00 0.04 0.00 0.00 61.00 63.34 3h7f s PRO 4 Cb -0.23 -1.93 0.96 0.00 0.04 0.00 0.00 34.50 33.35 3h7f s PRO 4 CO 0.27 -1.24 1.70 1.25 0.04 0.00 0.00 177.00 179.02 3h7f h LEU 5 N 0.78 0.59 -1.58 -3.56 5.85 -1.96 -0.33 115.31 115.09 3h7f h LEU 5 Ca -0.50 0.16 0.12 0.00 0.84 0.00 0.00 57.88 58.50 3h7f h LEU 5 Cb 1.29 0.08 -0.04 0.00 0.37 0.00 0.00 40.66 42.36 3h7f h LEU 5 CO 0.55 -0.00 0.46 0.00 -0.34 0.00 0.00 178.44 179.11 3h7f h ALA 6 N 1.78 2.04 0.03 1.25 0.00 -1.92 -1.15 119.26 121.29 3h7f h ALA 6 Ca 0.68 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.53 3h7f h ALA 6 Cb 1.40 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.11 3h7f h ALA 6 CO -0.53 -0.21 -0.27 0.93 0.00 0.00 0.00 179.25 179.17 3h7f h GLU 7 N 0.45 0.06 -0.38 0.00 5.08 -1.45 -3.36 114.58 114.98 3h7f h GLU 7 Ca 0.33 -0.10 -0.16 0.00 -1.00 0.00 0.00 59.36 58.43 3h7f h GLU 7 Cb 0.68 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.97 3h7f h GLU 7 CO -0.10 1.05 -0.37 0.28 -1.00 0.00 0.00 179.01 178.86 3h7f h VAL 8 N -0.87 1.27 -1.73 3.13 2.07 -1.13 -3.41 116.25 115.58 3h7f h VAL 8 Ca -0.06 -1.55 -0.43 0.00 0.82 0.00 0.00 66.70 65.48 3h7f h VAL 8 Cb 1.16 1.39 -0.30 0.00 -1.52 0.00 0.00 31.29 32.02 3h7f h VAL 8 CO 0.01 0.52 -0.82 -0.67 0.02 0.00 0.00 177.57 176.63 3h7f n ASP 9 N -4.08 -1.43 -0.14 0.57 -0.08 -0.46 -5.03 116.55 105.90 3h7f n ASP 9 Ca -0.02 -2.65 0.11 0.00 -1.51 0.00 0.00 54.79 50.72 3h7f n ASP 9 Cb 0.54 0.28 0.44 0.00 2.34 0.00 0.00 41.12 44.72 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 5.08 0.53 -0.39 -0.67 0.11 -1.71 -1.90 132.00 133.04 3h7f h PRO 10 Ca 0.15 -0.03 -0.08 0.00 0.11 0.00 0.00 66.00 66.14 3h7f h PRO 10 Cb 0.97 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 31.95 3h7f h PRO 10 CO 0.28 0.35 -0.08 -0.44 -0.21 0.00 0.00 178.00 177.90 3h7f h ASP 11 N 0.54 0.75 -0.49 -2.05 3.32 -1.93 -1.83 116.42 114.73 3h7f h ASP 11 Ca 0.32 -0.35 -0.13 0.00 0.02 0.00 0.00 57.03 56.89 3h7f h ASP 11 Cb 0.52 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.85 3h7f h ASP 11 CO -0.10 0.93 -0.19 0.40 -1.72 0.00 0.00 179.24 178.55 3h7f h ILE 12 N 0.56 1.27 -0.72 0.35 1.08 -1.81 -2.34 117.51 115.91 3h7f h ILE 12 Ca 0.10 -1.36 0.07 0.00 -0.39 0.00 0.00 64.86 63.29 3h7f h ILE 12 Cb 0.59 1.10 -0.06 0.00 -3.07 0.00 0.00 36.82 35.37 3h7f h ILE 12 CO 0.04 0.47 0.40 0.00 -0.69 0.00 0.00 178.15 178.36 3h7f h ALA 13 N 0.88 0.98 -0.44 1.87 0.00 -1.27 -1.48 119.26 119.79 3h7f h ALA 13 Ca 0.12 0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.96 3h7f h ALA 13 Cb 0.77 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 3h7f h ALA 13 CO 0.06 0.05 -0.08 1.49 0.00 0.00 0.00 179.25 180.78 3h7f h GLU 14 N 0.71 0.78 -0.37 0.00 4.57 -1.23 -2.75 114.58 116.28 3h7f h GLU 14 Ca 0.33 -0.24 -0.12 0.00 -1.18 0.00 0.00 59.36 58.15 3h7f h GLU 14 Cb 0.25 -0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 28.76 3h7f h GLU 14 CO -0.21 0.83 -0.26 -0.07 -1.18 0.00 0.00 179.01 178.12 3h7f h LEU 15 N 0.71 0.79 -0.76 1.64 3.38 -1.00 -0.72 115.31 119.35 3h7f h LEU 15 Ca 0.13 -0.30 0.05 0.00 0.09 0.00 0.00 57.88 57.84 3h7f h LEU 15 Cb 0.55 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 41.02 3h7f h LEU 15 CO 0.03 1.01 0.47 -0.07 0.09 0.00 0.00 178.44 179.97 3h7f h LEU 16 N 0.66 0.74 -0.42 1.67 4.07 -1.15 -1.42 115.31 119.46 3h7f h LEU 16 Ca 0.08 0.01 -0.06 0.00 0.08 0.00 0.00 57.88 58.00 3h7f h LEU 16 Cb 0.78 -0.14 -0.02 0.00 1.08 0.00 0.00 40.66 42.36 3h7f h LEU 16 CO 0.06 0.49 0.04 0.00 -1.08 0.00 0.00 178.44 177.95 3h7f h ALA 17 N 1.35 0.56 -0.76 1.53 0.00 -1.16 -2.24 119.26 118.53 3h7f h ALA 17 Ca 0.32 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 3h7f h ALA 17 Cb 0.11 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 3h7f h ALA 17 CO -0.15 0.30 0.37 0.87 0.00 0.00 0.00 179.25 180.64 3h7f h LYS 18 N 0.56 1.10 -0.44 0.00 1.57 -1.00 -1.81 116.57 116.55 3h7f h LYS 18 Ca 0.12 -0.16 -0.13 0.00 -1.87 0.00 0.00 60.65 58.61 3h7f h LYS 18 Cb 0.42 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.52 3h7f h LYS 18 CO 0.01 0.85 -0.24 1.49 -0.57 0.00 0.00 179.45 180.99 3h7f h GLU 19 N 1.07 0.91 -0.65 3.15 4.57 -1.16 -2.00 114.58 120.47 3h7f h GLU 19 Ca 0.26 -0.39 0.05 0.00 -1.18 0.00 0.00 59.36 58.10 3h7f h GLU 19 Cb 0.12 -0.03 -0.05 0.00 -0.16 0.00 0.00 28.75 28.63 3h7f h GLU 19 CO -0.03 1.05 0.37 1.25 -1.18 0.00 0.00 179.01 180.46 3h7f h LEU 20 N 0.78 0.56 -0.71 1.64 5.85 -1.33 -1.31 115.31 120.78 3h7f h LEU 20 Ca 0.10 0.02 0.01 0.00 0.84 0.00 0.00 57.88 58.85 3h7f h LEU 20 Cb 0.80 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 41.71 3h7f h LEU 20 CO 0.07 0.37 0.47 1.23 -0.34 0.00 0.00 178.44 180.23 3h7f h GLY 21 N 0.69 1.01 0.93 3.75 0.00 -1.10 -1.89 103.07 106.46 3h7f h GLY 21 Ca 0.28 -0.37 -0.05 0.00 0.00 0.00 0.00 47.33 47.20 3h7f h GLY 21 CO -0.16 0.35 0.06 -0.09 0.00 0.00 0.00 176.54 176.70 3h7f h ARG 22 N 0.94 0.66 -0.83 4.80 2.43 -1.11 0.47 114.38 121.74 3h7f h ARG 22 Ca 0.27 -0.18 0.04 0.00 -0.81 0.00 0.00 59.98 59.30 3h7f h ARG 22 Cb -0.08 -0.08 -0.05 0.00 -0.42 0.00 0.00 29.97 29.34 3h7f h ARG 22 CO -0.07 0.71 0.53 1.96 -1.51 0.00 0.00 179.97 181.59 3h7f h GLN 23 N 0.50 1.00 -0.47 0.20 4.20 -1.11 -2.52 115.11 116.91 3h7f h GLN 23 Ca 0.12 -0.06 -0.13 0.00 0.06 0.00 0.00 58.65 58.64 3h7f h GLN 23 Cb 0.37 -0.23 -0.01 0.00 0.30 0.00 0.00 27.48 27.91 3h7f h GLN 23 CO 0.01 0.66 -0.22 0.00 -0.67 0.00 0.00 178.83 178.61 3h7f h ARG 24 N 1.03 0.98 0.00 1.46 3.08 -0.94 -3.36 114.38 116.63 3h7f h ARG 24 Ca 0.34 -0.43 -0.10 0.00 0.07 0.00 0.00 59.98 59.86 3h7f h ARG 24 Cb 0.03 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.03 3h7f h ARG 24 CO -0.12 1.10 -0.87 -0.44 -1.07 0.00 0.00 179.97 178.57 3h7f h ASP 25 N 0.83 0.00 -1.84 7.04 3.32 -0.76 -3.45 116.42 121.56 3h7f h ASP 25 Ca 0.11 0.00 -0.45 0.00 0.02 0.00 0.00 57.03 56.71 3h7f h ASP 25 Cb 0.80 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.35 3h7f h ASP 25 CO 0.07 0.40 -0.36 0.42 -1.72 0.00 0.00 179.24 178.04 3h7f s THR 26 N -3.04 4.09 -0.47 0.35 -4.23 -0.96 -4.85 115.64 106.54 3h7f s THR 26 Ca 0.01 -1.05 -0.15 0.00 -1.18 0.00 0.00 61.69 59.31 3h7f s THR 26 Cb 0.08 -3.41 0.07 0.00 1.34 0.00 0.00 72.50 70.58 3h7f s THR 26 CO 0.77 -0.17 0.39 -0.76 -0.54 0.00 0.00 174.62 174.31 3h7f s LEU 27 N -4.13 5.61 -0.46 4.79 1.43 -0.44 -4.95 118.68 120.53 3h7f s LEU 27 Ca 0.43 -1.33 -0.29 0.00 -1.03 0.00 0.00 54.13 51.92 3h7f s LEU 27 Cb -0.09 -2.18 0.03 0.00 0.03 0.00 0.00 46.19 43.98 3h7f s LEU 27 CO 0.30 -0.64 1.12 -0.70 0.23 0.00 0.00 176.35 176.66 3h7f s GLU 28 N 1.64 3.75 -0.16 1.70 2.56 -1.26 -1.65 118.70 125.28 3h7f s GLU 28 Ca 0.04 0.59 0.14 0.00 0.00 0.00 0.00 54.97 55.75 3h7f s GLU 28 Cb -0.24 -3.89 0.41 0.00 2.00 0.00 0.00 34.13 32.40 3h7f s GLU 28 CO 0.07 -1.32 1.20 -1.33 -0.56 0.00 0.00 175.26 173.32 3h7f n MET 29 N 7.69 1.24 -2.66 4.30 2.81 -0.12 -4.29 117.12 126.09 3h7f n MET 29 Ca 0.12 -2.97 -0.43 0.00 -1.81 0.00 0.00 57.70 52.61 3h7f n MET 29 Cb 0.49 -1.28 -0.02 0.00 -0.71 0.00 0.00 33.22 31.69 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 -2.54 4.71 0.54 2.02 1.01 -1.17 -1.33 121.20 124.44 3h7f s ILE 30 Ca 0.36 2.02 0.27 0.00 0.00 0.00 0.00 60.65 63.30 3h7f s ILE 30 Cb 0.36 -4.30 0.32 0.00 0.01 0.00 0.00 42.46 38.86 3h7f s ILE 30 CO -0.08 -0.09 2.19 0.00 0.00 0.00 0.00 174.94 176.96 3h7f h ALA 31 N 7.31 1.53 -0.15 9.38 0.00 -1.86 -2.39 119.26 133.08 3h7f h ALA 31 Ca -0.25 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.63 3h7f h ALA 31 Cb 1.10 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.89 3h7f h ALA 31 CO 0.92 0.04 0.00 -1.13 0.00 0.00 0.00 179.25 179.08 3h7f n SER 32 N -3.90 1.80 -4.86 0.00 3.41 -1.26 -4.83 113.62 103.98 3h7f n SER 32 Ca -0.03 -1.69 -0.22 0.00 -0.26 0.00 0.00 58.87 56.66 3h7f n SER 32 Cb 0.12 -0.09 -0.04 0.00 -0.26 0.00 0.00 64.21 63.94 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 -1.82 3.05 0.17 4.33 2.02 -0.90 -4.88 118.70 120.68 3h7f s GLU 33 Ca 0.34 -0.95 -0.06 0.00 0.02 0.00 0.00 54.97 54.32 3h7f s GLU 33 Cb 0.19 -2.66 0.02 0.00 0.10 0.00 0.00 34.13 31.78 3h7f s GLU 33 CO 0.28 0.42 0.33 -1.71 0.02 0.00 0.00 175.26 174.61 3h7f n ASN 34 N -1.09 -0.96 -4.00 -0.19 2.85 -1.26 -3.92 115.26 106.69 3h7f n ASN 34 Ca -0.08 -1.74 -0.30 0.00 -0.11 0.00 0.00 54.58 52.35 3h7f n ASN 34 Cb 0.57 1.63 -0.16 0.00 1.24 0.00 0.00 39.78 43.05 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 -5.60 2.12 0.54 1.20 0.08 -1.26 -4.97 117.98 110.08 3h7f s PHE 35 Ca 0.08 -1.23 -0.19 0.00 0.12 0.00 0.00 56.93 55.71 3h7f s PHE 35 Cb -0.02 -1.55 -0.06 0.00 -0.57 0.00 0.00 43.02 40.82 3h7f s PHE 35 CO 0.06 -0.66 1.12 0.14 -0.10 0.00 0.00 175.22 175.78 3h7f s VAL 36 N 1.50 3.24 0.69 -0.44 -7.23 -1.26 -4.94 120.40 111.95 3h7f s VAL 36 Ca 0.04 0.76 -0.12 0.00 -1.81 0.00 0.00 61.98 60.85 3h7f s VAL 36 Cb -0.13 -3.31 0.01 0.00 0.56 0.00 0.00 36.38 33.51 3h7f s VAL 36 CO -0.10 -0.17 1.07 -2.16 -0.31 0.00 0.00 175.10 173.43 3h7f s PRO 37 N -3.30 2.86 0.29 4.82 0.04 -1.26 -4.91 135.00 133.54 3h7f s PRO 37 Ca 0.72 1.07 0.02 0.00 0.04 0.00 0.00 61.00 62.85 3h7f s PRO 37 Cb -0.23 -1.98 0.73 0.00 0.04 0.00 0.00 34.50 33.06 3h7f s PRO 37 CO 0.26 -1.17 1.62 -0.09 0.04 0.00 0.00 177.00 177.67 3h7f h ARG 38 N -0.55 0.13 0.00 4.56 2.43 -2.01 -1.86 114.38 117.08 3h7f h ARG 38 Ca -0.44 -0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 58.67 3h7f h ARG 38 Cb 1.22 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.73 3h7f h ARG 38 CO 0.56 0.08 -0.25 0.00 -1.51 0.00 0.00 179.97 178.85 3h7f h ALA 39 N 1.84 1.54 -0.10 2.80 0.00 -2.00 -2.16 119.26 121.19 3h7f h ALA 39 Ca 0.57 -0.23 -0.24 0.00 0.00 0.00 0.00 54.91 55.01 3h7f h ALA 39 Cb 1.17 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.93 3h7f h ALA 39 CO -0.73 0.31 -0.87 0.28 0.00 0.00 0.00 179.25 178.24 3h7f h VAL 40 N 0.00 1.28 -0.50 0.00 2.07 -1.70 -2.53 116.25 114.87 3h7f h VAL 40 Ca -0.00 -2.09 0.08 0.00 0.82 0.00 0.00 66.70 65.51 3h7f h VAL 40 Cb 0.45 2.13 -0.07 0.00 -1.52 0.00 0.00 31.29 32.28 3h7f h VAL 40 CO 0.03 0.65 0.12 -0.07 0.02 0.00 0.00 177.57 178.33 3h7f h LEU 41 N 0.47 0.05 -0.43 2.57 3.38 -1.30 -1.11 115.31 118.95 3h7f h LEU 41 Ca -0.08 0.08 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 3h7f h LEU 41 Cb 1.51 0.10 -0.02 0.00 0.09 0.00 0.00 40.66 42.34 3h7f h LEU 41 CO 0.17 0.05 0.26 1.56 0.09 0.00 0.00 178.44 180.57 3h7f h GLN 42 N 0.27 0.59 -0.45 1.13 4.20 -1.39 -1.43 115.11 118.02 3h7f h GLN 42 Ca 0.25 -0.06 -0.03 0.00 0.06 0.00 0.00 58.65 58.88 3h7f h GLN 42 Cb 0.32 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 27.96 3h7f h GLN 42 CO -0.31 0.45 0.18 0.00 -0.67 0.00 0.00 178.83 178.48 3h7f h ALA 43 N 1.11 0.59 0.00 3.87 0.00 -1.22 -2.81 119.26 120.80 3h7f h ALA 43 Ca 0.16 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 3h7f h ALA 43 Cb 0.01 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 3h7f h ALA 43 CO -0.03 0.19 -0.14 1.96 0.00 0.00 0.00 179.25 181.23 3h7f h GLN 44 N 0.59 0.00 -0.70 0.00 4.20 -1.02 -2.46 115.11 115.71 3h7f h GLN 44 Ca 0.15 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.86 3h7f h GLN 44 Cb 0.19 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.97 3h7f h GLN 44 CO -0.01 0.14 0.00 0.41 -0.67 0.00 0.00 178.83 178.70 3h7f n GLY 45 N -0.88 2.37 3.94 3.46 0.00 -0.56 -4.87 105.19 108.65 3h7f n GLY 45 Ca -0.02 -0.60 -0.24 0.00 0.00 0.00 0.00 46.02 45.15 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 -0.56 5.81 0.00 1.61 1.04 -0.93 -5.00 113.70 115.68 3h7f s SER 46 Ca 0.36 0.48 0.18 0.00 0.48 0.00 0.00 55.95 57.44 3h7f s SER 46 Cb 0.26 -1.66 0.93 0.00 0.10 0.00 0.00 66.02 65.65 3h7f s SER 46 CO 0.12 -0.79 1.50 1.33 0.98 0.00 0.00 173.24 176.38 3h7f n VAL 47 N -2.24 0.35 0.33 5.02 0.24 -1.26 -3.13 118.33 117.65 3h7f n VAL 47 Ca 0.02 0.09 0.22 0.00 -2.04 0.00 0.00 64.34 62.63 3h7f n VAL 47 Cb 0.57 -0.80 1.18 0.00 -1.47 0.00 0.00 33.84 33.32 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 -1.98 1.34 4.07 -1.94 -1.00 115.31 115.80 3h7f h LEU 48 Ca 0.00 0.00 0.15 0.00 0.08 0.00 0.00 57.88 58.11 3h7f h LEU 48 Cb 0.12 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 41.84 3h7f h LEU 48 CO 0.00 0.00 0.48 0.00 -1.08 0.00 0.00 178.44 177.84 3h7f h THR 49 N 0.00 0.47 0.00 0.22 1.03 -1.90 -2.72 112.91 110.01 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 0.03 0.64 0.00 0.00 -1.07 0.00 0.00 68.15 67.76 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 -3.93 0.64 -4.67 0.00 3.02 -0.38 -4.84 115.26 105.10 3h7f n ASN 50 Ca 0.10 0.58 -0.38 0.00 -0.03 0.00 0.00 54.58 54.85 3h7f n ASN 50 Cb 0.69 -0.75 -0.07 0.00 -0.61 0.00 0.00 39.78 39.04 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 4.17 -0.28 3.52 2.47 -1.02 -5.05 119.74 120.41 3h7f s LYS 51 Ca 0.10 0.21 -0.24 0.00 -1.56 0.00 0.00 55.97 54.47 3h7f s LYS 51 Cb 0.12 -3.54 -0.00 0.00 -1.46 0.00 0.00 37.83 32.95 3h7f s LYS 51 CO 0.53 -0.06 0.83 0.71 0.16 0.00 0.00 175.35 177.52 3h7f s TYR 52 N 1.37 3.24 -0.34 4.03 1.51 -1.26 -4.75 117.35 121.15 3h7f s TYR 52 Ca 0.19 0.97 0.14 0.00 -1.01 0.00 0.00 57.07 57.36 3h7f s TYR 52 Cb -0.15 -3.19 0.46 0.00 -0.11 0.00 0.00 41.96 38.97 3h7f s TYR 52 CO 0.08 -0.52 1.06 0.00 -1.11 0.00 0.00 175.55 175.07 3h7f n ALA 53 N 6.18 3.98 -1.74 3.71 0.00 -1.26 -4.85 120.51 126.52 3h7f n ALA 53 Ca 0.05 -3.50 -0.42 0.00 0.00 0.00 0.00 53.44 49.57 3h7f n ALA 53 Cb 0.48 -0.72 -0.01 0.00 0.00 0.00 0.00 19.45 19.20 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 -0.39 2.61 0.00 0.00 1.02 -1.26 -4.64 120.64 117.98 3h7f n GLU 54 Ca 0.23 0.93 0.00 0.00 -0.02 0.00 0.00 57.16 58.29 3h7f n GLU 54 Cb 0.79 -2.67 0.00 0.00 -0.02 0.00 0.00 31.44 29.54 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 1.63 0.24 3.34 0.62 0.00 -1.26 -1.56 105.19 108.19 3h7f n GLY 55 Ca 0.07 -1.92 -0.18 0.00 0.00 0.00 0.00 46.02 43.99 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 2.50 0.07 0.99 1.43 -0.97 -4.96 118.68 117.74 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 -0.55 -0.16 0.00 0.03 0.00 0.00 46.19 45.52 3h7f s LEU 56 CO 0.00 -0.27 1.47 -2.65 0.23 0.00 0.00 176.35 175.13 3h7f n PRO 57 N -0.38 1.50 -0.11 1.29 -0.02 -1.26 -0.97 135.00 135.05 3h7f n PRO 57 Ca -0.08 0.54 0.00 0.00 -2.02 0.00 0.00 63.50 61.95 3h7f n PRO 57 Cb 0.61 -2.24 0.00 0.00 -0.02 0.00 0.00 33.50 31.85 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 3.02 2.52 2.34 -1.23 0.00 -1.26 -4.85 105.19 105.73 3h7f n GLY 58 Ca 0.19 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.03 3h7f n GLY 58 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 3h7f n ARG 59 N -2.00 0.86 -3.80 1.61 1.85 -0.14 -5.13 116.66 109.91 3h7f n ARG 59 Ca 0.00 -2.90 -0.24 0.00 -1.00 0.00 0.00 57.85 53.71 3h7f n ARG 59 Cb 0.00 -1.41 -0.02 0.00 -1.05 0.00 0.00 32.46 29.98 3h7f n ARG 59 CO 0.00 0.00 0.00 1.03 -0.01 0.00 0.00 177.63 178.65 3h7f s ARG 60 N -1.21 3.46 0.18 2.89 1.81 -1.20 -2.29 118.95 122.60 3h7f s ARG 60 Ca 0.35 -0.56 -0.11 0.00 -1.72 0.00 0.00 55.73 53.69 3h7f s ARG 60 Cb 0.26 -2.85 0.10 0.00 -0.45 0.00 0.00 34.95 32.01 3h7f s ARG 60 CO -0.11 0.39 1.75 1.88 -0.68 0.00 0.00 175.30 178.53 3h7f h TYR 61 N 1.46 0.99 -2.22 -0.53 -1.99 -1.64 -3.47 116.97 109.58 3h7f h TYR 61 Ca -0.50 -0.07 -0.59 0.00 2.00 0.00 0.00 58.73 59.57 3h7f h TYR 61 Cb 1.21 -0.30 -0.12 0.00 2.00 0.00 0.00 36.73 39.52 3h7f h TYR 61 CO 0.50 0.78 -0.72 0.71 -0.00 0.00 0.00 178.16 179.43 3h7f s TYR 62 N -5.56 2.44 0.96 4.88 2.02 -1.26 -5.12 117.35 115.71 3h7f s TYR 62 Ca -0.13 -0.29 -0.16 0.00 -0.37 0.00 0.00 57.07 56.12 3h7f s TYR 62 Cb 0.14 -1.07 0.23 0.00 -0.40 0.00 0.00 41.96 40.86 3h7f s TYR 62 CO 0.81 0.68 1.12 0.41 -1.57 0.00 0.00 175.55 177.00 3h7f n GLY 63 N -0.72 -1.93 2.15 0.71 0.00 -1.26 -4.53 105.19 99.62 3h7f n GLY 63 Ca -0.06 -1.63 -0.01 0.00 0.00 0.00 0.00 46.02 44.33 3h7f n GLY 63 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h7f n GLY 64 N -3.24 0.46 0.95 -0.02 0.00 -1.26 -4.94 105.19 97.14 3h7f n GLY 64 Ca 0.14 -0.19 0.07 0.00 0.00 0.00 0.00 46.02 46.05 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 2.68 0.59 0.19 0.00 9.09 -1.97 -0.65 114.58 124.52 3h7f h GLU 66 Ca 0.00 -0.04 -0.25 0.00 0.05 0.00 0.00 59.36 59.12 3h7f h GLU 66 Cb 0.76 -0.13 0.03 0.00 -1.65 0.00 0.00 28.75 27.76 3h7f h GLU 66 CO 0.05 0.39 -1.10 0.45 0.05 0.00 0.00 179.01 178.86 3h7f h HIS 67 N 0.61 0.74 0.00 2.06 3.86 -2.02 -3.21 115.15 117.19 3h7f h HIS 67 Ca 0.44 -0.54 -0.05 0.00 -1.16 0.00 0.00 60.37 59.06 3h7f h HIS 67 Cb 0.61 -0.03 -0.01 0.00 1.06 0.00 0.00 27.41 29.04 3h7f h HIS 67 CO -0.10 1.42 -0.25 -0.39 0.86 0.00 0.00 177.93 179.47 3h7f h VAL 68 N -0.14 0.94 -0.53 2.45 -1.51 -1.84 -2.53 116.25 113.09 3h7f h VAL 68 Ca -0.19 -0.93 -0.07 0.00 -1.23 0.00 0.00 66.70 64.29 3h7f h VAL 68 Cb 1.86 1.54 -0.02 0.00 -2.13 0.00 0.00 31.29 32.54 3h7f h VAL 68 CO 0.21 0.24 0.07 0.44 -1.23 0.00 0.00 177.57 177.30 3h7f h ASP 69 N 0.00 0.85 -0.70 4.19 5.19 -1.20 -1.79 116.42 122.96 3h7f h ASP 69 Ca -0.00 -0.27 -0.04 0.00 -0.62 0.00 0.00 57.03 56.10 3h7f h ASP 69 Cb 0.52 -0.23 -0.03 0.00 0.18 0.00 0.00 39.33 39.77 3h7f h ASP 69 CO 0.03 0.91 0.28 0.58 -3.12 0.00 0.00 179.24 177.91 3h7f h VAL 70 N 0.76 1.25 -0.06 -1.35 2.07 -1.47 -1.71 116.25 115.74 3h7f h VAL 70 Ca 0.16 -0.78 0.03 0.00 0.82 0.00 0.00 66.70 66.93 3h7f h VAL 70 Cb 0.43 0.44 -0.04 0.00 -1.52 0.00 0.00 31.29 30.60 3h7f h VAL 70 CO 0.01 0.31 -0.17 0.58 0.02 0.00 0.00 177.57 178.33 3h7f h VAL 71 N 1.01 0.58 -0.78 2.57 2.07 -1.35 -1.24 116.25 119.11 3h7f h VAL 71 Ca 0.23 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.71 3h7f h VAL 71 Cb 0.22 0.58 -0.03 0.00 -1.52 0.00 0.00 31.29 30.53 3h7f h VAL 71 CO -0.02 0.00 0.31 -0.08 0.02 0.00 0.00 177.57 177.80 3h7f h GLU 72 N -0.24 1.16 -0.46 1.57 4.81 -1.24 -2.32 114.58 117.85 3h7f h GLU 72 Ca 0.07 -0.21 -0.07 0.00 -0.13 0.00 0.00 59.36 59.03 3h7f h GLU 72 Cb 0.35 -0.19 -0.02 0.00 0.63 0.00 0.00 28.75 29.52 3h7f h GLU 72 CO -0.21 0.94 -0.00 -0.91 -0.73 0.00 0.00 179.01 178.10 3h7f h ASN 73 N 1.13 0.73 -0.43 1.04 2.35 -1.18 -1.08 115.58 118.13 3h7f h ASN 73 Ca 0.26 -0.17 -0.00 0.00 -0.55 0.00 0.00 56.30 55.83 3h7f h ASN 73 Cb 0.21 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.37 3h7f h ASN 73 CO -0.02 0.80 0.26 -0.07 -1.65 0.00 0.00 177.43 176.74 3h7f h LEU 74 N 0.71 0.51 -0.31 1.61 3.38 -0.96 -0.05 115.31 120.20 3h7f h LEU 74 Ca 0.14 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 3h7f h LEU 74 Cb 0.44 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 3h7f h LEU 74 CO 0.02 0.42 0.16 0.00 0.09 0.00 0.00 178.44 179.13 3h7f h ALA 75 N 1.12 0.40 0.15 1.53 0.00 -1.20 -1.03 119.26 120.22 3h7f h ALA 75 Ca 0.15 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 3h7f h ALA 75 Cb 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.67 3h7f h ALA 75 CO -0.03 -0.05 -0.07 0.00 0.00 0.00 0.00 179.25 179.10 3h7f h ARG 76 N 0.38 -0.20 -0.42 0.00 3.08 -1.07 -1.94 114.38 114.21 3h7f h ARG 76 Ca 0.11 0.01 -0.10 0.00 0.07 0.00 0.00 59.98 60.07 3h7f h ARG 76 Cb 0.09 0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.17 3h7f h ARG 76 CO -0.02 -0.13 -0.14 -0.44 -1.07 0.00 0.00 179.97 178.17 3h7f h ASP 77 N -0.21 0.78 -0.50 7.04 3.32 -1.00 -1.73 116.42 124.13 3h7f h ASP 77 Ca -0.02 -0.25 -0.10 0.00 0.02 0.00 0.00 57.03 56.68 3h7f h ASP 77 Cb 0.16 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.48 3h7f h ASP 77 CO 0.03 0.93 -0.08 0.03 -1.72 0.00 0.00 179.24 178.44 3h7f h ARG 78 N 0.70 0.96 -0.30 3.56 3.08 -1.17 -2.20 114.38 119.02 3h7f h ARG 78 Ca 0.11 -0.33 -0.02 0.00 0.07 0.00 0.00 59.98 59.81 3h7f h ARG 78 Cb 0.64 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.60 3h7f h ARG 78 CO 0.04 1.00 0.11 0.00 -1.07 0.00 0.00 179.97 180.05 3h7f h ALA 79 N 1.04 0.39 -0.26 0.04 0.00 -1.17 -0.15 119.26 119.15 3h7f h ALA 79 Ca 0.14 -0.13 0.03 0.00 0.00 0.00 0.00 54.91 54.95 3h7f h ALA 79 Cb 0.61 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.26 3h7f h ALA 79 CO 0.04 -0.00 0.07 0.87 0.00 0.00 0.00 179.25 180.23 3h7f h LYS 80 N 0.33 0.18 -0.22 0.00 1.57 -1.26 -2.50 116.57 114.67 3h7f h LYS 80 Ca 0.10 -0.01 -0.04 0.00 -1.87 0.00 0.00 60.65 58.83 3h7f h LYS 80 Cb 0.20 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.46 3h7f h LYS 80 CO -0.01 0.12 -0.01 0.00 -0.57 0.00 0.00 179.45 178.98 3h7f h ALA 81 N 1.17 0.30 -0.81 3.86 0.00 -1.32 0.99 119.26 123.45 3h7f h ALA 81 Ca 0.11 -0.22 0.03 0.00 0.00 0.00 0.00 54.91 54.83 3h7f h ALA 81 Cb 0.09 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 17.76 3h7f h ALA 81 CO -0.13 0.04 0.52 1.25 0.00 0.00 0.00 179.25 180.93 3h7f h LEU 82 N 0.15 0.87 -0.77 0.00 5.85 -1.02 -3.24 115.31 117.16 3h7f h LEU 82 Ca 0.06 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.77 3h7f h LEU 82 Cb 0.43 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.26 3h7f h LEU 82 CO 0.01 0.61 -0.54 0.49 -0.34 0.00 0.00 178.44 178.67 3h7f n PHE 83 N -4.57 0.00 -2.73 1.25 3.72 -0.94 -4.94 117.46 109.25 3h7f n PHE 83 Ca 0.09 0.00 -0.15 0.00 -0.05 0.00 0.00 57.45 57.34 3h7f n PHE 83 Cb 0.07 0.00 0.02 0.00 -0.94 0.00 0.00 39.48 38.63 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 1.37 -0.13 3.93 1.37 0.00 0.27 -4.85 105.19 107.15 3h7f n GLY 84 Ca 0.07 -0.18 -0.27 0.00 0.00 0.00 0.00 46.02 45.65 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 -2.95 3.88 0.18 4.61 0.00 -0.74 -4.91 121.76 121.84 3h7f s ALA 85 Ca 0.19 -0.90 0.05 0.00 0.00 0.00 0.00 51.96 51.29 3h7f s ALA 85 Cb -0.08 -1.92 0.05 0.00 0.00 0.00 0.00 23.12 21.18 3h7f s ALA 85 CO 0.23 0.47 1.42 0.93 0.00 0.00 0.00 175.76 178.82 3h7f h GLU 86 N 2.06 0.13 -3.52 0.00 5.08 -1.86 -3.44 114.58 113.03 3h7f h GLU 86 Ca -0.48 -0.14 -0.09 0.00 -1.00 0.00 0.00 59.36 57.65 3h7f h GLU 86 Cb 1.19 0.04 -0.16 0.00 0.50 0.00 0.00 28.75 30.32 3h7f h GLU 86 CO 0.68 0.88 -0.30 -0.59 -1.00 0.00 0.00 179.01 178.68 3h7f s PHE 87 N -3.26 -0.00 -0.01 4.33 -0.12 -0.66 -4.77 117.98 113.49 3h7f s PHE 87 Ca -0.02 -0.25 -0.03 0.00 -0.05 0.00 0.00 56.93 56.57 3h7f s PHE 87 Cb 0.11 0.04 -0.00 0.00 -0.63 0.00 0.00 43.02 42.53 3h7f s PHE 87 CO 0.81 -0.51 0.07 0.00 -0.05 0.00 0.00 175.22 175.54 3h7f s ALA 88 N -3.03 -0.15 -0.11 1.99 0.00 -1.26 -1.85 121.76 117.34 3h7f s ALA 88 Ca -0.02 -0.12 0.02 0.00 0.00 0.00 0.00 51.96 51.84 3h7f s ALA 88 Cb 0.01 0.02 0.01 0.00 0.00 0.00 0.00 23.12 23.17 3h7f s ALA 88 CO -0.06 -0.13 -0.17 1.21 0.00 0.00 0.00 175.76 176.61 3h7f s ASN 89 N -0.84 2.58 -0.02 0.00 3.84 -0.29 -4.96 114.94 115.24 3h7f s ASN 89 Ca -0.09 -0.46 0.13 0.00 0.21 0.00 0.00 52.86 52.65 3h7f s ASN 89 Cb -0.06 -1.16 0.40 0.00 -0.55 0.00 0.00 41.25 39.88 3h7f s ASN 89 CO 0.00 0.03 1.34 1.33 -2.79 0.00 0.00 177.10 177.01 3h7f n VAL 90 N 4.17 1.15 0.25 -5.21 0.24 -1.26 -1.79 118.33 115.89 3h7f n VAL 90 Ca -0.19 -1.09 0.12 0.00 -2.04 0.00 0.00 64.34 61.14 3h7f n VAL 90 Cb 0.51 0.42 0.14 0.00 -1.47 0.00 0.00 33.84 33.44 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 2.48 0.00 -6.55 7.34 4.20 -1.97 -3.47 115.11 117.15 3h7f h GLN 91 Ca 0.00 0.00 -0.59 0.00 0.06 0.00 0.00 58.65 58.12 3h7f h GLN 91 Cb 0.87 0.00 0.08 0.00 0.30 0.00 0.00 27.48 28.74 3h7f h GLN 91 CO 0.03 0.00 0.55 -2.30 -0.67 0.00 0.00 178.83 176.44 3h7f n PRO 92 N -2.80 1.88 0.22 1.46 -0.02 -1.26 -4.77 135.00 129.71 3h7f n PRO 92 Ca 0.03 0.67 0.15 0.00 -2.02 0.00 0.00 63.50 62.33 3h7f n PRO 92 Cb 0.52 -2.29 0.60 0.00 -0.02 0.00 0.00 33.50 32.30 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 3.99 0.00 -2.30 6.00 3.86 -1.91 -2.33 115.15 122.46 3h7f h HIS 93 Ca -0.45 0.00 0.19 0.00 -1.16 0.00 0.00 60.37 58.95 3h7f h HIS 93 Cb 1.29 0.00 -0.07 0.00 1.06 0.00 0.00 27.41 29.68 3h7f h HIS 93 CO 0.56 0.00 0.54 -1.54 0.86 0.00 0.00 177.93 178.34 3h7f s SER 94 N -5.13 -0.12 0.19 2.45 1.04 -1.26 -4.18 113.70 106.69 3h7f s SER 94 Ca 0.03 -0.45 -0.11 0.00 0.48 0.00 0.00 55.95 55.90 3h7f s SER 94 Cb 0.09 0.46 0.12 0.00 0.10 0.00 0.00 66.02 66.79 3h7f s SER 94 CO 0.49 -0.87 1.82 1.23 0.98 0.00 0.00 173.24 176.88 3h7f h GLY 95 N 2.00 1.00 1.01 7.32 0.00 -1.81 -1.76 103.07 110.82 3h7f h GLY 95 Ca -0.25 -0.44 -0.00 0.00 0.00 0.00 0.00 47.33 46.63 3h7f h GLY 95 CO 0.28 0.42 0.44 0.00 0.00 0.00 0.00 176.54 177.68 3h7f h ALA 96 N 1.19 0.92 -0.23 3.60 0.00 -1.96 -2.04 119.26 120.74 3h7f h ALA 96 Ca 0.24 -0.08 -0.11 0.00 0.00 0.00 0.00 54.91 54.96 3h7f h ALA 96 Cb 0.02 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 3h7f h ALA 96 CO -0.04 0.39 -0.32 1.96 0.00 0.00 0.00 179.25 181.24 3h7f h GLN 97 N 0.99 0.48 -0.12 0.00 7.50 -1.93 -1.15 115.11 120.87 3h7f h GLN 97 Ca 0.26 -0.21 -0.00 0.00 0.50 0.00 0.00 58.65 59.20 3h7f h GLN 97 Cb -0.03 -0.01 -0.01 0.00 0.05 0.00 0.00 27.48 27.47 3h7f h GLN 97 CO -0.05 0.75 0.07 0.00 -1.50 0.00 0.00 178.83 178.10 3h7f h ALA 98 N 1.25 0.15 -0.75 3.87 0.00 -1.10 -2.41 119.26 120.27 3h7f h ALA 98 Ca 0.05 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.87 3h7f h ALA 98 Cb 0.77 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.48 3h7f h ALA 98 CO 0.06 -0.33 0.26 -0.91 0.00 0.00 0.00 179.25 178.33 3h7f h ASN 99 N 0.12 1.07 -0.89 0.00 -0.26 -1.19 -1.79 115.58 112.64 3h7f h ASN 99 Ca 0.04 -0.19 0.04 0.00 -0.56 0.00 0.00 56.30 55.63 3h7f h ASN 99 Cb 0.04 -0.28 -0.06 0.00 -1.06 0.00 0.00 38.32 36.96 3h7f h ASN 99 CO -0.01 0.98 0.57 0.00 -1.06 0.00 0.00 177.43 177.91 3h7f h ALA 100 N 1.13 1.20 -0.31 -0.83 0.00 -1.16 -2.12 119.26 117.18 3h7f h ALA 100 Ca 0.25 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 55.05 3h7f h ALA 100 Cb 0.27 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 3h7f h ALA 100 CO -0.01 0.39 -0.10 0.00 0.00 0.00 0.00 179.25 179.54 3h7f h ALA 101 N 1.38 0.43 -0.57 0.00 0.00 -1.26 -2.04 119.26 117.19 3h7f h ALA 101 Ca 0.37 -0.30 0.02 0.00 0.00 0.00 0.00 54.91 55.00 3h7f h ALA 101 Cb 0.06 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.71 3h7f h ALA 101 CO -0.14 0.27 0.35 0.28 0.00 0.00 0.00 179.25 180.02 3h7f h VAL 102 N 0.37 1.08 -0.36 0.00 2.07 -1.03 -1.37 116.25 117.00 3h7f h VAL 102 Ca 0.08 -0.24 -0.14 0.00 0.82 0.00 0.00 66.70 67.21 3h7f h VAL 102 Cb 0.60 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 30.67 3h7f h VAL 102 CO 0.03 0.13 -0.33 -0.07 0.02 0.00 0.00 177.57 177.35 3h7f h LEU 103 N 0.70 0.86 -0.67 2.57 3.38 -1.40 -1.40 115.31 119.35 3h7f h LEU 103 Ca 0.23 -0.36 0.09 0.00 0.09 0.00 0.00 57.88 57.93 3h7f h LEU 103 Cb 0.01 -0.24 -0.07 0.00 0.09 0.00 0.00 40.66 40.45 3h7f h LEU 103 CO -0.09 1.11 0.31 -0.74 0.09 0.00 0.00 178.44 179.12 3h7f h HIS 104 N 0.68 0.56 -0.27 1.13 2.76 -1.20 -1.85 115.15 116.96 3h7f h HIS 104 Ca 0.07 0.03 -0.16 0.00 -2.20 0.00 0.00 60.37 58.10 3h7f h HIS 104 Cb 0.88 -0.15 -0.00 0.00 1.55 0.00 0.00 27.41 29.69 3h7f h HIS 104 CO 0.05 0.19 -0.49 0.00 -1.30 0.00 0.00 177.93 176.38 3h7f h ALA 105 N 1.41 0.62 0.00 5.26 0.00 -0.89 -3.37 119.26 122.29 3h7f h ALA 105 Ca 0.33 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 54.75 3h7f h ALA 105 Cb 0.35 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.05 3h7f h ALA 105 CO -0.27 0.68 -1.38 1.28 0.00 0.00 0.00 179.25 179.56 3h7f n LEU 106 N -4.01 0.54 -4.03 0.00 4.77 -0.56 -4.92 117.00 108.78 3h7f n LEU 106 Ca -0.03 -0.28 -0.10 0.00 -0.03 0.00 0.00 56.01 55.57 3h7f n LEU 106 Cb 0.59 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.62 3h7f n LEU 106 CO 0.48 0.13 0.11 0.00 -1.33 0.00 0.00 177.39 176.78 3h7f s MET 107 N -3.13 1.49 0.20 3.23 0.23 -0.71 -4.96 119.30 115.64 3h7f s MET 107 Ca 0.01 -1.31 0.11 0.00 -1.03 0.00 0.00 55.69 53.46 3h7f s MET 107 Cb 0.14 0.44 -0.04 0.00 -1.53 0.00 0.00 34.83 33.84 3h7f s MET 107 CO 0.84 -0.60 -0.20 -1.12 -2.03 0.00 0.00 175.02 171.92 3h7f s SER 108 N -3.04 3.68 0.29 -1.18 0.01 -1.26 -4.56 113.70 107.63 3h7f s SER 108 Ca 0.25 -0.80 -0.29 0.00 1.31 0.00 0.00 55.95 56.41 3h7f s SER 108 Cb 0.01 -0.39 -0.13 0.00 0.21 0.00 0.00 66.02 65.72 3h7f s SER 108 CO 0.09 0.11 1.26 -2.65 0.41 0.00 0.00 173.24 172.46 3h7f n PRO 109 N 0.11 1.87 0.00 12.44 -0.02 -1.26 -2.09 135.00 146.04 3h7f n PRO 109 Ca -0.11 0.66 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 3h7f n PRO 109 Cb 0.56 -2.21 0.00 0.00 -0.02 0.00 0.00 33.50 31.83 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 1.40 2.55 3.82 -1.23 0.00 -0.18 -5.02 105.19 106.54 3h7f n GLY 110 Ca 0.09 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.70 2.22 -0.10 1.61 2.02 -0.89 -4.31 118.70 118.55 3h7f s GLU 111 Ca 0.00 0.60 -0.18 0.00 0.02 0.00 0.00 54.97 55.41 3h7f s GLU 111 Cb 0.00 -1.94 -0.04 0.00 0.10 0.00 0.00 34.13 32.25 3h7f s GLU 111 CO 0.00 -1.51 0.47 1.03 0.02 0.00 0.00 175.26 175.27 3h7f s ARG 112 N -5.20 4.31 -0.10 1.61 0.52 -1.26 -1.48 118.95 117.35 3h7f s ARG 112 Ca 0.60 0.45 0.04 0.00 -0.52 0.00 0.00 55.73 56.30 3h7f s ARG 112 Cb -0.14 -3.42 0.00 0.00 0.52 0.00 0.00 34.95 31.92 3h7f s ARG 112 CO 0.54 0.21 -0.22 -1.17 0.02 0.00 0.00 175.30 174.68 3h7f s LEU 113 N 0.45 2.01 -0.17 2.53 2.96 -0.50 -1.12 118.68 124.85 3h7f s LEU 113 Ca 0.26 -0.52 -0.01 0.00 -0.22 0.00 0.00 54.13 53.64 3h7f s LEU 113 Cb -0.15 -1.32 -0.01 0.00 0.50 0.00 0.00 46.19 45.21 3h7f s LEU 113 CO 0.11 0.13 -0.11 -0.22 -1.32 0.00 0.00 176.35 174.94 3h7f s LEU 114 N 0.45 2.68 0.26 -0.68 2.96 -0.78 -1.08 118.68 122.49 3h7f s LEU 114 Ca -0.17 -0.41 -0.07 0.00 -0.22 0.00 0.00 54.13 53.27 3h7f s LEU 114 Cb -0.17 -1.63 -0.01 0.00 0.50 0.00 0.00 46.19 44.87 3h7f s LEU 114 CO 0.07 0.07 0.39 -0.83 -1.32 0.00 0.00 176.35 174.73 3h7f s GLY 115 N 0.91 1.04 -0.00 7.98 0.00 -1.01 -1.01 107.32 115.23 3h7f s GLY 115 Ca -0.02 -1.27 -0.30 0.00 0.00 0.00 0.00 44.72 43.12 3h7f s GLY 115 CO -0.00 -0.93 1.39 -2.27 0.00 0.00 0.00 173.10 171.29 3h7f s LEU 116 N -3.12 4.31 0.17 0.66 2.96 -1.26 -1.78 118.68 120.62 3h7f s LEU 116 Ca 0.29 2.09 -0.33 0.00 -0.22 0.00 0.00 54.13 55.96 3h7f s LEU 116 Cb 0.01 -3.56 -0.16 0.00 0.50 0.00 0.00 46.19 42.98 3h7f s LEU 116 CO 0.13 -0.71 1.13 -0.67 -1.32 0.00 0.00 176.35 174.91 3h7f n ASP 117 N 5.36 1.18 -0.30 3.68 2.03 -0.85 -4.01 116.55 123.64 3h7f n ASP 117 Ca 0.13 1.14 0.03 0.00 0.52 0.00 0.00 54.79 56.62 3h7f n ASP 117 Cb 0.44 -1.19 0.18 0.00 -0.72 0.00 0.00 41.12 39.82 3h7f n ASP 117 CO 0.00 0.00 0.00 0.25 -1.92 0.00 0.00 177.20 175.53 3h7f h LEU 118 N 3.25 0.71 -2.03 -2.67 5.85 -1.89 -1.19 115.31 117.33 3h7f h LEU 118 Ca -0.43 0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.32 3h7f h LEU 118 Cb 1.35 -0.09 -0.00 0.00 0.37 0.00 0.00 40.66 42.29 3h7f h LEU 118 CO 0.69 0.40 -0.08 0.00 -0.34 0.00 0.00 178.44 179.11 3h7f h ALA 119 N 1.47 1.19 -0.34 1.25 0.00 -1.92 -2.70 119.26 118.21 3h7f h ALA 119 Ca 0.41 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.25 3h7f h ALA 119 Cb 0.38 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.16 3h7f h ALA 119 CO -0.25 0.10 0.00 0.09 0.00 0.00 0.00 179.25 179.19 3h7f n ASN 120 N -3.45 3.72 0.00 0.00 5.03 -0.76 -4.98 115.26 114.81 3h7f n ASN 120 Ca -0.02 -2.61 0.00 0.00 0.87 0.00 0.00 54.58 52.83 3h7f n ASN 120 Cb 0.22 -0.45 0.00 0.00 -1.02 0.00 0.00 39.78 38.53 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 0.05 1.02 3.80 7.41 0.00 -0.96 -4.82 105.19 111.69 3h7f n GLY 121 Ca 0.19 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.92 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 -1.10 1.59 0.29 -0.02 0.00 -0.52 -0.91 107.32 106.64 3h7f s GLY 122 Ca 0.00 -0.47 -0.01 0.00 0.00 0.00 0.00 44.72 44.24 3h7f s GLY 122 CO 0.00 0.06 0.50 -1.58 0.00 0.00 0.00 173.10 172.07 3h7f s HIS 123 N -3.28 3.49 0.59 1.90 2.46 -1.26 -4.45 115.29 114.74 3h7f s HIS 123 Ca 0.63 0.39 0.29 0.00 0.47 0.00 0.00 55.06 56.84 3h7f s HIS 123 Cb -0.14 -1.91 1.74 0.00 -0.13 0.00 0.00 32.58 32.13 3h7f s HIS 123 CO 0.53 0.22 2.18 1.37 -2.47 0.00 0.00 174.74 176.57 3h7f h LEU 124 N 1.31 0.00 -0.20 8.88 8.10 -1.98 -1.91 115.31 129.51 3h7f h LEU 124 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.50 3h7f h LEU 124 Cb 1.21 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 41.43 3h7f h LEU 124 CO 0.64 0.00 0.00 0.35 -4.11 0.00 0.00 178.44 175.32 3h7f n THR 125 N -3.83 0.04 -0.59 0.15 -2.24 -1.26 -2.33 114.28 104.22 3h7f n THR 125 Ca -0.01 -0.06 0.09 0.00 -2.27 0.00 0.00 64.05 61.80 3h7f n THR 125 Cb 0.19 -0.14 0.32 0.00 -2.10 0.00 0.00 70.33 68.60 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 -0.55 1.26 0.00 4.78 8.25 -0.72 -4.76 115.22 123.48 3h7f n HIS 126 Ca 0.12 -0.62 0.00 0.00 -0.26 0.00 0.00 57.72 56.97 3h7f n HIS 126 Cb 0.10 -0.20 0.00 0.00 1.12 0.00 0.00 29.99 31.01 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 0.92 -0.99 3.77 -1.41 0.00 -1.23 -4.45 105.19 101.80 3h7f n GLY 127 Ca 0.23 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.84 3h7f n GLY 127 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3h7f s MET 128 N 0.00 4.24 0.46 1.61 0.00 -0.99 -4.05 119.30 120.58 3h7f s MET 128 Ca 0.00 2.38 0.15 0.00 0.00 0.00 0.00 55.69 58.22 3h7f s MET 128 Cb 0.00 -3.04 1.11 0.00 0.00 0.00 0.00 34.83 32.90 3h7f s MET 128 CO 0.00 -0.37 2.01 0.07 0.00 0.00 0.00 175.02 176.72 3h7f h ARG 129 N 3.62 0.30 0.00 4.11 -0.00 -1.90 -2.16 114.38 118.34 3h7f h ARG 129 Ca -0.49 -0.02 0.00 0.00 -0.00 0.00 0.00 59.98 59.47 3h7f h ARG 129 Cb 1.23 -0.07 0.00 0.00 -0.00 0.00 0.00 29.97 31.13 3h7f h ARG 129 CO 0.68 0.20 -0.96 1.28 -0.00 0.00 0.00 179.97 181.17 3h7f n LEU 130 N -4.46 0.67 -4.86 0.08 4.77 -1.26 -3.73 117.00 108.21 3h7f n LEU 130 Ca 0.08 0.16 -0.31 0.00 -0.03 0.00 0.00 56.01 55.90 3h7f n LEU 130 Cb 0.35 -0.11 -0.01 0.00 -2.33 0.00 0.00 43.42 41.33 3h7f n LEU 130 CO 0.35 -0.06 0.71 0.21 -1.33 0.00 0.00 177.39 177.26 3h7f s ASN 131 N -4.47 6.36 0.38 -1.43 3.84 -0.83 -4.83 114.94 113.96 3h7f s ASN 131 Ca 0.03 1.48 0.19 0.00 0.21 0.00 0.00 52.86 54.77 3h7f s ASN 131 Cb 0.13 -2.48 1.15 0.00 -0.55 0.00 0.00 41.25 39.49 3h7f s ASN 131 CO 0.78 -0.78 1.71 2.19 -2.79 0.00 0.00 177.10 178.21 3h7f h PHE 132 N 0.12 0.73 0.00 0.43 -5.15 -1.92 -0.64 116.94 110.52 3h7f h PHE 132 Ca -0.45 0.03 -0.04 0.00 -0.20 0.00 0.00 57.97 57.31 3h7f h PHE 132 Cb 1.19 -0.20 -0.01 0.00 0.22 0.00 0.00 35.95 37.15 3h7f h PHE 132 CO 0.65 -0.05 -0.18 0.66 -2.00 0.00 0.00 178.31 177.39 3h7f h SER 133 N 0.33 0.00 0.20 -0.68 4.64 -1.86 -1.90 113.55 114.28 3h7f h SER 133 Ca 0.68 0.00 -0.35 0.00 -0.47 0.00 0.00 61.79 61.65 3h7f h SER 133 Cb 1.75 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.80 3h7f h SER 133 CO -0.42 0.18 -2.04 0.61 -0.87 0.00 0.00 176.83 174.29 3h7f n GLY 134 N -0.97 -0.71 0.29 -0.77 0.00 -0.52 -4.00 105.19 98.51 3h7f n GLY 134 Ca -0.02 -0.20 -0.11 0.00 0.00 0.00 0.00 46.02 45.69 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 0.03 1.01 0.00 1.61 1.79 -1.06 -3.33 116.57 116.62 3h7f h LYS 135 Ca -0.43 -0.41 -0.16 0.00 -2.18 0.00 0.00 60.65 57.47 3h7f h LYS 135 Cb 2.03 -0.04 -0.03 0.00 -1.58 0.00 0.00 32.23 32.61 3h7f h LYS 135 CO 0.05 1.10 -1.38 -0.07 -1.08 0.00 0.00 179.45 178.06 3h7f h LEU 136 N 0.88 0.00 -9.09 2.94 3.38 -1.57 -3.49 115.31 108.35 3h7f h LEU 136 Ca 0.12 0.00 -0.55 0.00 0.09 0.00 0.00 57.88 57.54 3h7f h LEU 136 Cb 0.76 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.37 3h7f h LEU 136 CO 0.06 0.56 -0.75 -0.31 0.09 0.00 0.00 178.44 178.09 3h7f s TYR 137 N -2.93 2.08 -0.29 1.13 2.02 -1.25 -1.01 117.35 117.10 3h7f s TYR 137 Ca -0.03 -0.42 -0.19 0.00 -0.37 0.00 0.00 57.07 56.07 3h7f s TYR 137 Cb 0.09 -0.92 -0.02 0.00 -0.40 0.00 0.00 41.96 40.71 3h7f s TYR 137 CO 0.81 0.59 0.55 -2.00 -1.57 0.00 0.00 175.55 173.92 3h7f s GLU 138 N -3.54 3.94 -0.12 -0.62 2.12 -0.55 -4.77 118.70 115.16 3h7f s GLU 138 Ca 0.27 0.22 -0.10 0.00 0.36 0.00 0.00 54.97 55.73 3h7f s GLU 138 Cb -0.04 -3.70 -0.05 0.00 0.26 0.00 0.00 34.13 30.61 3h7f s GLU 138 CO 0.12 -0.47 0.20 -0.80 -0.54 0.00 0.00 175.26 173.77 3h7f s ASN 139 N 1.62 6.44 0.17 -1.70 -0.87 -1.26 -1.40 114.94 117.92 3h7f s ASN 139 Ca 0.22 0.52 0.07 0.00 -1.57 0.00 0.00 52.86 52.10 3h7f s ASN 139 Cb -0.15 -2.12 -0.04 0.00 -0.02 0.00 0.00 41.25 38.91 3h7f s ASN 139 CO 0.11 0.31 -0.15 -0.83 -2.57 0.00 0.00 177.10 173.97 3h7f s GLY 140 N -0.59 1.30 0.04 0.66 0.00 -0.24 -4.95 107.32 103.53 3h7f s GLY 140 Ca 0.15 -1.51 0.03 0.00 0.00 0.00 0.00 44.72 43.40 3h7f s GLY 140 CO 0.05 -1.58 -0.10 -1.36 0.00 0.00 0.00 173.10 170.10 3h7f s PHE 141 N -2.56 0.86 0.38 1.90 0.08 -1.26 -2.40 117.98 114.98 3h7f s PHE 141 Ca 0.17 -0.39 0.08 0.00 0.12 0.00 0.00 56.93 56.91 3h7f s PHE 141 Cb -0.03 -0.51 -0.04 0.00 -0.57 0.00 0.00 43.02 41.87 3h7f s PHE 141 CO 0.05 -0.02 0.21 1.52 -0.10 0.00 0.00 175.22 176.88 3h7f s TYR 142 N -1.02 2.67 0.00 0.36 -0.85 -0.73 -4.94 117.35 112.84 3h7f s TYR 142 Ca -0.04 -0.48 0.00 0.00 -0.52 0.00 0.00 57.07 56.03 3h7f s TYR 142 Cb -0.08 -1.88 0.00 0.00 0.38 0.00 0.00 41.96 40.37 3h7f s TYR 142 CO 0.01 0.17 0.00 0.41 -1.52 0.00 0.00 175.55 174.62 3h7f n GLY 143 N -1.28 4.90 3.77 5.49 0.00 -1.26 -2.01 105.19 114.80 3h7f n GLY 143 Ca -0.01 -1.47 -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 4.32 0.10 1.61 -7.23 -1.26 -4.54 120.40 112.15 3h7f s VAL 144 Ca 0.00 -1.18 -0.31 0.00 -1.81 0.00 0.00 61.98 58.68 3h7f s VAL 144 Cb 0.00 -3.21 -0.09 0.00 0.56 0.00 0.00 36.38 33.64 3h7f s VAL 144 CO 0.00 -0.13 1.65 -0.62 -0.31 0.00 0.00 175.10 175.69 3h7f s ASP 145 N -3.12 6.58 0.62 4.85 2.15 -0.34 -4.91 116.67 122.49 3h7f s ASP 145 Ca 0.30 2.55 0.38 0.00 0.43 0.00 0.00 52.55 56.21 3h7f s ASP 145 Cb -0.10 -2.57 2.05 0.00 -0.30 0.00 0.00 42.92 42.00 3h7f s ASP 145 CO 0.22 -0.88 2.27 1.55 -0.17 0.00 0.00 175.17 178.16 3h7f h PRO 146 N 7.94 0.00 0.09 4.34 0.13 -1.98 -0.28 132.00 142.24 3h7f h PRO 146 Ca -0.43 0.00 -0.27 0.00 -0.87 0.00 0.00 66.00 64.43 3h7f h PRO 146 Cb 1.20 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.32 3h7f h PRO 146 CO 0.93 0.02 -1.43 0.00 -0.23 0.00 0.00 178.00 177.28 3h7f h ALA 147 N 1.98 0.23 0.00 -0.56 0.00 -1.97 -3.40 119.26 115.55 3h7f h ALA 147 Ca -0.00 -1.14 -0.06 0.00 0.00 0.00 0.00 54.91 53.71 3h7f h ALA 147 Cb 0.10 0.55 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 3h7f h ALA 147 CO 0.00 0.85 -1.49 0.25 0.00 0.00 0.00 179.25 178.87 3h7f n THR 148 N -3.98 0.58 -1.55 0.00 -2.24 -1.20 -4.98 114.28 100.91 3h7f n THR 148 Ca -0.27 -0.58 -0.18 0.00 -2.27 0.00 0.00 64.05 60.75 3h7f n THR 148 Cb 0.87 -0.31 -0.08 0.00 -2.10 0.00 0.00 70.33 68.71 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 -2.59 -0.01 -4.07 4.78 -0.00 -0.12 -4.55 115.22 108.66 3h7f n HIS 149 Ca -0.05 0.00 -0.29 0.00 -0.00 0.00 0.00 57.72 57.38 3h7f n HIS 149 Cb 0.65 -3.14 -0.06 0.00 -0.00 0.00 0.00 29.99 27.44 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 -4.21 3.76 0.02 2.41 1.43 -1.26 -4.79 118.68 116.04 3h7f s LEU 150 Ca 0.00 -0.08 -0.30 0.00 -1.03 0.00 0.00 54.13 52.72 3h7f s LEU 150 Cb 0.00 -2.42 -0.06 0.00 0.03 0.00 0.00 46.19 43.74 3h7f s LEU 150 CO 0.00 0.13 1.44 -0.63 0.23 0.00 0.00 176.35 177.51 3h7f s ILE 151 N -1.54 3.59 -0.45 -0.59 1.01 -1.26 -1.20 121.20 120.75 3h7f s ILE 151 Ca 0.30 1.00 -0.16 0.00 0.00 0.00 0.00 60.65 61.78 3h7f s ILE 151 Cb -0.11 -3.64 0.05 0.00 0.01 0.00 0.00 42.46 38.76 3h7f s ILE 151 CO 0.22 0.00 0.43 -0.62 0.00 0.00 0.00 174.94 174.97 3h7f s ASP 152 N 1.91 6.16 0.52 3.58 -1.08 -1.26 -4.93 116.67 121.57 3h7f s ASP 152 Ca 0.65 -1.02 0.30 0.00 -0.52 0.00 0.00 52.55 51.97 3h7f s ASP 152 Cb -0.33 -2.21 1.35 0.00 -1.46 0.00 0.00 42.92 40.27 3h7f s ASP 152 CO 0.28 -0.63 1.99 0.24 0.52 0.00 0.00 175.17 177.56 3h7f h MET 153 N 8.77 0.00 -0.51 4.34 2.86 -1.98 -1.62 114.93 126.80 3h7f h MET 153 Ca -0.27 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.28 3h7f h MET 153 Cb 1.11 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.75 3h7f h MET 153 CO 0.84 0.10 -0.03 -0.44 1.06 0.00 0.00 176.91 178.44 3h7f h ASP 154 N 0.00 0.85 -0.34 1.22 3.32 -2.00 -2.03 116.42 117.44 3h7f h ASP 154 Ca -0.00 -0.23 -0.07 0.00 0.02 0.00 0.00 57.03 56.75 3h7f h ASP 154 Cb 0.50 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.81 3h7f h ASP 154 CO 0.01 0.93 -0.08 0.00 -1.72 0.00 0.00 179.24 178.38 3h7f h ALA 155 N 1.16 0.47 -0.72 3.45 0.00 -1.75 -2.35 119.26 119.52 3h7f h ALA 155 Ca 0.15 -0.30 0.03 0.00 0.00 0.00 0.00 54.91 54.79 3h7f h ALA 155 Cb 0.52 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.15 3h7f h ALA 155 CO 0.03 0.31 0.45 0.28 0.00 0.00 0.00 179.25 180.32 3h7f h VAL 156 N 0.44 1.10 -0.24 0.00 2.07 -1.37 -2.35 116.25 115.90 3h7f h VAL 156 Ca 0.09 -0.30 0.02 0.00 0.82 0.00 0.00 66.70 67.32 3h7f h VAL 156 Cb 0.58 0.14 -0.02 0.00 -1.52 0.00 0.00 31.29 30.46 3h7f h VAL 156 CO 0.03 0.16 0.09 -0.09 0.02 0.00 0.00 177.57 177.78 3h7f h ARG 157 N 0.89 0.20 -0.67 1.57 2.43 -1.32 -1.35 114.38 116.13 3h7f h ARG 157 Ca 0.29 -0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 59.39 3h7f h ARG 157 Cb 0.01 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.49 3h7f h ARG 157 CO -0.11 0.13 0.21 0.00 -1.51 0.00 0.00 179.97 178.69 3h7f h ALA 158 N 1.14 1.11 -0.30 2.80 0.00 -1.23 -1.79 119.26 120.99 3h7f h ALA 158 Ca 0.10 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.77 3h7f h ALA 158 Cb 0.06 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 3h7f h ALA 158 CO -0.10 0.61 0.06 1.15 0.00 0.00 0.00 179.25 180.97 3h7f h THR 159 N 0.98 1.23 -0.83 0.00 2.02 -1.28 -2.57 112.91 112.46 3h7f h THR 159 Ca 0.22 -0.78 0.01 0.00 0.77 0.00 0.00 66.41 66.63 3h7f h THR 159 Cb 0.28 1.16 -0.04 0.00 -1.74 0.00 0.00 68.15 67.80 3h7f h THR 159 CO -0.01 0.26 0.55 0.00 0.37 0.00 0.00 175.52 176.69 3h7f h ALA 160 N 0.89 1.06 -0.13 6.16 0.00 -1.01 -0.53 119.26 125.69 3h7f h ALA 160 Ca 0.09 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 3h7f h ALA 160 Cb 0.33 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 3h7f h ALA 160 CO 0.00 0.45 -0.11 -0.07 0.00 0.00 0.00 179.25 179.53 3h7f h LEU 161 N 1.12 0.19 0.01 0.00 3.38 -1.25 -0.70 115.31 118.07 3h7f h LEU 161 Ca 0.31 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.24 3h7f h LEU 161 Cb -0.12 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.58 3h7f h LEU 161 CO -0.07 0.33 -0.01 -0.08 0.09 0.00 0.00 178.44 178.70 3h7f h GLU 162 N 0.20 -0.02 0.03 1.13 4.57 -1.12 -3.39 114.58 115.98 3h7f h GLU 162 Ca 0.04 0.00 -0.25 0.00 -1.18 0.00 0.00 59.36 57.97 3h7f h GLU 162 Cb 0.32 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 28.89 3h7f h GLU 162 CO 0.02 0.71 -1.27 0.35 -1.18 0.00 0.00 179.01 177.64 3h7f h PHE 163 N -0.79 0.13 -5.63 0.92 3.57 -1.09 -3.49 116.94 110.56 3h7f h PHE 163 Ca -0.00 -0.10 -0.25 0.00 3.53 0.00 0.00 57.97 61.15 3h7f h PHE 163 Cb 0.74 -0.01 0.14 0.00 2.79 0.00 0.00 35.95 39.62 3h7f h PHE 163 CO 0.19 1.10 -0.75 0.54 -2.23 0.00 0.00 178.31 177.15 3h7f n ARG 164 N -3.32 -1.88 -2.01 1.11 5.12 -0.27 -4.97 116.66 110.44 3h7f n ARG 164 Ca -0.07 0.88 -0.34 0.00 -1.93 0.00 0.00 57.85 56.39 3h7f n ARG 164 Cb 0.99 -5.39 0.02 0.00 -1.16 0.00 0.00 32.46 26.92 3h7f n ARG 164 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 3h7f s PRO 165 N -4.52 3.12 0.08 5.56 0.04 -1.26 -4.87 135.00 133.15 3h7f s PRO 165 Ca 0.38 1.42 0.00 0.00 0.04 0.00 0.00 61.00 62.84 3h7f s PRO 165 Cb -0.07 -1.99 -0.26 0.00 0.04 0.00 0.00 34.50 32.22 3h7f s PRO 165 CO 0.77 -1.00 1.15 -0.22 0.04 0.00 0.00 177.00 177.74 3h7f h LYS 166 N 0.54 0.17 -4.12 4.56 3.64 -1.49 -3.39 116.57 116.49 3h7f h LYS 166 Ca -0.48 -0.29 -0.39 0.00 -1.27 0.00 0.00 60.65 58.22 3h7f h LYS 166 Cb 1.24 0.11 -0.33 0.00 -0.41 0.00 0.00 32.23 32.85 3h7f h LYS 166 CO 0.56 1.12 -0.77 0.08 -2.27 0.00 0.00 179.45 178.17 3h7f s VAL 167 N -2.67 0.52 -0.17 2.00 1.01 -1.19 -1.88 120.40 118.02 3h7f s VAL 167 Ca -0.03 -0.15 -0.05 0.00 0.00 0.00 0.00 61.98 61.75 3h7f s VAL 167 Cb 0.08 -0.52 -0.03 0.00 0.00 0.00 0.00 36.38 35.91 3h7f s VAL 167 CO 0.86 0.20 -0.00 -0.63 0.00 0.00 0.00 175.10 175.53 3h7f s ILE 168 N 0.65 4.11 -0.23 2.22 1.01 -0.30 -1.86 121.20 126.80 3h7f s ILE 168 Ca -0.08 -0.27 -0.10 0.00 0.00 0.00 0.00 60.65 60.19 3h7f s ILE 168 Cb -0.12 -2.83 -0.05 0.00 0.01 0.00 0.00 42.46 39.47 3h7f s ILE 168 CO 0.00 0.47 0.16 -0.63 0.00 0.00 0.00 174.94 174.93 3h7f s ILE 169 N 0.55 5.37 -0.16 2.92 1.01 -0.18 -1.69 121.20 129.02 3h7f s ILE 169 Ca -0.01 0.19 -0.05 0.00 0.00 0.00 0.00 60.65 60.78 3h7f s ILE 169 Cb -0.14 -3.50 -0.03 0.00 0.01 0.00 0.00 42.46 38.80 3h7f s ILE 169 CO 0.02 0.37 0.01 0.00 0.00 0.00 0.00 174.94 175.33 3h7f s ALA 170 N 0.90 3.19 0.00 9.38 0.00 -0.51 -4.35 121.76 130.37 3h7f s ALA 170 Ca 0.08 -0.78 0.00 0.00 0.00 0.00 0.00 51.96 51.25 3h7f s ALA 170 Cb -0.13 -1.71 0.00 0.00 0.00 0.00 0.00 23.12 21.28 3h7f s ALA 170 CO 0.03 0.22 0.00 0.41 0.00 0.00 0.00 175.76 176.42 3h7f n GLY 171 N 3.46 2.95 3.49 0.00 0.00 -1.26 -1.24 105.19 112.58 3h7f n GLY 171 Ca -0.17 -1.44 -0.10 0.00 0.00 0.00 0.00 46.02 44.31 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 -0.42 -0.10 1.61 1.48 -1.26 -4.76 118.94 113.49 3h7f s TRP 172 Ca 0.00 0.38 0.14 0.00 -1.06 0.00 0.00 56.10 55.56 3h7f s TRP 172 Cb 0.00 0.52 -0.21 0.00 -1.16 0.00 0.00 33.47 32.62 3h7f s TRP 172 CO 0.00 -0.60 0.17 -1.13 -4.06 0.00 0.00 176.95 171.34 3h7f n SER 173 N -0.05 1.31 -3.31 -2.66 3.41 -0.09 -4.57 113.62 107.65 3h7f n SER 173 Ca -0.12 0.00 -0.18 0.00 -0.26 0.00 0.00 58.87 58.31 3h7f n SER 173 Cb 0.62 1.22 -0.07 0.00 -0.26 0.00 0.00 64.21 65.71 3h7f n SER 173 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3h7f s ALA 174 N -2.67 -0.22 -0.09 7.33 0.00 -0.91 -5.04 121.76 120.18 3h7f s ALA 174 Ca -0.07 -1.23 -0.06 0.00 0.00 0.00 0.00 51.96 50.60 3h7f s ALA 174 Cb 0.07 -2.02 0.03 0.00 0.00 0.00 0.00 23.12 21.20 3h7f s ALA 174 CO 0.64 -2.13 0.21 -0.47 0.00 0.00 0.00 175.76 174.01 3h7f s TYR 175 N 1.11 -0.25 -2.28 0.00 5.04 -1.26 -4.36 117.35 115.35 3h7f s TYR 175 Ca 0.21 0.63 0.22 0.00 -2.44 0.00 0.00 57.07 55.68 3h7f s TYR 175 Cb -0.11 0.05 0.52 0.00 0.35 0.00 0.00 41.96 42.77 3h7f s TYR 175 CO -0.05 -0.16 1.45 -0.35 -1.34 0.00 0.00 175.55 175.10 3h7f n PRO 176 N 3.53 2.38 -4.31 4.97 -0.04 -1.26 -4.97 135.00 135.30 3h7f n PRO 176 Ca -0.18 -2.11 -0.23 0.00 -0.04 0.00 0.00 63.50 60.94 3h7f n PRO 176 Cb 0.56 -1.49 -0.07 0.00 -0.04 0.00 0.00 33.50 32.46 3h7f n PRO 176 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3h7f n ARG 177 N 1.27 0.53 -3.27 0.54 5.12 -1.26 -1.58 116.66 118.00 3h7f n ARG 177 Ca 0.20 -3.36 -0.39 0.00 -1.93 0.00 0.00 57.85 52.37 3h7f n ARG 177 Cb 0.54 2.10 -0.07 0.00 -1.16 0.00 0.00 32.46 33.86 3h7f n ARG 177 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 3h7f s VAL 178 N -3.14 5.11 0.52 1.55 1.01 -1.26 -4.95 120.40 119.24 3h7f s VAL 178 Ca 0.26 0.86 -0.21 0.00 0.00 0.00 0.00 61.98 62.88 3h7f s VAL 178 Cb 0.01 -3.81 -0.06 0.00 0.00 0.00 0.00 36.38 32.53 3h7f s VAL 178 CO 0.18 0.15 1.22 -0.76 0.00 0.00 0.00 175.10 175.89 3h7f s LEU 179 N 1.90 3.86 -0.89 3.92 1.43 -1.26 -5.00 118.68 122.64 3h7f s LEU 179 Ca 0.21 2.42 -0.16 0.00 -1.03 0.00 0.00 54.13 55.57 3h7f s LEU 179 Cb -0.15 -4.37 0.18 0.00 0.03 0.00 0.00 46.19 41.87 3h7f s LEU 179 CO 0.09 -1.27 0.95 -0.62 0.23 0.00 0.00 176.35 175.73 3h7f s ASP 180 N -1.37 6.72 0.29 2.29 -1.08 -1.26 -4.93 116.67 117.34 3h7f s ASP 180 Ca 0.70 -2.42 0.04 0.00 -0.52 0.00 0.00 52.55 50.35 3h7f s ASP 180 Cb -0.31 -2.30 0.46 0.00 -1.46 0.00 0.00 42.92 39.30 3h7f s ASP 180 CO 0.36 -0.80 1.74 -0.26 0.52 0.00 0.00 175.17 176.74 3h7f h PHE 181 N 8.23 0.48 -0.68 -5.34 0.04 -1.94 -2.65 116.94 115.09 3h7f h PHE 181 Ca 0.14 -0.10 -0.06 0.00 2.80 0.00 0.00 57.97 60.75 3h7f h PHE 181 Cb 1.03 -0.12 -0.03 0.00 2.20 0.00 0.00 35.95 39.03 3h7f h PHE 181 CO 1.09 0.65 0.20 0.00 -0.60 0.00 0.00 178.31 179.66 3h7f h ALA 182 N 1.35 1.08 -0.60 2.45 0.00 -1.95 -1.71 119.26 119.88 3h7f h ALA 182 Ca 0.06 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 3h7f h ALA 182 Cb 0.64 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 3h7f h ALA 182 CO 0.05 0.62 0.25 0.00 0.00 0.00 0.00 179.25 180.17 3h7f h ALA 183 N 1.21 0.78 -0.73 0.00 0.00 -1.94 -2.27 119.26 116.32 3h7f h ALA 183 Ca 0.22 -0.16 0.04 0.00 0.00 0.00 0.00 54.91 55.00 3h7f h ALA 183 Cb 0.29 -0.24 -0.05 0.00 0.00 0.00 0.00 17.79 17.80 3h7f h ALA 183 CO -0.01 0.39 0.45 0.74 0.00 0.00 0.00 179.25 180.82 3h7f h PHE 184 N 0.83 0.84 -0.44 0.00 0.04 -1.23 -2.26 116.94 114.72 3h7f h PHE 184 Ca 0.20 0.02 0.00 0.00 2.80 0.00 0.00 57.97 61.00 3h7f h PHE 184 Cb 0.19 -0.27 -0.02 0.00 2.20 0.00 0.00 35.95 38.05 3h7f h PHE 184 CO 0.01 0.46 0.29 -0.09 -0.60 0.00 0.00 178.31 178.38 3h7f h ARG 185 N 0.86 0.58 -0.78 1.51 9.65 -1.17 -1.37 114.38 123.66 3h7f h ARG 185 Ca 0.30 -0.04 0.02 0.00 -1.10 0.00 0.00 59.98 59.16 3h7f h ARG 185 Cb 0.06 -0.13 -0.04 0.00 -1.39 0.00 0.00 29.97 28.47 3h7f h ARG 185 CO -0.13 0.39 0.51 1.03 2.80 0.00 0.00 179.97 184.57 3h7f h SER 186 N 0.60 0.87 -0.25 -3.80 0.87 -1.18 -1.88 113.55 108.78 3h7f h SER 186 Ca 0.16 -0.02 -0.08 0.00 -1.23 0.00 0.00 61.79 60.63 3h7f h SER 186 Cb -0.07 -0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 61.68 3h7f h SER 186 CO -0.03 0.62 -0.14 0.40 -0.53 0.00 0.00 176.83 177.15 3h7f h ILE 187 N 1.03 1.30 -0.67 2.23 2.04 -1.28 -2.62 117.51 119.54 3h7f h ILE 187 Ca 0.30 -1.23 0.02 0.00 1.00 0.00 0.00 64.86 64.94 3h7f h ILE 187 Cb -0.08 1.57 -0.04 0.00 -0.74 0.00 0.00 36.82 37.54 3h7f h ILE 187 CO -0.08 0.39 0.43 0.00 0.00 0.00 0.00 178.15 178.88 3h7f h ALA 188 N 0.72 0.86 -0.63 1.87 0.00 -1.12 -2.71 119.26 118.25 3h7f h ALA 188 Ca 0.05 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.95 3h7f h ALA 188 Cb 0.65 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 18.17 3h7f h ALA 188 CO 0.04 0.21 0.40 -0.44 0.00 0.00 0.00 179.25 179.47 3h7f h ASP 189 N 0.85 0.68 -1.00 0.00 3.32 -1.32 0.04 116.42 118.98 3h7f h ASP 189 Ca 0.26 -0.01 0.09 0.00 0.02 0.00 0.00 57.03 57.39 3h7f h ASP 189 Cb -0.03 -0.16 -0.08 0.00 0.22 0.00 0.00 39.33 39.29 3h7f h ASP 189 CO -0.09 0.48 0.64 -0.33 -1.72 0.00 0.00 179.24 178.23 3h7f h GLU 190 N 0.81 1.05 -0.03 3.56 5.08 -1.14 -2.88 114.58 121.03 3h7f h GLU 190 Ca 0.24 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.54 3h7f h GLU 190 Cb -0.04 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 28.97 3h7f h GLU 190 CO -0.08 0.70 -0.07 1.33 -1.00 0.00 0.00 179.01 179.89 3h7f n VAL 191 N -4.56 0.00 -2.40 3.13 0.24 -1.13 -4.99 118.33 108.62 3h7f n VAL 191 Ca 0.17 -0.46 -0.10 0.00 -2.04 0.00 0.00 64.34 61.91 3h7f n VAL 191 Cb 0.27 1.43 0.01 0.00 -1.47 0.00 0.00 33.84 34.07 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 1.27 0.05 3.91 7.63 0.00 -0.34 -4.90 105.19 112.80 3h7f n GLY 192 Ca 0.12 -0.42 -0.29 0.00 0.00 0.00 0.00 46.02 45.43 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 -2.66 3.71 0.33 4.61 0.00 -0.15 -4.95 121.76 122.66 3h7f s ALA 193 Ca 0.07 -0.61 -0.24 0.00 0.00 0.00 0.00 51.96 51.17 3h7f s ALA 193 Cb -0.03 -2.20 -0.10 0.00 0.00 0.00 0.00 23.12 20.79 3h7f s ALA 193 CO 0.09 0.39 0.92 0.15 0.00 0.00 0.00 175.76 177.30 3h7f s LYS 194 N -3.28 4.47 -0.29 0.00 -0.14 -0.79 -4.45 119.74 115.26 3h7f s LYS 194 Ca 0.42 1.23 -0.08 0.00 -1.36 0.00 0.00 55.97 56.18 3h7f s LYS 194 Cb -0.11 -2.69 -0.01 0.00 -1.68 0.00 0.00 37.83 33.35 3h7f s LYS 194 CO 0.28 0.23 0.11 -1.17 -0.76 0.00 0.00 175.35 174.04 3h7f s LEU 195 N -2.27 3.87 -0.25 3.17 2.96 -1.26 -1.15 118.68 123.75 3h7f s LEU 195 Ca 0.52 -0.53 -0.11 0.00 -0.22 0.00 0.00 54.13 53.79 3h7f s LEU 195 Cb -0.16 -1.94 -0.05 0.00 0.50 0.00 0.00 46.19 44.54 3h7f s LEU 195 CO 0.21 -0.16 0.16 -0.22 -1.32 0.00 0.00 176.35 175.03 3h7f s LEU 196 N 1.57 4.10 -0.24 -0.68 2.96 -0.68 -1.85 118.68 123.86 3h7f s LEU 196 Ca 0.04 0.09 -0.09 0.00 -0.22 0.00 0.00 54.13 53.95 3h7f s LEU 196 Cb -0.17 -2.11 -0.04 0.00 0.50 0.00 0.00 46.19 44.37 3h7f s LEU 196 CO 0.04 0.05 0.12 -0.69 -1.32 0.00 0.00 176.35 174.55 3h7f s VAL 197 N 1.16 4.91 -0.61 1.68 1.01 -0.88 -1.43 120.40 126.24 3h7f s VAL 197 Ca 0.07 0.02 -0.15 0.00 0.00 0.00 0.00 61.98 61.93 3h7f s VAL 197 Cb -0.14 -3.29 0.15 0.00 0.00 0.00 0.00 36.38 33.11 3h7f s VAL 197 CO 0.05 0.35 0.57 -0.62 0.00 0.00 0.00 175.10 175.45 3h7f s ASP 198 N 1.24 6.32 -0.11 3.32 -1.08 -0.38 -1.43 116.67 124.55 3h7f s ASP 198 Ca 0.06 -2.04 0.14 0.00 -0.52 0.00 0.00 52.55 50.18 3h7f s ASP 198 Cb -0.14 -2.20 0.59 0.00 -1.46 0.00 0.00 42.92 39.71 3h7f s ASP 198 CO 0.05 -0.78 1.46 1.15 0.52 0.00 0.00 175.17 177.57 3h7f n MET 199 N 4.89 3.39 -0.35 4.34 0.00 -0.57 -4.08 117.12 124.73 3h7f n MET 199 Ca -0.06 -2.31 -0.01 0.00 0.00 0.00 0.00 57.70 55.31 3h7f n MET 199 Cb 0.42 -1.85 0.03 0.00 0.00 0.00 0.00 33.22 31.82 3h7f n MET 199 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 3h7f n ALA 200 N 0.76 -0.14 -0.24 3.17 0.00 -1.25 -1.62 120.51 121.19 3h7f n ALA 200 Ca 0.21 0.90 -0.08 0.00 0.00 0.00 0.00 53.44 54.48 3h7f n ALA 200 Cb 0.80 -0.39 0.04 0.00 0.00 0.00 0.00 19.45 19.89 3h7f n ALA 200 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3h7f h HIS 201 N 0.00 1.12 -0.48 0.00 3.86 -1.85 -3.35 115.15 114.45 3h7f h HIS 201 Ca 0.31 -0.13 0.00 0.00 -1.16 0.00 0.00 60.37 59.39 3h7f h HIS 201 Cb 0.54 -0.32 0.00 0.00 1.06 0.00 0.00 27.41 28.69 3h7f h HIS 201 CO -0.81 0.92 0.00 1.97 0.86 0.00 0.00 177.93 180.87 3h7f n PHE 202 N -4.29 0.64 -0.17 2.45 1.16 -0.64 -3.82 117.46 112.80 3h7f n PHE 202 Ca 0.04 -0.50 0.01 0.00 -1.87 0.00 0.00 57.45 55.13 3h7f n PHE 202 Cb 0.25 -0.02 0.28 0.00 -1.61 0.00 0.00 39.48 38.38 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 2.78 1.51 -0.10 1.98 0.00 -1.46 -1.47 119.26 122.50 3h7f h ALA 203 Ca 0.00 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.76 3h7f h ALA 203 Cb 0.83 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 3h7f h ALA 203 CO 0.00 0.45 -0.36 0.78 0.00 0.00 0.00 179.25 180.13 3h7f h GLY 204 N 0.92 0.22 0.96 0.00 0.00 -1.85 -1.33 103.07 101.99 3h7f h GLY 204 Ca 0.24 -0.19 -0.06 0.00 0.00 0.00 0.00 47.33 47.33 3h7f h GLY 204 CO -0.05 0.17 0.03 1.41 0.00 0.00 0.00 176.54 178.10 3h7f h LEU 205 N 0.17 0.72 -0.35 3.11 3.38 -1.58 -2.69 115.31 118.07 3h7f h LEU 205 Ca 0.02 -0.29 -0.00 0.00 0.09 0.00 0.00 57.88 57.70 3h7f h LEU 205 Cb 0.72 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.26 3h7f h LEU 205 CO 0.05 0.83 0.22 0.58 0.09 0.00 0.00 178.44 180.22 3h7f h VAL 206 N 0.59 1.11 -0.99 1.22 2.07 -1.26 -0.36 116.25 118.63 3h7f h VAL 206 Ca 0.13 -0.24 0.05 0.00 0.82 0.00 0.00 66.70 67.46 3h7f h VAL 206 Cb 0.44 0.64 -0.06 0.00 -1.52 0.00 0.00 31.29 30.78 3h7f h VAL 206 CO 0.02 0.11 0.64 0.00 0.02 0.00 0.00 177.57 178.36 3h7f h ALA 207 N 1.10 1.35 -0.01 1.67 0.00 -1.19 -1.86 119.26 120.33 3h7f h ALA 207 Ca 0.13 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.01 3h7f h ALA 207 Cb -0.01 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.45 3h7f h ALA 207 CO -0.03 0.48 0.00 0.00 0.00 0.00 0.00 179.25 179.70 3h7f n ALA 208 N -2.36 2.65 -1.12 0.00 0.00 -1.02 -4.88 120.51 113.77 3h7f n ALA 208 Ca 0.14 -0.26 -0.04 0.00 0.00 0.00 0.00 53.44 53.29 3h7f n ALA 208 Cb 0.15 -1.41 -0.02 0.00 0.00 0.00 0.00 19.45 18.17 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 1.02 0.69 0.93 0.00 0.00 -0.70 -4.95 105.19 102.19 3h7f n GLY 209 Ca 0.22 -0.67 0.10 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 -0.46 3.03 -3.81 0.99 4.77 -0.17 -4.89 117.00 116.46 3h7f n LEU 210 Ca -0.04 -1.35 -0.13 0.00 -0.03 0.00 0.00 56.01 54.47 3h7f n LEU 210 Cb 0.16 -0.15 -0.13 0.00 -2.33 0.00 0.00 43.42 40.97 3h7f n LEU 210 CO 0.06 0.62 -0.23 -2.28 -1.33 0.00 0.00 177.39 174.23 3h7f s HIS 211 N -1.45 -0.13 0.49 -1.77 2.46 -1.18 -4.91 115.29 108.79 3h7f s HIS 211 Ca 0.30 0.34 -0.23 0.00 0.47 0.00 0.00 55.06 55.95 3h7f s HIS 211 Cb 0.19 0.02 -0.08 0.00 -0.13 0.00 0.00 32.58 32.58 3h7f s HIS 211 CO 0.26 -0.08 1.19 -2.30 -2.47 0.00 0.00 174.74 171.35 3h7f n PRO 212 N 3.26 1.58 -2.88 2.88 -0.02 -1.26 -4.35 135.00 134.20 3h7f n PRO 212 Ca -0.15 0.57 -0.40 0.00 -2.02 0.00 0.00 63.50 61.50 3h7f n PRO 212 Cb 0.58 -2.34 -0.05 0.00 -0.02 0.00 0.00 33.50 31.66 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 -0.80 7.38 0.19 2.55 0.15 -1.26 -4.92 113.70 116.99 3h7f s SER 213 Ca 0.67 1.65 0.26 0.00 0.70 0.00 0.00 55.95 59.23 3h7f s SER 213 Cb -0.47 -2.53 0.84 0.00 -1.71 0.00 0.00 66.02 62.15 3h7f s SER 213 CO 0.53 0.05 1.78 -0.81 1.20 0.00 0.00 173.24 175.99 3h7f n PRO 214 N 2.39 0.24 -0.35 5.44 -0.04 -1.26 -4.46 135.00 136.96 3h7f n PRO 214 Ca -0.02 0.19 -0.02 0.00 -0.04 0.00 0.00 63.50 63.61 3h7f n PRO 214 Cb 0.49 -1.77 0.12 0.00 -0.04 0.00 0.00 33.50 32.30 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 -1.93 -1.73 116.25 116.43 3h7f h VAL 215 Ca 0.00 -0.50 -0.01 0.00 0.82 0.00 0.00 66.70 67.01 3h7f h VAL 215 Cb 0.72 -0.13 -0.00 0.00 -1.52 0.00 0.00 31.29 30.36 3h7f h VAL 215 CO 0.00 0.25 -0.04 -0.65 0.02 0.00 0.00 177.57 177.15 3h7f h PRO 216 N 1.30 0.00 0.00 1.57 0.11 -1.91 -3.31 132.00 129.76 3h7f h PRO 216 Ca 0.35 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 66.40 3h7f h PRO 216 Cb -0.11 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 30.99 3h7f h PRO 216 CO -0.07 0.04 -1.70 0.72 -0.21 0.00 0.00 178.00 176.78 3h7f n HIS 217 N -3.51 0.00 -3.65 0.65 8.25 -0.73 -5.03 115.22 111.20 3h7f n HIS 217 Ca -0.02 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.11 3h7f n HIS 217 Cb 0.15 -0.39 -0.05 0.00 1.12 0.00 0.00 29.99 30.82 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 -2.81 3.78 0.03 -1.41 0.00 -0.73 -4.70 121.76 115.91 3h7f s ALA 218 Ca -0.05 -0.50 -0.25 0.00 0.00 0.00 0.00 51.96 51.16 3h7f s ALA 218 Cb 0.08 -2.17 -0.18 0.00 0.00 0.00 0.00 23.12 20.85 3h7f s ALA 218 CO 0.57 0.63 1.49 -0.44 0.00 0.00 0.00 175.76 178.01 3h7f h ASP 219 N 3.33 -0.03 -4.33 0.00 3.32 -1.72 -3.42 116.42 113.57 3h7f h ASP 219 Ca -0.48 -0.24 -0.21 0.00 0.02 0.00 0.00 57.03 56.12 3h7f h ASP 219 Cb 1.18 0.01 -0.25 0.00 0.22 0.00 0.00 39.33 40.49 3h7f h ASP 219 CO 0.69 0.22 -0.71 -0.69 -1.72 0.00 0.00 179.24 177.03 3h7f s VAL 220 N -5.20 0.09 -0.12 -1.35 1.01 -1.14 -1.94 120.40 111.77 3h7f s VAL 220 Ca -0.15 -0.45 0.01 0.00 0.00 0.00 0.00 61.98 61.39 3h7f s VAL 220 Cb 0.04 -0.16 0.02 0.00 0.00 0.00 0.00 36.38 36.27 3h7f s VAL 220 CO 0.66 -0.23 -0.15 -0.69 0.00 0.00 0.00 175.10 174.69 3h7f s VAL 221 N -0.70 1.51 0.14 2.92 1.01 -0.09 -2.07 120.40 123.12 3h7f s VAL 221 Ca -0.07 -0.63 0.03 0.00 0.00 0.00 0.00 61.98 61.30 3h7f s VAL 221 Cb -0.05 -1.39 -0.04 0.00 0.00 0.00 0.00 36.38 34.91 3h7f s VAL 221 CO -0.00 0.44 0.20 -0.94 0.00 0.00 0.00 175.10 174.80 3h7f s SER 222 N 1.10 5.94 0.07 3.32 1.04 -0.52 -1.52 113.70 123.13 3h7f s SER 222 Ca -0.04 0.05 -0.25 0.00 0.48 0.00 0.00 55.95 56.19 3h7f s SER 222 Cb -0.14 -1.69 0.06 0.00 0.10 0.00 0.00 66.02 64.35 3h7f s SER 222 CO -0.04 0.09 0.60 0.28 0.98 0.00 0.00 173.24 175.15 3h7f s THR 223 N -1.68 0.01 0.45 2.02 -1.32 -0.71 -1.52 115.64 112.90 3h7f s THR 223 Ca 0.33 -0.07 -0.20 0.00 -1.21 0.00 0.00 61.69 60.53 3h7f s THR 223 Cb -0.11 -1.00 -0.10 0.00 -1.51 0.00 0.00 72.50 69.78 3h7f s THR 223 CO 0.26 -0.04 0.97 0.42 -2.21 0.00 0.00 174.62 174.01 3h7f s THR 224 N -2.69 4.33 -0.17 5.08 -4.23 -1.26 -1.66 115.64 115.03 3h7f s THR 224 Ca -0.04 1.40 0.20 0.00 -1.18 0.00 0.00 61.69 62.07 3h7f s THR 224 Cb -0.01 -3.59 -0.08 0.00 1.34 0.00 0.00 72.50 70.16 3h7f s THR 224 CO -0.04 -0.37 0.90 0.52 -0.54 0.00 0.00 174.62 175.10 3h7f n VAL 225 N -0.83 0.84 -2.60 2.29 0.31 -0.57 -4.84 118.33 112.92 3h7f n VAL 225 Ca 0.07 -0.61 -0.43 0.00 -0.01 0.00 0.00 64.34 63.36 3h7f n VAL 225 Cb 0.54 -0.49 -0.02 0.00 -0.91 0.00 0.00 33.84 32.96 3h7f n VAL 225 CO 0.00 0.00 0.00 -1.38 -1.32 0.00 0.00 176.83 174.13 3h7f s HIS 226 N -3.17 3.00 0.03 3.52 -3.43 -1.24 -1.13 115.29 112.87 3h7f s HIS 226 Ca -0.02 1.03 0.02 0.00 -0.80 0.00 0.00 55.06 55.28 3h7f s HIS 226 Cb 0.09 -3.93 0.06 0.00 -1.43 0.00 0.00 32.58 27.38 3h7f s HIS 226 CO 0.81 -1.02 0.07 0.25 -2.00 0.00 0.00 174.74 172.84 3h7f n THR 228 N 6.19 0.00 0.30 -5.38 -2.24 -1.25 -4.45 114.28 107.44 3h7f n THR 228 Ca 0.12 0.07 0.18 0.00 -2.27 0.00 0.00 64.05 62.15 3h7f n THR 228 Cb 0.48 -0.11 0.94 0.00 -2.10 0.00 0.00 70.33 69.53 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 -1.87 -3.38 115.31 119.13 3h7f h LEU 229 Ca 0.03 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.75 3h7f h LEU 229 Cb 0.16 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.19 3h7f h LEU 229 CO -0.00 0.03 0.00 0.61 -0.34 0.00 0.00 178.44 178.74 3h7f n GLY 230 N -0.73 0.53 0.00 3.75 0.00 -1.19 -4.91 105.19 102.64 3h7f n GLY 230 Ca -0.02 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.50 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 -2.83 2.58 3.82 -0.02 0.00 -0.28 -4.50 105.19 103.95 3h7f n GLY 231 Ca 0.00 -2.11 -0.32 0.00 0.00 0.00 0.00 46.02 43.58 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 -1.51 2.10 -0.33 -0.02 0.00 -1.26 -3.93 107.32 102.37 3h7f s GLY 232 Ca 0.00 0.30 -0.28 0.00 0.00 0.00 0.00 44.72 44.74 3h7f s GLY 232 CO 0.00 0.60 1.77 -1.60 0.00 0.00 0.00 173.10 173.87 3h7f s ARG 233 N -4.06 3.38 -0.09 2.90 3.52 -1.26 -3.59 118.95 119.75 3h7f s ARG 233 Ca 0.62 1.42 -0.31 0.00 -0.13 0.00 0.00 55.73 57.32 3h7f s ARG 233 Cb -0.13 -4.18 0.11 0.00 -1.56 0.00 0.00 34.95 29.19 3h7f s ARG 233 CO 0.34 -1.81 1.38 -1.54 -0.81 0.00 0.00 175.30 172.87 3h7f s SER 234 N 5.86 -0.00 0.47 -2.12 1.04 -1.26 -4.88 113.70 112.81 3h7f s SER 234 Ca 0.79 -0.03 0.04 0.00 0.48 0.00 0.00 55.95 57.22 3h7f s SER 234 Cb -0.22 0.02 -0.04 0.00 0.10 0.00 0.00 66.02 65.89 3h7f s SER 234 CO 0.34 -0.05 0.03 -0.83 0.98 0.00 0.00 173.24 173.70 3h7f s GLY 235 N -3.71 2.80 -0.19 7.32 0.00 -0.88 -1.51 107.32 111.15 3h7f s GLY 235 Ca 0.28 -1.13 -0.28 0.00 0.00 0.00 0.00 44.72 43.59 3h7f s GLY 235 CO -0.04 -2.15 0.81 -2.27 0.00 0.00 0.00 173.10 169.46 3h7f s LEU 236 N -3.84 -0.60 -0.03 0.66 2.96 -0.66 -4.22 118.68 112.94 3h7f s LEU 236 Ca 0.18 0.95 0.04 0.00 -0.22 0.00 0.00 54.13 55.08 3h7f s LEU 236 Cb 0.04 2.28 -0.00 0.00 0.50 0.00 0.00 46.19 49.01 3h7f s LEU 236 CO 0.09 -0.35 -0.14 -0.63 -1.32 0.00 0.00 176.35 174.00 3h7f s ILE 237 N -0.35 1.15 0.14 6.68 1.01 -0.74 -1.74 121.20 127.36 3h7f s ILE 237 Ca -0.03 -0.57 0.05 0.00 0.00 0.00 0.00 60.65 60.11 3h7f s ILE 237 Cb -0.03 -1.00 -0.04 0.00 0.01 0.00 0.00 42.46 41.40 3h7f s ILE 237 CO 0.02 0.34 -0.12 0.68 0.00 0.00 0.00 174.94 175.86 3h7f s VAL 238 N 0.09 1.29 -0.00 2.92 -7.23 -0.58 -1.14 120.40 115.75 3h7f s VAL 238 Ca -0.03 -1.89 0.00 0.00 -1.81 0.00 0.00 61.98 58.24 3h7f s VAL 238 Cb -0.10 -1.69 0.00 0.00 0.56 0.00 0.00 36.38 35.15 3h7f s VAL 238 CO 0.01 -0.57 0.00 0.61 -0.31 0.00 0.00 175.10 174.84 3h7f n GLY 239 N 0.16 -1.16 3.77 2.32 0.00 -0.77 -0.91 105.19 108.60 3h7f n GLY 239 Ca -0.13 -0.78 -0.38 0.00 0.00 0.00 0.00 46.02 44.74 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 -0.00 4.17 0.41 1.61 -0.14 -0.82 -1.65 119.74 123.32 3h7f s LYS 240 Ca 0.00 1.71 0.14 0.00 -1.36 0.00 0.00 55.97 56.47 3h7f s LYS 240 Cb 0.00 -2.70 1.01 0.00 -1.68 0.00 0.00 37.83 34.46 3h7f s LYS 240 CO 0.00 -0.18 1.91 0.37 -0.76 0.00 0.00 175.35 176.68 3h7f h GLN 241 N 2.75 0.46 -0.00 1.68 5.75 -1.92 -1.97 115.11 121.86 3h7f h GLN 241 Ca -0.48 -0.03 0.00 0.00 -0.15 0.00 0.00 58.65 57.99 3h7f h GLN 241 Cb 1.22 -0.10 -0.00 0.00 1.07 0.00 0.00 27.48 29.67 3h7f h GLN 241 CO 0.63 0.30 0.02 -0.56 -2.65 0.00 0.00 178.83 176.57 3h7f h GLN 242 N 0.47 0.00 -0.58 1.69 3.07 -1.97 -1.71 115.11 116.08 3h7f h GLN 242 Ca 0.39 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.13 3h7f h GLN 242 Cb 0.84 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.40 3h7f h GLN 242 CO -0.14 0.00 0.00 0.66 0.09 0.00 0.00 178.83 179.44 3h7f n TYR 243 N -3.07 0.77 0.03 0.06 4.01 -0.74 -4.70 117.16 113.52 3h7f n TYR 243 Ca -0.03 -0.38 -0.12 0.00 -0.16 0.00 0.00 57.90 57.21 3h7f n TYR 243 Cb 0.09 0.00 -0.07 0.00 -0.31 0.00 0.00 39.34 39.05 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 4.33 0.02 -0.29 -0.72 0.00 -1.44 -1.12 119.26 120.03 3h7f h ALA 244 Ca 0.00 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.83 3h7f h ALA 244 Cb 0.92 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 3h7f h ALA 244 CO 0.00 -0.47 -0.10 -0.22 0.00 0.00 0.00 179.25 178.46 3h7f h LYS 245 N -0.00 0.58 -0.31 0.00 1.63 -1.84 -0.93 116.57 115.70 3h7f h LYS 245 Ca 0.01 -0.24 0.05 0.00 -0.85 0.00 0.00 60.65 59.62 3h7f h LYS 245 Cb 0.02 -0.03 -0.05 0.00 -0.60 0.00 0.00 32.23 31.58 3h7f h LYS 245 CO -0.00 0.79 0.01 0.00 -3.45 0.00 0.00 179.45 176.81 3h7f h ALA 246 N 0.77 0.29 -0.03 5.00 0.00 -1.85 -1.94 119.26 121.50 3h7f h ALA 246 Ca 0.07 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 3h7f h ALA 246 Cb 0.60 0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.52 3h7f h ALA 246 CO 0.03 -0.39 -0.04 0.82 0.00 0.00 0.00 179.25 179.67 3h7f h ILE 247 N 0.11 1.41 -0.30 0.00 1.08 -1.21 -2.14 117.51 116.45 3h7f h ILE 247 Ca 0.15 -1.26 0.06 0.00 -0.39 0.00 0.00 64.86 63.42 3h7f h ILE 247 Cb 0.19 2.19 -0.06 0.00 -3.07 0.00 0.00 36.82 36.08 3h7f h ILE 247 CO -0.24 0.34 -0.06 0.78 -0.69 0.00 0.00 178.15 178.28 3h7f h ASN 248 N -0.42 -0.24 -0.04 1.72 2.35 -1.14 -1.84 115.58 115.96 3h7f h ASN 248 Ca 0.00 0.09 -0.06 0.00 -0.55 0.00 0.00 56.30 55.78 3h7f h ASN 248 Cb 0.56 0.17 -0.01 0.00 0.05 0.00 0.00 38.32 39.09 3h7f h ASN 248 CO 0.01 -0.08 -0.12 -1.28 -1.65 0.00 0.00 177.43 174.31 3h7f h SER 249 N 0.02 0.31 -0.44 5.81 0.87 -1.39 -1.88 113.55 116.85 3h7f h SER 249 Ca 0.15 -0.07 -0.12 0.00 -1.23 0.00 0.00 61.79 60.52 3h7f h SER 249 Cb 0.22 -0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 62.08 3h7f h SER 249 CO -0.30 0.46 -0.19 0.00 -0.53 0.00 0.00 176.83 176.27 3h7f h ALA 250 N 1.58 0.62 0.23 6.23 0.00 -0.98 -1.16 119.26 125.78 3h7f h ALA 250 Ca 0.06 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.59 3h7f h ALA 250 Cb 0.40 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.04 3h7f h ALA 250 CO 0.02 0.58 -0.11 0.28 0.00 0.00 0.00 179.25 180.02 3h7f h VAL 251 N 0.74 0.83 -3.41 0.00 2.07 -1.09 -0.93 116.25 114.47 3h7f h VAL 251 Ca 0.10 -0.54 -0.31 0.00 0.82 0.00 0.00 66.70 66.77 3h7f h VAL 251 Cb 0.76 1.14 -0.35 0.00 -1.52 0.00 0.00 31.29 31.32 3h7f h VAL 251 CO 0.06 0.12 -0.71 0.12 0.02 0.00 0.00 177.57 177.17 3h7f s PHE 252 N -4.97 0.00 -1.38 1.57 5.36 -0.73 -1.19 117.98 116.65 3h7f s PHE 252 Ca -0.15 0.23 0.10 0.00 -0.96 0.00 0.00 56.93 56.15 3h7f s PHE 252 Cb 0.03 -0.29 0.37 0.00 -0.34 0.00 0.00 43.02 42.79 3h7f s PHE 252 CO 0.59 -0.14 1.21 -0.35 -1.46 0.00 0.00 175.22 175.08 3h7f n PRO 253 N 4.57 2.38 0.27 10.12 -0.04 -1.16 -4.10 135.00 147.04 3h7f n PRO 253 Ca -0.19 -1.47 -0.16 0.00 -0.04 0.00 0.00 63.50 61.64 3h7f n PRO 253 Cb 0.50 -1.56 -0.08 0.00 -0.04 0.00 0.00 33.50 32.32 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 4.88 -0.77 0.00 0.55 0.00 -1.24 -3.40 103.07 103.08 3h7f h GLY 254 Ca 0.00 0.33 -0.22 0.00 0.00 0.00 0.00 47.33 47.44 3h7f h GLY 254 CO 0.11 -0.29 -1.81 -1.06 0.00 0.00 0.00 176.54 173.50 3h7f n GLN 255 N -5.43 0.34 -4.08 4.80 1.13 -0.36 -5.00 117.38 108.78 3h7f n GLN 255 Ca -0.11 0.10 -0.23 0.00 -1.94 0.00 0.00 57.00 54.81 3h7f n GLN 255 Cb 0.33 -1.20 -0.07 0.00 0.11 0.00 0.00 30.24 29.41 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 -2.28 2.32 0.00 -1.09 -0.21 -0.33 -5.05 119.66 113.01 3h7f s GLN 256 Ca -0.19 -1.66 0.00 0.00 0.02 0.00 0.00 55.36 53.53 3h7f s GLN 256 Cb 0.06 -2.11 0.00 0.00 1.00 0.00 0.00 33.01 31.96 3h7f s GLN 256 CO 0.30 0.01 0.00 0.41 -2.12 0.00 0.00 175.29 173.90 3h7f n GLY 257 N -1.20 0.65 3.74 3.09 0.00 -1.26 -4.67 105.19 105.54 3h7f n GLY 257 Ca -0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 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 2.08 0.73 -0.02 0.00 -1.26 -4.85 107.32 104.00 3h7f s GLY 258 Ca 0.00 1.35 -0.11 0.00 0.00 0.00 0.00 44.72 45.96 3h7f s GLY 258 CO 0.00 2.40 1.07 2.56 0.00 0.00 0.00 173.10 179.13 3h7f s PRO 259 N 0.09 2.66 -0.85 2.90 0.04 -1.26 -5.01 135.00 133.56 3h7f s PRO 259 Ca 0.63 0.90 -0.20 0.00 0.04 0.00 0.00 61.00 62.37 3h7f s PRO 259 Cb -0.43 -1.96 0.11 0.00 0.04 0.00 0.00 34.50 32.26 3h7f s PRO 259 CO 0.40 -1.28 1.08 -0.51 0.04 0.00 0.00 177.00 176.73 3h7f s LEU 260 N -5.64 4.85 0.34 -3.56 1.43 -1.26 -4.78 118.68 110.06 3h7f s LEU 260 Ca 0.59 -1.74 0.10 0.00 -1.03 0.00 0.00 54.13 52.05 3h7f s LEU 260 Cb -0.14 -2.41 0.60 0.00 0.03 0.00 0.00 46.19 44.27 3h7f s LEU 260 CO 0.55 -1.17 1.76 0.24 0.23 0.00 0.00 176.35 177.96 3h7f h MET 261 N 9.06 0.08 -0.77 1.70 2.86 -1.86 -1.57 114.93 124.43 3h7f h MET 261 Ca 0.03 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3h7f h MET 261 Cb 1.04 -0.00 -0.04 0.00 0.06 0.00 0.00 31.60 32.66 3h7f h MET 261 CO 1.14 0.48 0.48 1.12 1.06 0.00 0.00 176.91 181.19 3h7f h HIS 262 N 0.07 0.99 -0.38 -0.22 -0.00 -1.86 -1.50 115.15 112.24 3h7f h HIS 262 Ca 0.00 0.01 -0.14 0.00 -0.00 0.00 0.00 60.37 60.24 3h7f h HIS 262 Cb 0.75 -0.33 -0.01 0.00 -0.00 0.00 0.00 27.41 27.82 3h7f h HIS 262 CO 0.00 0.65 -0.32 0.28 -0.00 0.00 0.00 177.93 178.54 3h7f h VAL 263 N 1.05 1.28 -0.73 6.12 2.07 -1.71 -2.78 116.25 121.55 3h7f h VAL 263 Ca 0.28 -1.49 -0.03 0.00 0.82 0.00 0.00 66.70 66.29 3h7f h VAL 263 Cb -0.08 1.32 -0.03 0.00 -1.52 0.00 0.00 31.29 30.98 3h7f h VAL 263 CO -0.06 0.50 0.34 0.40 0.02 0.00 0.00 177.57 178.77 3h7f h ILE 264 N 0.72 1.23 -0.88 4.57 2.04 -1.14 -1.10 117.51 122.95 3h7f h ILE 264 Ca 0.07 -0.66 0.04 0.00 1.00 0.00 0.00 64.86 65.32 3h7f h ILE 264 Cb 0.88 0.31 -0.05 0.00 -0.74 0.00 0.00 36.82 37.22 3h7f h ILE 264 CO 0.08 0.28 0.56 0.00 0.00 0.00 0.00 178.15 179.07 3h7f h ALA 265 N 1.35 1.17 -0.17 1.87 0.00 -1.13 -1.68 119.26 120.67 3h7f h ALA 265 Ca 0.25 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 55.06 3h7f h ALA 265 Cb 0.11 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 3h7f h ALA 265 CO -0.03 0.39 -0.20 0.78 0.00 0.00 0.00 179.25 180.18 3h7f h GLY 266 N 1.08 0.32 0.99 0.00 0.00 -1.10 -2.69 103.07 101.66 3h7f h GLY 266 Ca 0.36 -0.22 0.00 0.00 0.00 0.00 0.00 47.33 47.46 3h7f h GLY 266 CO -0.13 0.21 0.24 0.50 0.00 0.00 0.00 176.54 177.36 3h7f h LYS 267 N 0.27 0.52 -0.78 4.80 1.57 -0.32 -1.46 116.57 121.16 3h7f h LYS 267 Ca 0.05 -0.04 0.07 0.00 -1.87 0.00 0.00 60.65 58.85 3h7f h LYS 267 Cb 0.52 -0.11 -0.06 0.00 0.08 0.00 0.00 32.23 32.66 3h7f h LYS 267 CO 0.03 0.37 0.47 0.00 -0.57 0.00 0.00 179.45 179.75 3h7f h ALA 268 N 1.12 1.08 -0.29 3.86 0.00 -1.12 -1.55 119.26 122.36 3h7f h ALA 268 Ca 0.14 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 3h7f h ALA 268 Cb -0.02 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 3h7f h ALA 268 CO -0.03 0.17 0.13 0.28 0.00 0.00 0.00 179.25 179.81 3h7f h VAL 269 N 0.84 1.16 -0.41 0.00 2.07 -1.27 -2.33 116.25 116.31 3h7f h VAL 269 Ca 0.35 -0.45 -0.06 0.00 0.82 0.00 0.00 66.70 67.36 3h7f h VAL 269 Cb 0.20 0.93 -0.02 0.00 -1.52 0.00 0.00 31.29 30.88 3h7f h VAL 269 CO -0.19 0.16 0.02 0.00 0.02 0.00 0.00 177.57 177.58 3h7f h ALA 270 N 0.99 1.27 -0.13 1.67 0.00 -1.01 -1.96 119.26 120.09 3h7f h ALA 270 Ca 0.10 -0.22 -0.14 0.00 0.00 0.00 0.00 54.91 54.65 3h7f h ALA 270 Cb 0.13 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 3h7f h ALA 270 CO -0.01 0.49 -0.52 -0.07 0.00 0.00 0.00 179.25 179.14 3h7f h LEU 271 N 0.62 0.39 -0.10 0.00 3.38 -1.16 -1.76 115.31 116.67 3h7f h LEU 271 Ca 0.13 -0.20 -0.02 0.00 0.09 0.00 0.00 57.88 57.88 3h7f h LEU 271 Cb 0.36 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 40.99 3h7f h LEU 271 CO 0.01 0.84 -0.01 0.50 0.09 0.00 0.00 178.44 179.87 3h7f h LYS 272 N 0.28 0.19 -0.77 1.13 3.64 -1.06 -3.07 116.57 116.91 3h7f h LYS 272 Ca 0.01 -0.07 0.04 0.00 -1.27 0.00 0.00 60.65 59.37 3h7f h LYS 272 Cb 1.01 -0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.77 3h7f h LYS 272 CO 0.09 0.47 0.51 0.82 -2.27 0.00 0.00 179.45 179.06 3h7f h ILE 273 N -0.11 1.09 0.00 2.00 2.04 -1.29 -3.02 117.51 118.22 3h7f h ILE 273 Ca 0.03 -0.31 0.00 0.00 1.00 0.00 0.00 64.86 65.58 3h7f h ILE 273 Cb 0.39 0.11 0.00 0.00 -0.74 0.00 0.00 36.82 36.58 3h7f h ILE 273 CO 0.01 0.17 0.00 0.00 0.00 0.00 0.00 178.15 178.32 3h7f h ALA 274 N 1.56 1.00 -0.01 1.87 0.00 -1.22 -1.95 119.26 120.52 3h7f h ALA 274 Ca 0.31 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.22 3h7f h ALA 274 Cb 0.10 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.89 3h7f h ALA 274 CO -0.10 0.00 -0.24 0.00 0.00 0.00 0.00 179.25 178.91 3h7f n ALA 275 N -1.82 3.05 -2.06 0.00 0.00 -1.14 -4.56 120.51 113.98 3h7f n ALA 275 Ca 0.01 -0.40 -0.31 0.00 0.00 0.00 0.00 53.44 52.74 3h7f n ALA 275 Cb 0.17 -1.15 -0.03 0.00 0.00 0.00 0.00 19.45 18.44 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 -2.49 4.70 0.36 0.00 -4.23 -0.73 -5.00 115.64 108.25 3h7f s THR 276 Ca 0.25 0.82 0.04 0.00 -1.18 0.00 0.00 61.69 61.62 3h7f s THR 276 Cb 0.19 -3.73 0.24 0.00 1.34 0.00 0.00 72.50 70.54 3h7f s THR 276 CO 0.51 -0.59 1.99 -0.65 -0.54 0.00 0.00 174.62 175.34 3h7f h PRO 277 N 1.10 0.70 -0.59 3.99 0.11 -1.94 -2.68 132.00 132.69 3h7f h PRO 277 Ca -0.47 -0.06 0.05 0.00 0.11 0.00 0.00 66.00 65.63 3h7f h PRO 277 Cb 1.19 -0.15 -0.05 0.00 0.11 0.00 0.00 31.00 32.10 3h7f h PRO 277 CO 0.63 0.51 0.31 1.49 -0.21 0.00 0.00 178.00 180.73 3h7f h GLU 278 N 0.72 0.57 -0.65 1.05 4.81 -1.94 -1.77 114.58 117.37 3h7f h GLU 278 Ca 0.19 -0.03 -0.05 0.00 -0.13 0.00 0.00 59.36 59.33 3h7f h GLU 278 Cb -0.00 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.22 3h7f h GLU 278 CO -0.03 0.38 0.22 0.35 -0.73 0.00 0.00 179.01 179.19 3h7f h PHE 279 N 0.59 1.03 -0.71 0.92 3.57 -1.74 -2.54 116.94 118.06 3h7f h PHE 279 Ca 0.26 -0.10 -0.01 0.00 3.53 0.00 0.00 57.97 61.65 3h7f h PHE 279 Cb 0.16 -0.30 -0.03 0.00 2.79 0.00 0.00 35.95 38.57 3h7f h PHE 279 CO -0.09 0.83 0.40 0.00 -2.23 0.00 0.00 178.31 177.22 3h7f h ALA 280 N 1.08 0.91 -0.84 2.41 0.00 -1.23 -1.39 119.26 120.21 3h7f h ALA 280 Ca 0.21 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 3h7f h ALA 280 Cb 0.27 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 17.74 3h7f h ALA 280 CO -0.01 0.41 0.45 0.22 0.00 0.00 0.00 179.25 180.33 3h7f h ASP 281 N 0.97 1.05 -0.87 0.00 3.58 -1.25 -1.51 116.42 118.39 3h7f h ASP 281 Ca 0.25 -0.10 -0.02 0.00 0.42 0.00 0.00 57.03 57.58 3h7f h ASP 281 Cb 0.02 -0.27 -0.04 0.00 1.72 0.00 0.00 39.33 40.76 3h7f h ASP 281 CO -0.04 0.85 0.46 -0.09 -2.88 0.00 0.00 179.24 177.54 3h7f h ARG 282 N 1.16 1.22 -0.45 0.28 2.43 -1.00 0.05 114.38 118.08 3h7f h ARG 282 Ca 0.29 -0.15 -0.06 0.00 -0.81 0.00 0.00 59.98 59.25 3h7f h ARG 282 Cb 0.04 -0.23 -0.02 0.00 -0.42 0.00 0.00 29.97 29.33 3h7f h ARG 282 CO -0.05 0.90 0.02 1.96 -1.51 0.00 0.00 179.97 181.30 3h7f h GLN 283 N 1.22 0.72 -0.49 0.20 1.08 -1.08 -1.78 115.11 114.97 3h7f h GLN 283 Ca 0.30 -0.17 -0.13 0.00 -1.45 0.00 0.00 58.65 57.21 3h7f h GLN 283 Cb 0.05 -0.09 -0.01 0.00 -0.05 0.00 0.00 27.48 27.37 3h7f h GLN 283 CO -0.05 0.71 -0.20 -0.09 -0.95 0.00 0.00 178.83 178.26 3h7f h ARG 284 N 0.68 0.98 -0.42 1.46 2.43 -0.15 -2.48 114.38 116.89 3h7f h ARG 284 Ca 0.14 -0.41 -0.05 0.00 -0.81 0.00 0.00 59.98 58.85 3h7f h ARG 284 Cb 0.38 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.87 3h7f h ARG 284 CO 0.01 1.08 0.03 0.00 -1.51 0.00 0.00 179.97 179.59 3h7f h ARG 285 N 0.85 0.65 0.07 0.20 3.08 -0.96 -1.88 114.38 116.39 3h7f h ARG 285 Ca 0.11 -0.14 0.02 0.00 0.07 0.00 0.00 59.98 60.04 3h7f h ARG 285 Cb 0.77 -0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.70 3h7f h ARG 285 CO 0.06 0.65 -0.20 1.15 -1.07 0.00 0.00 179.97 180.56 3h7f h THR 286 N 0.62 0.55 -0.53 2.04 2.02 -1.17 -1.72 112.91 114.71 3h7f h THR 286 Ca 0.13 0.00 -0.10 0.00 0.77 0.00 0.00 66.41 67.21 3h7f h THR 286 Cb 0.34 0.55 -0.02 0.00 -1.74 0.00 0.00 68.15 67.28 3h7f h THR 286 CO 0.01 0.00 -0.07 -0.07 0.37 0.00 0.00 175.52 175.75 3h7f h LEU 287 N -0.35 0.99 -0.70 2.58 3.38 -1.31 -2.69 115.31 117.21 3h7f h LEU 287 Ca 0.04 -0.34 -0.04 0.00 0.09 0.00 0.00 57.88 57.62 3h7f h LEU 287 Cb 0.39 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.84 3h7f h LEU 287 CO -0.13 1.10 0.27 -1.28 0.09 0.00 0.00 178.44 178.48 3h7f h SER 288 N 0.87 0.98 -0.63 -0.43 0.87 -1.36 -2.37 113.55 111.48 3h7f h SER 288 Ca 0.14 -0.18 -0.03 0.00 -1.23 0.00 0.00 61.79 60.49 3h7f h SER 288 Cb 0.63 -0.25 -0.03 0.00 -0.44 0.00 0.00 62.40 62.31 3h7f h SER 288 CO 0.04 0.89 0.27 1.23 -0.53 0.00 0.00 176.83 178.73 3h7f h GLY 289 N 1.00 1.00 1.18 5.77 0.00 -1.25 -1.74 103.07 109.03 3h7f h GLY 289 Ca 0.23 -0.53 -0.06 0.00 0.00 0.00 0.00 47.33 46.98 3h7f h GLY 289 CO -0.02 0.50 0.19 0.00 0.00 0.00 0.00 176.54 177.21 3h7f h ALA 290 N 1.11 1.08 -0.63 3.60 0.00 -1.31 -2.02 119.26 121.09 3h7f h ALA 290 Ca 0.21 -0.22 -0.09 0.00 0.00 0.00 0.00 54.91 54.81 3h7f h ALA 290 Cb 0.17 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 3h7f h ALA 290 CO -0.02 0.62 0.02 0.07 0.00 0.00 0.00 179.25 179.94 3h7f h ARG 291 N 0.99 1.09 -0.75 0.00 -0.00 -1.29 -1.88 114.38 112.54 3h7f h ARG 291 Ca 0.21 -0.33 -0.03 0.00 -0.00 0.00 0.00 59.98 59.83 3h7f h ARG 291 Cb 0.31 -0.11 -0.03 0.00 -0.00 0.00 0.00 29.97 30.14 3h7f h ARG 291 CO -0.00 1.04 0.34 0.82 -0.00 0.00 0.00 179.97 182.17 3h7f h ILE 292 N 1.00 1.24 -0.13 0.08 2.04 -1.01 -2.00 117.51 118.73 3h7f h ILE 292 Ca 0.18 -0.71 -0.11 0.00 1.00 0.00 0.00 64.86 65.22 3h7f h ILE 292 Cb 0.54 0.30 0.00 0.00 -0.74 0.00 0.00 36.82 36.92 3h7f h ILE 292 CO 0.03 0.30 -0.34 0.40 0.00 0.00 0.00 178.15 178.54 3h7f h ILE 293 N 1.08 1.37 -0.64 -0.67 2.04 -1.30 -2.69 117.51 116.70 3h7f h ILE 293 Ca 0.26 -1.63 0.01 0.00 1.00 0.00 0.00 64.86 64.50 3h7f h ILE 293 Cb 0.14 2.07 -0.03 0.00 -0.74 0.00 0.00 36.82 38.26 3h7f h ILE 293 CO -0.03 0.49 0.42 0.00 0.00 0.00 0.00 178.15 179.02 3h7f h ALA 294 N 0.52 0.81 -0.45 1.87 0.00 -1.26 -1.94 119.26 118.81 3h7f h ALA 294 Ca -0.01 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 3h7f h ALA 294 Cb 0.95 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 3h7f h ALA 294 CO 0.07 0.22 0.15 -0.44 0.00 0.00 0.00 179.25 179.26 3h7f h ASP 295 N 0.85 0.64 -0.35 0.00 5.19 -1.42 -2.65 116.42 118.68 3h7f h ASP 295 Ca 0.24 -0.19 -0.03 0.00 -0.62 0.00 0.00 57.03 56.43 3h7f h ASP 295 Cb -0.08 -0.17 -0.02 0.00 0.18 0.00 0.00 39.33 39.24 3h7f h ASP 295 CO -0.06 0.66 0.14 -0.09 -3.12 0.00 0.00 179.24 176.78 3h7f h ARG 296 N 0.58 0.58 -0.00 3.56 9.65 -1.31 -2.41 114.38 125.03 3h7f h ARG 296 Ca 0.15 -0.08 0.00 0.00 -1.10 0.00 0.00 59.98 58.94 3h7f h ARG 296 Cb 0.24 -0.11 0.00 0.00 -1.39 0.00 0.00 29.97 28.71 3h7f h ARG 296 CO -0.01 0.50 -0.02 1.28 2.80 0.00 0.00 179.97 184.53 3h7f n LEU 297 N -4.36 0.06 -1.17 3.80 4.77 -0.75 -2.79 117.00 116.56 3h7f n LEU 297 Ca 0.03 0.22 0.11 0.00 -0.03 0.00 0.00 56.01 56.34 3h7f n LEU 297 Cb 0.16 -0.25 0.25 0.00 -2.33 0.00 0.00 43.42 41.26 3h7f n LEU 297 CO 0.37 0.01 0.72 0.23 -1.33 0.00 0.00 177.39 177.40 3h7f n MET 298 N -1.22 2.59 -1.40 3.23 2.81 -0.91 -4.50 117.12 117.72 3h7f n MET 298 Ca 0.15 -2.41 -0.31 0.00 -1.81 0.00 0.00 57.70 53.32 3h7f n MET 298 Cb 0.23 -1.50 0.07 0.00 -0.71 0.00 0.00 33.22 31.31 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 -1.19 2.42 0.31 3.04 0.00 -1.12 -4.74 121.76 120.47 3h7f s ALA 299 Ca 0.41 0.22 0.05 0.00 0.00 0.00 0.00 51.96 52.64 3h7f s ALA 299 Cb 0.22 -3.24 0.68 0.00 0.00 0.00 0.00 23.12 20.79 3h7f s ALA 299 CO 0.30 -1.54 1.82 -1.35 0.00 0.00 0.00 175.76 174.99 3h7f h PRO 300 N -0.90 0.82 -0.61 0.00 0.11 -1.95 -2.01 132.00 127.46 3h7f h PRO 300 Ca -0.44 -0.05 -0.05 0.00 0.11 0.00 0.00 66.00 65.57 3h7f h PRO 300 Cb 1.22 -0.19 -0.03 0.00 0.11 0.00 0.00 31.00 32.12 3h7f h PRO 300 CO 0.53 0.54 0.17 0.38 -0.21 0.00 0.00 178.00 179.42 3h7f h ASP 301 N 0.85 0.87 0.15 -2.05 2.03 -1.95 -1.90 116.42 114.42 3h7f h ASP 301 Ca 0.52 -0.15 -0.31 0.00 -0.73 0.00 0.00 57.03 56.36 3h7f h ASP 301 Cb 0.71 -0.23 0.03 0.00 -0.83 0.00 0.00 39.33 39.01 3h7f h ASP 301 CO -0.30 0.83 -1.30 0.58 -1.03 0.00 0.00 179.24 178.02 3h7f h VAL 302 N 0.90 1.28 -0.73 4.15 2.07 -1.69 -3.18 116.25 119.05 3h7f h VAL 302 Ca 0.20 -2.50 -0.04 0.00 0.82 0.00 0.00 66.70 65.17 3h7f h VAL 302 Cb 0.29 2.76 -0.03 0.00 -1.52 0.00 0.00 31.29 32.78 3h7f h VAL 302 CO -0.01 0.76 0.29 0.00 0.02 0.00 0.00 177.57 178.63 3h7f h ALA 303 N 0.26 0.95 0.00 1.67 0.00 -1.36 -2.66 119.26 118.12 3h7f h ALA 303 Ca -0.20 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.48 3h7f h ALA 303 Cb 1.97 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 19.47 3h7f h ALA 303 CO 0.25 0.58 -0.17 1.57 0.00 0.00 0.00 179.25 181.47 3h7f h LYS 304 N 1.05 0.00 0.00 0.00 2.10 -1.43 -2.34 116.57 115.95 3h7f h LYS 304 Ca 0.24 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.89 3h7f h LYS 304 Cb 0.22 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.55 3h7f h LYS 304 CO -0.02 0.17 0.00 0.00 -2.00 0.00 0.00 179.45 177.60 3h7f n ALA 305 N -2.43 2.10 -0.17 0.07 0.00 -1.01 -4.90 120.51 114.17 3h7f n ALA 305 Ca -0.02 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.32 3h7f n ALA 305 Cb 0.25 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.33 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 0.73 0.89 3.81 0.00 0.00 -0.88 -4.36 105.19 105.38 3h7f n GLY 306 Ca 0.08 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.02 5.14 0.10 1.61 1.01 -1.19 -3.42 120.40 121.63 3h7f s VAL 307 Ca 0.00 0.75 0.05 0.00 0.00 0.00 0.00 61.98 62.78 3h7f s VAL 307 Cb 0.00 -3.68 -0.03 0.00 0.00 0.00 0.00 36.38 32.66 3h7f s VAL 307 CO 0.00 0.52 -0.14 -0.94 0.00 0.00 0.00 175.10 174.54 3h7f s SER 308 N -0.57 1.80 -0.27 3.32 1.04 -0.95 -4.31 113.70 113.76 3h7f s SER 308 Ca 0.22 -0.74 -0.10 0.00 0.48 0.00 0.00 55.95 55.81 3h7f s SER 308 Cb -0.15 -0.05 -0.04 0.00 0.10 0.00 0.00 66.02 65.87 3h7f s SER 308 CO 0.10 -0.14 0.16 -0.69 0.98 0.00 0.00 173.24 173.66 3h7f s VAL 309 N -1.88 5.07 0.08 5.02 1.01 -1.26 -1.17 120.40 127.26 3h7f s VAL 309 Ca 0.05 0.09 -0.31 0.00 0.00 0.00 0.00 61.98 61.81 3h7f s VAL 309 Cb -0.06 -3.40 -0.09 0.00 0.00 0.00 0.00 36.38 32.82 3h7f s VAL 309 CO 0.02 0.28 1.81 -0.69 0.00 0.00 0.00 175.10 176.52 3h7f s VAL 310 N 1.69 2.83 0.00 2.92 1.01 -0.00 -1.77 120.40 127.08 3h7f s VAL 310 Ca 0.07 0.18 0.00 0.00 0.00 0.00 0.00 61.98 62.23 3h7f s VAL 310 Cb -0.16 -3.12 0.00 0.00 0.00 0.00 0.00 36.38 33.11 3h7f s VAL 310 CO 0.09 -0.01 0.00 -1.54 0.00 0.00 0.00 175.10 173.64 3h7f n SER 311 N 6.21 0.00 -0.21 3.32 3.41 -1.26 -4.01 113.62 121.08 3h7f n SER 311 Ca 0.18 0.00 -0.03 0.00 -0.26 0.00 0.00 58.87 58.76 3h7f n SER 311 Cb 0.40 -0.31 -0.01 0.00 -0.26 0.00 0.00 64.21 64.03 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 -2.00 0.60 0.00 5.00 0.00 -0.73 -4.91 105.19 103.15 3h7f n GLY 312 Ca 0.00 -0.90 0.00 0.00 0.00 0.00 0.00 46.02 45.12 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 -2.62 -0.60 3.40 -0.02 0.00 -1.26 -5.03 105.19 99.05 3h7f n GLY 313 Ca -0.03 -1.15 -0.16 0.00 0.00 0.00 0.00 46.02 44.69 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 -3.00 0.02 -0.44 2.61 -1.32 -1.26 -4.84 115.64 107.41 3h7f s THR 314 Ca 0.00 -0.20 0.04 0.00 -1.21 0.00 0.00 61.69 60.32 3h7f s THR 314 Cb 0.00 -0.82 0.08 0.00 -1.51 0.00 0.00 72.50 70.25 3h7f s THR 314 CO 0.00 -0.11 0.89 0.47 -2.21 0.00 0.00 174.62 173.66 3h7f n ASP 315 N 1.18 1.90 -0.29 8.08 8.00 -0.62 -4.83 116.55 129.98 3h7f n ASP 315 Ca -0.20 -1.62 0.00 0.00 0.71 0.00 0.00 54.79 53.68 3h7f n ASP 315 Cb 0.57 -0.05 0.00 0.00 -0.02 0.00 0.00 41.12 41.62 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 0.05 0.00 0.82 2.53 0.24 -1.25 -4.95 118.33 115.78 3h7f n VAL 316 Ca 0.04 0.00 0.05 0.00 -2.04 0.00 0.00 64.34 62.38 3h7f n VAL 316 Cb 0.22 0.00 0.15 0.00 -1.47 0.00 0.00 33.84 32.74 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 0.52 -3.86 6.34 1.44 -1.26 -4.74 115.22 113.66 3h7f n HIS 317 Ca 0.00 -0.23 -0.09 0.00 -2.01 0.00 0.00 57.72 55.39 3h7f n HIS 317 Cb 0.00 -0.06 -0.07 0.00 0.12 0.00 0.00 29.99 29.98 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 -1.04 1.45 -0.10 2.39 0.05 -1.26 -2.05 118.68 118.12 3h7f s LEU 318 Ca 0.22 -0.65 0.03 0.00 0.05 0.00 0.00 54.13 53.78 3h7f s LEU 318 Cb 0.12 1.01 0.01 0.00 -2.05 0.00 0.00 46.19 45.28 3h7f s LEU 318 CO 0.13 -0.72 -0.20 -0.69 -0.55 0.00 0.00 176.35 174.32 3h7f s VAL 319 N -3.82 1.77 -0.23 1.48 1.01 0.10 -4.84 120.40 115.87 3h7f s VAL 319 Ca 0.05 -0.84 -0.10 0.00 0.00 0.00 0.00 61.98 61.08 3h7f s VAL 319 Cb 0.05 -1.56 -0.05 0.00 0.00 0.00 0.00 36.38 34.81 3h7f s VAL 319 CO -0.11 0.50 0.15 -0.76 0.00 0.00 0.00 175.10 174.88 3h7f s LEU 320 N 0.60 4.13 -0.09 3.92 1.43 -1.26 -1.69 118.68 125.72 3h7f s LEU 320 Ca -0.14 0.13 0.04 0.00 -1.03 0.00 0.00 54.13 53.13 3h7f s LEU 320 Cb -0.17 -2.10 -0.01 0.00 0.03 0.00 0.00 46.19 43.94 3h7f s LEU 320 CO 0.04 0.09 -0.21 -0.69 0.23 0.00 0.00 176.35 175.81 3h7f s VAL 321 N 0.92 2.37 -0.26 -1.59 1.01 -0.38 -0.82 120.40 121.65 3h7f s VAL 321 Ca 0.08 -0.93 -0.09 0.00 0.00 0.00 0.00 61.98 61.04 3h7f s VAL 321 Cb -0.13 -1.92 -0.04 0.00 0.00 0.00 0.00 36.38 34.30 3h7f s VAL 321 CO 0.03 0.56 0.12 -0.62 0.00 0.00 0.00 175.10 175.19 3h7f s ASP 322 N 0.10 5.54 0.00 3.32 -1.08 -0.32 -1.90 116.67 122.33 3h7f s ASP 322 Ca -0.10 -0.11 0.22 0.00 -0.52 0.00 0.00 52.55 52.04 3h7f s ASP 322 Cb -0.16 -2.01 0.34 0.00 -1.46 0.00 0.00 42.92 39.63 3h7f s ASP 322 CO 0.06 -0.04 1.33 0.18 0.52 0.00 0.00 175.17 177.22 3h7f n LEU 323 N 4.95 3.26 0.25 -1.34 4.77 0.05 -2.23 117.00 126.71 3h7f n LEU 323 Ca -0.15 -1.36 0.11 0.00 -0.03 0.00 0.00 56.01 54.58 3h7f n LEU 323 Cb 0.52 -0.17 0.67 0.00 -2.33 0.00 0.00 43.42 42.11 3h7f n LEU 323 CO 0.32 0.66 0.95 0.08 -1.33 0.00 0.00 177.39 178.07 3h7f h ARG 324 N 4.35 0.00 -0.66 3.23 0.11 -1.85 -1.42 114.38 118.15 3h7f h ARG 324 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 3h7f h ARG 324 Cb 0.96 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.04 3h7f h ARG 324 CO 0.00 0.14 0.00 -0.25 0.10 0.00 0.00 179.97 179.96 3h7f n ASP 325 N -3.73 4.80 -4.78 0.08 8.00 -1.26 -4.98 116.55 114.67 3h7f n ASP 325 Ca -0.02 -2.48 -0.24 0.00 0.71 0.00 0.00 54.79 52.76 3h7f n ASP 325 Cb 0.25 -0.59 -0.06 0.00 -0.02 0.00 0.00 41.12 40.70 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 -0.87 4.54 0.00 -2.24 1.04 -0.53 -4.42 113.70 111.21 3h7f s SER 326 Ca 0.51 -1.05 0.23 0.00 0.48 0.00 0.00 55.95 56.11 3h7f s SER 326 Cb 0.33 -0.39 1.11 0.00 0.10 0.00 0.00 66.02 67.17 3h7f s SER 326 CO 0.24 -0.62 1.74 -2.65 0.98 0.00 0.00 173.24 172.93 3h7f n PRO 327 N -1.34 0.25 -4.06 4.02 -0.02 -1.26 -4.82 135.00 127.78 3h7f n PRO 327 Ca -0.01 0.08 -0.36 0.00 -2.02 0.00 0.00 63.50 61.19 3h7f n PRO 327 Cb 0.64 -1.50 -0.07 0.00 -0.02 0.00 0.00 33.50 32.55 3h7f n PRO 327 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3h7f s LEU 328 N -2.67 4.09 0.56 2.45 1.43 -1.26 -5.11 118.68 118.18 3h7f s LEU 328 Ca 0.19 0.34 0.05 0.00 -1.03 0.00 0.00 54.13 53.68 3h7f s LEU 328 Cb 0.15 -2.01 0.06 0.00 0.03 0.00 0.00 46.19 44.42 3h7f s LEU 328 CO 0.36 0.39 0.78 1.51 0.23 0.00 0.00 176.35 179.62 3h7f s ASP 329 N -1.05 5.11 0.22 2.29 1.47 -1.26 -4.72 116.67 118.73 3h7f s ASP 329 Ca 0.15 -0.41 -0.08 0.00 1.18 0.00 0.00 52.55 53.40 3h7f s ASP 329 Cb -0.12 -0.32 0.32 0.00 -0.34 0.00 0.00 42.92 42.47 3h7f s ASP 329 CO 0.04 -1.27 1.77 1.23 0.68 0.00 0.00 175.17 177.62 3h7f h GLY 330 N 0.10 1.01 1.23 2.12 0.00 -1.89 -1.26 103.07 104.37 3h7f h GLY 330 Ca -0.37 -0.20 -0.12 0.00 0.00 0.00 0.00 47.33 46.65 3h7f h GLY 330 CO 0.45 0.04 -0.18 -1.61 0.00 0.00 0.00 176.54 175.23 3h7f h GLN 331 N 0.55 0.89 -0.57 4.80 5.75 -1.96 -1.70 115.11 122.87 3h7f h GLN 331 Ca 0.34 -0.35 -0.10 0.00 -0.15 0.00 0.00 58.65 58.39 3h7f h GLN 331 Cb 0.37 -0.05 -0.02 0.00 1.07 0.00 0.00 27.48 28.86 3h7f h GLN 331 CO -0.28 1.00 -0.03 0.00 -2.65 0.00 0.00 178.83 176.87 3h7f h ALA 332 N 1.00 0.77 -0.51 3.38 0.00 -1.80 -1.40 119.26 120.71 3h7f h ALA 332 Ca 0.11 -0.32 -0.07 0.00 0.00 0.00 0.00 54.91 54.63 3h7f h ALA 332 Cb 0.72 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 3h7f h ALA 332 CO 0.06 0.63 0.04 0.00 0.00 0.00 0.00 179.25 179.98 3h7f h ALA 333 N 0.96 0.68 -0.49 0.00 0.00 -1.13 -1.98 119.26 117.30 3h7f h ALA 333 Ca 0.16 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 3h7f h ALA 333 Cb 0.59 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 3h7f h ALA 333 CO 0.04 0.46 0.21 1.49 0.00 0.00 0.00 179.25 181.44 3h7f h GLU 334 N 0.74 0.73 -0.68 0.00 4.81 -1.19 -2.13 114.58 116.86 3h7f h GLU 334 Ca 0.15 -0.13 -0.07 0.00 -0.13 0.00 0.00 59.36 59.18 3h7f h GLU 334 Cb 0.46 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.69 3h7f h GLU 334 CO 0.02 0.64 0.14 -0.44 -0.73 0.00 0.00 179.01 178.64 3h7f h ASP 335 N 0.65 1.05 -0.67 1.04 3.32 -1.16 -2.17 116.42 118.48 3h7f h ASP 335 Ca 0.17 -0.24 -0.08 0.00 0.02 0.00 0.00 57.03 56.89 3h7f h ASP 335 Cb 0.18 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.42 3h7f h ASP 335 CO -0.02 1.02 0.12 0.25 -1.72 0.00 0.00 179.24 178.90 3h7f h LEU 336 N 1.03 1.06 -0.78 1.55 5.85 -1.24 -2.40 115.31 120.38 3h7f h LEU 336 Ca 0.21 -0.25 -0.11 0.00 0.84 0.00 0.00 57.88 58.58 3h7f h LEU 336 Cb 0.40 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.13 3h7f h LEU 336 CO 0.01 1.04 -0.23 -0.07 -0.34 0.00 0.00 178.44 178.85 3h7f h LEU 337 N 1.04 0.69 -1.19 2.25 3.38 -1.22 -2.63 115.31 117.63 3h7f h LEU 337 Ca 0.21 -0.24 0.03 0.00 0.09 0.00 0.00 57.88 57.97 3h7f h LEU 337 Cb 0.42 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 40.94 3h7f h LEU 337 CO 0.01 0.90 0.56 -0.74 0.09 0.00 0.00 178.44 179.26 3h7f h HIS 338 N 0.60 1.02 -0.55 1.13 2.76 -1.12 -1.45 115.15 117.55 3h7f h HIS 338 Ca 0.09 0.03 0.03 0.00 -2.20 0.00 0.00 60.37 58.32 3h7f h HIS 338 Cb 0.70 -0.34 -0.03 0.00 1.55 0.00 0.00 27.41 29.29 3h7f h HIS 338 CO 0.03 0.60 0.36 0.93 -1.30 0.00 0.00 177.93 178.55 3h7f h GLU 339 N 1.06 0.60 -0.62 5.26 5.08 -1.05 -2.24 114.58 122.67 3h7f h GLU 339 Ca 0.34 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.66 3h7f h GLU 339 Cb 0.02 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.13 3h7f h GLU 339 CO -0.10 0.40 0.00 1.33 -1.00 0.00 0.00 179.01 179.64 3h7f n VAL 340 N -4.47 0.83 -0.38 3.13 0.24 -0.94 -4.76 118.33 111.99 3h7f n VAL 340 Ca 0.06 -0.83 0.00 0.00 -2.04 0.00 0.00 64.34 61.54 3h7f n VAL 340 Cb 0.15 0.41 0.00 0.00 -1.47 0.00 0.00 33.84 32.93 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 1.48 0.78 3.30 7.63 0.00 -0.84 -4.25 105.19 113.30 3h7f n GLY 341 Ca 0.21 -0.28 -0.33 0.00 0.00 0.00 0.00 46.02 45.61 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 2.79 -0.37 -0.61 1.01 -0.59 -1.33 121.20 120.10 3h7f s ILE 342 Ca 0.00 -0.74 -0.15 0.00 0.00 0.00 0.00 60.65 59.76 3h7f s ILE 342 Cb 0.00 -2.17 -0.00 0.00 0.01 0.00 0.00 42.46 40.30 3h7f s ILE 342 CO 0.00 0.52 0.31 -0.89 0.00 0.00 0.00 174.94 174.88 3h7f s THR 343 N 0.60 5.22 0.14 2.92 2.01 -0.66 -2.79 115.64 123.09 3h7f s THR 343 Ca -0.09 -0.28 0.00 0.00 0.31 0.00 0.00 61.69 61.64 3h7f s THR 343 Cb -0.16 -3.84 -0.00 0.00 0.01 0.00 0.00 72.50 68.51 3h7f s THR 343 CO 0.03 -0.16 0.02 1.33 -0.69 0.00 0.00 174.62 175.15 3h7f n VAL 344 N 5.20 0.00 -4.07 3.82 0.24 -1.26 -0.94 118.33 121.31 3h7f n VAL 344 Ca -0.11 -0.72 -0.11 0.00 -2.04 0.00 0.00 64.34 61.36 3h7f n VAL 344 Cb 0.49 0.19 -0.11 0.00 -1.47 0.00 0.00 33.84 32.93 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 -1.81 0.80 0.96 -1.34 4.22 -1.20 -4.85 114.94 111.72 3h7f s ASN 345 Ca 0.02 -0.67 -0.16 0.00 -2.14 0.00 0.00 52.86 49.92 3h7f s ASN 345 Cb 0.00 0.07 0.20 0.00 1.28 0.00 0.00 41.25 42.80 3h7f s ASN 345 CO 0.02 -0.30 1.32 0.00 -2.04 0.00 0.00 177.10 176.10 3h7f s ARG 346 N -2.19 0.61 0.00 3.55 1.70 -1.26 -0.94 118.95 120.42 3h7f s ARG 346 Ca -0.05 -0.45 -0.01 0.00 -0.47 0.00 0.00 55.73 54.75 3h7f s ARG 346 Cb -0.06 -1.85 -0.02 0.00 -0.57 0.00 0.00 34.95 32.45 3h7f s ARG 346 CO -0.02 -2.42 0.82 0.43 -1.08 0.00 0.00 175.30 173.03 3h7f n SER 360 N -3.76 0.03 -4.50 -2.89 7.64 -1.26 -4.71 113.62 104.16 3h7f n SER 360 Ca 0.15 -1.70 -0.25 0.00 1.01 0.00 0.00 58.87 58.08 3h7f n SER 360 Cb 0.59 -0.39 -0.10 0.00 -1.01 0.00 0.00 64.21 63.30 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 4.26 2.03 -0.13 0.23 0.00 -1.26 -0.77 107.32 111.67 3h7f s GLY 361 Ca 0.03 -1.98 -0.10 0.00 0.00 0.00 0.00 44.72 42.66 3h7f s GLY 361 CO 0.01 -1.99 0.34 -2.27 0.00 0.00 0.00 173.10 169.19 3h7f s LEU 362 N -3.55 0.53 -0.10 0.66 2.96 -0.80 -4.65 118.68 113.73 3h7f s LEU 362 Ca 0.31 0.70 0.03 0.00 -0.22 0.00 0.00 54.13 54.95 3h7f s LEU 362 Cb -0.01 1.14 -0.00 0.00 0.50 0.00 0.00 46.19 47.81 3h7f s LEU 362 CO 0.15 -0.14 -0.22 -0.13 -1.32 0.00 0.00 176.35 174.70 3h7f s ARG 363 N 0.54 3.08 -0.15 1.98 0.52 -0.11 -1.25 118.95 123.55 3h7f s ARG 363 Ca -0.03 -0.84 0.01 0.00 -0.52 0.00 0.00 55.73 54.35 3h7f s ARG 363 Cb -0.04 -2.36 0.02 0.00 0.52 0.00 0.00 34.95 33.08 3h7f s ARG 363 CO -0.03 0.21 -0.17 0.42 0.02 0.00 0.00 175.30 175.74 3h7f s ILE 364 N 0.29 1.80 0.19 1.52 1.01 -0.68 -3.26 121.20 122.06 3h7f s ILE 364 Ca -0.16 -0.79 0.11 0.00 0.00 0.00 0.00 60.65 59.81 3h7f s ILE 364 Cb -0.17 -1.64 -0.04 0.00 0.01 0.00 0.00 42.46 40.62 3h7f s ILE 364 CO 0.08 0.50 -0.22 -0.83 0.00 0.00 0.00 174.94 174.47 3h7f s GLY 365 N 1.24 1.71 0.00 6.18 0.00 -0.44 -0.72 107.32 115.28 3h7f s GLY 365 Ca 0.01 -1.60 0.09 0.00 0.00 0.00 0.00 44.72 43.22 3h7f s GLY 365 CO -0.09 -1.62 0.42 -1.30 0.00 0.00 0.00 173.10 170.51 3h7f n THR 366 N 0.27 0.00 -0.20 0.90 -2.24 -0.87 -4.51 114.28 107.62 3h7f n THR 366 Ca -0.13 -0.31 -0.00 0.00 -2.27 0.00 0.00 64.05 61.34 3h7f n THR 366 Cb 0.56 1.02 0.10 0.00 -2.10 0.00 0.00 70.33 69.91 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 0.20 0.42 -0.51 -0.78 0.11 -1.85 -2.36 132.00 127.23 3h7f h PRO 367 Ca 0.00 -0.02 -0.06 0.00 0.11 0.00 0.00 66.00 66.02 3h7f h PRO 367 Cb 0.23 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 31.23 3h7f h PRO 367 CO 0.00 0.27 0.07 0.00 -0.21 0.00 0.00 178.00 178.14 3h7f h ALA 368 N 1.40 0.68 -0.34 -0.75 0.00 -1.82 -1.72 119.26 116.71 3h7f h ALA 368 Ca 0.30 -0.24 -0.10 0.00 0.00 0.00 0.00 54.91 54.86 3h7f h ALA 368 Cb 0.35 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 3h7f h ALA 368 CO -0.29 0.42 -0.22 -0.07 0.00 0.00 0.00 179.25 179.10 3h7f h LEU 369 N 0.72 0.66 -0.34 0.00 3.38 -1.70 -2.41 115.31 115.62 3h7f h LEU 369 Ca 0.15 -0.23 -0.00 0.00 0.09 0.00 0.00 57.88 57.89 3h7f h LEU 369 Cb 0.42 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 3h7f h LEU 369 CO 0.01 0.87 0.20 0.00 0.09 0.00 0.00 178.44 179.61 3h7f h ALA 370 N 1.18 0.44 -0.81 1.53 0.00 -1.29 -2.02 119.26 118.29 3h7f h ALA 370 Ca 0.09 -0.06 0.10 0.00 0.00 0.00 0.00 54.91 55.03 3h7f h ALA 370 Cb 0.69 -0.14 -0.06 0.00 0.00 0.00 0.00 17.79 18.28 3h7f h ALA 370 CO 0.05 -0.05 0.53 1.15 0.00 0.00 0.00 179.25 180.93 3h7f h THR 371 N 0.44 0.94 0.00 0.00 2.02 -1.19 -1.72 112.91 113.40 3h7f h THR 371 Ca 0.12 -0.26 0.00 0.00 0.77 0.00 0.00 66.41 67.05 3h7f h THR 371 Cb 0.03 0.13 0.00 0.00 -1.74 0.00 0.00 68.15 66.57 3h7f h THR 371 CO -0.02 0.14 0.00 -0.09 0.37 0.00 0.00 175.52 175.91 3h7f h ARG 372 N 0.74 0.00 0.00 6.66 2.43 -1.13 -3.47 114.38 119.62 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 0.46 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.01 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 0.40 1.21 3.75 2.80 0.00 -0.65 -4.83 105.19 107.89 3h7f n GLY 373 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 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 2.94 0.00 1.61 0.40 -0.79 -5.00 117.98 115.14 3h7f s PHE 374 Ca 0.00 1.08 0.00 0.00 -0.60 0.00 0.00 56.93 57.41 3h7f s PHE 374 Cb 0.00 -3.85 0.00 0.00 0.51 0.00 0.00 43.02 39.68 3h7f s PHE 374 CO 0.00 -2.68 0.00 0.41 0.70 0.00 0.00 175.22 173.65 3h7f n GLY 375 N 1.77 7.14 0.24 4.36 0.00 -1.26 -4.54 105.19 112.89 3h7f n GLY 375 Ca 0.05 -1.97 -0.07 0.00 0.00 0.00 0.00 46.02 44.02 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 0.71 -0.88 1.61 5.19 -1.96 -1.56 116.42 119.53 3h7f h ASP 376 Ca 0.00 -0.12 0.09 0.00 -0.62 0.00 0.00 57.03 56.38 3h7f h ASP 376 Cb 0.00 -0.18 -0.07 0.00 0.18 0.00 0.00 39.33 39.26 3h7f h ASP 376 CO 0.00 0.62 0.53 0.74 -3.12 0.00 0.00 179.24 178.01 3h7f h THR 377 N 0.74 0.95 -0.12 0.35 2.02 -1.99 -0.43 112.91 114.43 3h7f h THR 377 Ca 0.19 -0.31 -0.23 0.00 0.77 0.00 0.00 66.41 66.83 3h7f h THR 377 Cb 0.09 -0.02 0.01 0.00 -1.74 0.00 0.00 68.15 66.49 3h7f h THR 377 CO -0.03 0.16 -0.83 -0.33 0.37 0.00 0.00 175.52 174.87 3h7f h GLU 378 N 0.90 0.75 -0.01 6.66 3.07 -1.83 -2.75 114.58 121.36 3h7f h GLU 378 Ca 0.41 -0.65 -0.10 0.00 -0.50 0.00 0.00 59.36 58.53 3h7f h GLU 378 Cb 0.33 0.15 -0.01 0.00 -0.84 0.00 0.00 28.75 28.37 3h7f h GLU 378 CO -0.23 1.25 -0.47 0.74 -1.40 0.00 0.00 179.01 178.90 3h7f h PHE 379 N 0.50 0.04 -0.41 4.33 0.04 -1.09 -1.38 116.94 118.96 3h7f h PHE 379 Ca -0.07 -0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.69 3h7f h PHE 379 Cb 1.46 -0.01 -0.02 0.00 2.20 0.00 0.00 35.95 39.58 3h7f h PHE 379 CO 0.09 0.50 0.26 1.15 -0.60 0.00 0.00 178.31 179.71 3h7f h THR 380 N 0.03 1.12 0.27 -1.55 2.02 -0.99 -0.66 112.91 113.15 3h7f h THR 380 Ca -0.00 -0.25 -0.01 0.00 0.77 0.00 0.00 66.41 66.91 3h7f h THR 380 Cb 0.85 0.55 0.00 0.00 -1.74 0.00 0.00 68.15 67.81 3h7f h THR 380 CO 0.06 0.12 -0.13 -0.08 0.37 0.00 0.00 175.52 175.86 3h7f h GLU 381 N 0.55 -0.35 -0.70 6.66 4.57 -1.18 -2.50 114.58 121.63 3h7f h GLU 381 Ca 0.15 0.02 0.12 0.00 -1.18 0.00 0.00 59.36 58.47 3h7f h GLU 381 Cb -0.03 0.08 -0.08 0.00 -0.16 0.00 0.00 28.75 28.56 3h7f h GLU 381 CO -0.03 -0.12 0.28 -0.39 -1.18 0.00 0.00 179.01 177.57 3h7f h VAL 382 N -0.53 0.72 -0.88 0.32 -1.51 -1.26 -1.81 116.25 111.30 3h7f h VAL 382 Ca -0.04 -0.16 0.00 0.00 -1.23 0.00 0.00 66.70 65.28 3h7f h VAL 382 Cb 0.39 0.22 -0.04 0.00 -2.13 0.00 0.00 31.29 29.73 3h7f h VAL 382 CO 0.06 0.08 0.56 0.00 -1.23 0.00 0.00 177.57 177.04 3h7f h ALA 383 N 1.49 1.33 -0.29 5.19 0.00 -1.08 -2.32 119.26 123.58 3h7f h ALA 383 Ca 0.37 -0.08 -0.15 0.00 0.00 0.00 0.00 54.91 55.06 3h7f h ALA 383 Cb 0.51 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 3h7f h ALA 383 CO -0.36 0.60 -0.42 0.22 0.00 0.00 0.00 179.25 179.30 3h7f h ASP 384 N 1.20 0.76 0.00 0.00 3.58 -0.89 -1.33 116.42 119.74 3h7f h ASP 384 Ca 0.32 -0.35 0.01 0.00 0.42 0.00 0.00 57.03 57.43 3h7f h ASP 384 Cb -0.10 -0.21 -0.02 0.00 1.72 0.00 0.00 39.33 40.72 3h7f h ASP 384 CO -0.06 1.07 -0.08 0.40 -2.88 0.00 0.00 179.24 177.69 3h7f h ILE 385 N 0.58 0.80 -0.21 2.25 2.04 -1.09 -2.16 117.51 119.72 3h7f h ILE 385 Ca 0.04 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.91 3h7f h ILE 385 Cb 0.96 0.80 -0.01 0.00 -0.74 0.00 0.00 36.82 37.82 3h7f h ILE 385 CO 0.09 0.00 0.14 0.40 0.00 0.00 0.00 178.15 178.77 3h7f h ILE 386 N -0.14 1.05 -0.93 -0.67 2.04 -1.31 -2.36 117.51 115.20 3h7f h ILE 386 Ca 0.03 -0.09 -0.00 0.00 1.00 0.00 0.00 64.86 65.79 3h7f h ILE 386 Cb 0.18 0.75 -0.04 0.00 -0.74 0.00 0.00 36.82 36.96 3h7f h ILE 386 CO -0.08 0.05 0.57 0.00 0.00 0.00 0.00 178.15 178.69 3h7f h ALA 387 N 1.08 1.18 -0.36 1.87 0.00 -1.23 -1.44 119.26 120.37 3h7f h ALA 387 Ca 0.08 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 3h7f h ALA 387 Cb -0.03 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.37 3h7f h ALA 387 CO -0.02 0.63 -0.02 1.15 0.00 0.00 0.00 179.25 180.99 3h7f h THR 388 N 1.27 1.26 -0.49 0.00 2.02 -1.28 -1.27 112.91 114.43 3h7f h THR 388 Ca 0.33 -1.02 0.01 0.00 0.77 0.00 0.00 66.41 66.50 3h7f h THR 388 Cb -0.07 1.21 -0.03 0.00 -1.74 0.00 0.00 68.15 67.52 3h7f h THR 388 CO -0.06 0.34 0.31 0.00 0.37 0.00 0.00 175.52 176.48 3h7f h ALA 389 N 0.85 0.63 0.00 6.16 0.00 -1.13 -2.61 119.26 123.16 3h7f h ALA 389 Ca 0.10 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 3h7f h ALA 389 Cb 0.49 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 3h7f h ALA 389 CO 0.02 0.03 -0.44 -0.07 0.00 0.00 0.00 179.25 178.79 3h7f h LEU 390 N 0.63 0.00 0.09 0.00 3.38 -1.13 -3.36 115.31 114.92 3h7f h LEU 390 Ca 0.19 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.79 3h7f h LEU 390 Cb -0.03 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 3h7f h LEU 390 CO -0.06 0.44 -2.06 0.00 0.09 0.00 0.00 178.44 176.85 3h7f n ALA 391 N -2.26 1.03 1.37 1.53 0.00 -0.49 -4.64 120.51 117.04 3h7f n ALA 391 Ca 0.01 -0.70 0.12 0.00 0.00 0.00 0.00 53.44 52.87 3h7f n ALA 391 Cb 0.62 -0.59 0.45 0.00 0.00 0.00 0.00 19.45 19.93 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 -3.40 0.12 -4.57 0.00 -2.24 -0.99 -4.82 114.28 98.38 3h7f n THR 392 Ca -0.33 -0.29 0.00 0.00 -2.27 0.00 0.00 64.05 61.15 3h7f n THR 392 Cb 1.04 0.38 0.00 0.00 -2.10 0.00 0.00 70.33 69.65 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 1.13 2.41 0.44 3.38 0.00 -1.26 -2.81 105.19 108.48 3h7f n GLY 393 Ca 0.17 -0.41 0.26 0.00 0.00 0.00 0.00 46.02 46.03 3h7f n GLY 393 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3h7f h SER 394 N 8.92 0.03 -0.02 1.61 0.02 -1.97 -2.72 113.55 119.42 3h7f h SER 394 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3h7f h SER 394 Cb 0.00 -0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 3h7f h SER 394 CO 0.00 0.01 0.00 -1.54 -1.14 0.00 0.00 176.83 174.16 3h7f n SER 395 N -4.32 0.75 -4.68 3.07 3.41 -1.12 -4.90 113.62 105.83 3h7f n SER 395 Ca 0.16 -2.02 -0.42 0.00 -0.26 0.00 0.00 58.87 56.33 3h7f n SER 395 Cb 0.85 -0.32 -0.03 0.00 -0.26 0.00 0.00 64.21 64.45 3h7f n SER 395 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3h7f s VAL 396 N -1.40 4.45 -1.03 -3.33 0.11 -1.03 -4.97 120.40 113.19 3h7f s VAL 396 Ca 0.02 1.75 -0.17 0.00 -2.93 0.00 0.00 61.98 60.64 3h7f s VAL 396 Cb 0.01 -4.12 0.14 0.00 -1.53 0.00 0.00 36.38 30.88 3h7f s VAL 396 CO 0.01 -0.02 1.24 -0.62 -3.33 0.00 0.00 175.10 172.38 3h7f s ASP 397 N 1.38 6.77 0.26 3.54 -1.08 -1.26 -4.89 116.67 121.39 3h7f s ASP 397 Ca 0.53 -2.34 -0.03 0.00 -0.52 0.00 0.00 52.55 50.19 3h7f s ASP 397 Cb -0.22 -2.41 0.43 0.00 -1.46 0.00 0.00 42.92 39.27 3h7f s ASP 397 CO 0.19 -0.98 1.83 0.58 0.52 0.00 0.00 175.17 177.31 3h7f h VAL 398 N 5.48 0.94 -0.55 1.11 2.07 -1.98 -2.69 116.25 120.63 3h7f h VAL 398 Ca 0.21 -0.31 -0.06 0.00 0.82 0.00 0.00 66.70 67.37 3h7f h VAL 398 Cb 0.97 -0.04 -0.02 0.00 -1.52 0.00 0.00 31.29 30.69 3h7f h VAL 398 CO 1.17 0.16 0.11 -1.28 0.02 0.00 0.00 177.57 177.75 3h7f h SER 399 N 0.90 0.87 -0.52 0.57 0.87 -1.93 -0.66 113.55 113.65 3h7f h SER 399 Ca 0.43 -0.25 -0.11 0.00 -1.23 0.00 0.00 61.79 60.63 3h7f h SER 399 Cb 0.36 -0.23 -0.02 0.00 -0.44 0.00 0.00 62.40 62.08 3h7f h SER 399 CO -0.24 0.89 -0.10 0.00 -0.53 0.00 0.00 176.83 176.86 3h7f h ALA 400 N 1.00 0.71 -0.49 6.23 0.00 -1.94 -2.69 119.26 122.08 3h7f h ALA 400 Ca 0.17 -0.34 -0.13 0.00 0.00 0.00 0.00 54.91 54.61 3h7f h ALA 400 Cb 0.38 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 3h7f h ALA 400 CO 0.01 0.61 -0.20 -0.07 0.00 0.00 0.00 179.25 179.60 3h7f h LEU 401 N 0.85 1.03 -0.73 0.00 3.38 -1.28 -3.01 115.31 115.55 3h7f h LEU 401 Ca 0.14 -0.39 -0.00 0.00 0.09 0.00 0.00 57.88 57.72 3h7f h LEU 401 Cb 0.66 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 41.09 3h7f h LEU 401 CO 0.05 1.19 0.45 0.50 0.09 0.00 0.00 178.44 180.71 3h7f h LYS 402 N 0.87 0.99 -0.53 1.13 3.64 -1.07 -2.53 116.57 119.07 3h7f h LYS 402 Ca 0.11 -0.08 -0.05 0.00 -1.27 0.00 0.00 60.65 59.36 3h7f h LYS 402 Cb 0.78 -0.21 -0.02 0.00 -0.41 0.00 0.00 32.23 32.37 3h7f h LYS 402 CO 0.07 0.69 0.12 -0.44 -2.27 0.00 0.00 179.45 177.62 3h7f h ASP 403 N 1.00 0.77 -0.33 4.20 3.32 -1.44 -1.50 116.42 122.43 3h7f h ASP 403 Ca 0.26 -0.14 -0.07 0.00 0.02 0.00 0.00 57.03 57.11 3h7f h ASP 403 Cb -0.05 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.28 3h7f h ASP 403 CO -0.05 0.76 -0.02 0.03 -1.72 0.00 0.00 179.24 178.24 3h7f h ARG 404 N 0.79 0.70 -0.30 3.56 3.08 -1.38 -2.13 114.38 118.70 3h7f h ARG 404 Ca 0.17 -0.18 -0.12 0.00 0.07 0.00 0.00 59.98 59.92 3h7f h ARG 404 Cb 0.30 -0.08 -0.00 0.00 0.08 0.00 0.00 29.97 30.26 3h7f h ARG 404 CO -0.00 0.72 -0.29 0.00 -1.07 0.00 0.00 179.97 179.33 3h7f h ALA 405 N 1.33 0.44 -0.15 0.04 0.00 -0.96 -2.99 119.26 116.97 3h7f h ALA 405 Ca 0.13 -0.40 -0.10 0.00 0.00 0.00 0.00 54.91 54.53 3h7f h ALA 405 Cb 0.43 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 3h7f h ALA 405 CO 0.02 0.46 -0.36 1.79 0.00 0.00 0.00 179.25 181.16 3h7f h THR 406 N 0.48 1.29 -0.28 0.00 1.35 -1.26 -2.25 112.91 112.24 3h7f h THR 406 Ca 0.05 -1.42 0.01 0.00 -0.55 0.00 0.00 66.41 64.50 3h7f h THR 406 Cb 0.86 1.58 -0.02 0.00 -1.73 0.00 0.00 68.15 68.84 3h7f h THR 406 CO 0.07 0.43 0.16 0.03 -0.25 0.00 0.00 175.52 175.96 3h7f h ARG 407 N 0.26 0.32 -0.09 4.72 3.08 -1.38 -1.42 114.38 119.86 3h7f h ARG 407 Ca 0.03 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.06 3h7f h ARG 407 Cb 0.76 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 30.73 3h7f h ARG 407 CO 0.06 0.21 0.06 -0.07 -1.07 0.00 0.00 179.97 179.16 3h7f h LEU 408 N 0.33 0.10 -0.52 3.04 3.38 -1.37 -2.93 115.31 117.34 3h7f h LEU 408 Ca 0.11 -0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.10 3h7f h LEU 408 Cb -0.00 -0.03 -0.04 0.00 0.09 0.00 0.00 40.66 40.69 3h7f h LEU 408 CO -0.05 0.07 0.30 0.00 0.09 0.00 0.00 178.44 178.85 3h7f h ALA 409 N 1.03 0.66 0.00 1.53 0.00 -1.26 -2.65 119.26 118.58 3h7f h ALA 409 Ca 0.03 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 3h7f h ALA 409 Cb -0.01 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 3h7f h ALA 409 CO -0.01 -0.01 -0.04 0.00 0.00 0.00 0.00 179.25 179.20 3h7f h ARG 410 N 0.59 0.00 0.00 0.00 3.08 -1.22 -2.70 114.38 114.14 3h7f h ARG 410 Ca 0.21 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.25 3h7f h ARG 410 Cb 0.05 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.10 3h7f h ARG 410 CO -0.11 0.04 -0.16 0.00 -1.07 0.00 0.00 179.97 178.67 3h7f h ALA 411 N 1.96 0.92 -3.12 0.04 0.00 -1.28 -3.39 119.26 114.39 3h7f h ALA 411 Ca -0.00 -0.05 -0.62 0.00 0.00 0.00 0.00 54.91 54.24 3h7f h ALA 411 Cb 0.07 -0.00 -0.41 0.00 0.00 0.00 0.00 17.79 17.44 3h7f h ALA 411 CO 0.00 0.07 -0.61 -0.06 0.00 0.00 0.00 179.25 178.65 3h7f s PHE 412 N -3.20 3.31 0.43 0.00 0.08 -1.02 -5.10 117.98 112.48 3h7f s PHE 412 Ca 0.06 -3.23 -0.26 0.00 0.12 0.00 0.00 56.93 53.62 3h7f s PHE 412 Cb 0.06 -2.63 -0.09 0.00 -0.57 0.00 0.00 43.02 39.79 3h7f s PHE 412 CO 0.69 -0.61 1.41 -2.14 -0.10 0.00 0.00 175.22 174.46 3h7f s PRO 413 N -1.05 3.81 -0.15 0.24 0.02 -1.26 -4.92 135.00 131.69 3h7f s PRO 413 Ca 0.23 2.38 -0.04 0.00 0.02 0.00 0.00 61.00 63.59 3h7f s PRO 413 Cb -0.10 -2.72 -0.03 0.00 0.02 0.00 0.00 34.50 31.67 3h7f s PRO 413 CO -0.12 -0.70 -0.02 -1.17 -0.33 0.00 0.00 177.00 174.66 3h7f s LEU 414 N -2.56 3.36 -1.45 -5.54 2.96 -1.26 -4.63 118.68 109.55 3h7f s LEU 414 Ca 0.59 -0.07 -0.11 0.00 -0.22 0.00 0.00 54.13 54.32 3h7f s LEU 414 Cb -0.43 -1.81 0.05 0.00 0.50 0.00 0.00 46.19 44.51 3h7f s LEU 414 CO 0.55 0.20 1.00 -1.22 -1.32 0.00 0.00 176.35 175.57 3h7f n TYR 415 N 3.36 -2.40 -1.88 5.38 4.01 -1.26 -4.88 117.16 119.48 3h7f n TYR 415 Ca -0.17 0.93 -0.42 0.00 -0.16 0.00 0.00 57.90 58.07 3h7f n TYR 415 Cb 0.53 -4.33 -0.03 0.00 -0.31 0.00 0.00 39.34 35.20 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 -3.47 6.40 0.00 7.72 2.15 -1.26 -2.28 116.67 125.92 3h7f s ASP 416 Ca 0.55 2.20 0.00 0.00 0.43 0.00 0.00 52.55 55.73 3h7f s ASP 416 Cb -0.27 -2.53 0.00 0.00 -0.30 0.00 0.00 42.92 39.83 3h7f s ASP 416 CO 0.80 -1.15 0.00 0.61 -0.17 0.00 0.00 175.17 175.26 3h7f n GLY 417 N 4.56 0.40 0.37 2.66 0.00 -1.26 -4.98 105.19 106.92 3h7f n GLY 417 Ca 0.20 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.41 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 0.61 -1.76 0.99 6.46 -1.84 -0.98 115.31 118.78 3h7f h LEU 418 Ca 0.00 0.11 0.00 0.00 -0.12 0.00 0.00 57.88 57.87 3h7f h LEU 418 Cb 0.00 0.01 0.00 0.00 -0.73 0.00 0.00 40.66 39.94 3h7f h LEU 418 CO 0.00 0.13 0.04 -0.33 -0.62 0.00 0.00 178.44 177.66 3h7f h GLU 419 N 0.54 0.00 0.00 1.25 3.07 -1.94 -2.32 114.58 115.18 3h7f h GLU 419 Ca 0.61 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.47 3h7f h GLU 419 Cb 1.28 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.19 3h7f h GLU 419 CO -0.39 0.00 -0.64 0.39 -1.40 0.00 0.00 179.01 176.97 3h7f n GLU 420 N -2.45 2.95 -2.25 2.33 1.02 -0.38 -5.06 120.64 116.81 3h7f n GLU 420 Ca -0.02 -0.01 -0.39 0.00 -0.02 0.00 0.00 57.16 56.72 3h7f n GLU 420 Cb 0.08 -1.06 -0.02 0.00 -0.02 0.00 0.00 31.44 30.42 3h7f n GLU 420 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 3h7f s TRP 421 N -2.15 3.08 0.48 -0.32 0.51 -0.87 -5.04 118.94 114.63 3h7f s TRP 421 Ca 0.03 1.53 -0.10 0.00 -2.12 0.00 0.00 56.10 55.44 3h7f s TRP 421 Cb 0.08 -3.47 -0.05 0.00 -0.81 0.00 0.00 33.47 29.22 3h7f s TRP 421 CO 0.47 -1.44 0.86 0.45 -0.51 0.00 0.00 176.95 176.78 3h7f s SER 422 N -0.93 6.41 0.12 2.95 0.15 -1.26 -5.02 113.70 116.11 3h7f s SER 422 Ca 0.54 1.20 -0.20 0.00 0.70 0.00 0.00 55.95 58.19 3h7f s SER 422 Cb -0.34 -2.36 -0.07 0.00 -1.71 0.00 0.00 66.02 61.54 3h7f s SER 422 CO 0.43 -0.57 1.77 -0.07 1.20 0.00 0.00 173.24 176.00 3h7f h LEU 423 N 0.62 0.16 -8.43 3.45 3.38 -1.98 -3.45 115.31 109.06 3h7f h LEU 423 Ca -0.46 0.00 -0.42 0.00 0.09 0.00 0.00 57.88 57.08 3h7f h LEU 423 Cb 1.19 -0.03 -0.22 0.00 0.09 0.00 0.00 40.66 41.69 3h7f h LEU 423 CO 0.62 0.12 -0.78 0.68 0.09 0.00 0.00 178.44 179.17 3h7f s VAL 424 N -6.18 1.16 0.00 1.22 -7.23 -1.26 -4.80 120.40 103.30 3h7f s VAL 424 Ca -0.13 -1.32 0.00 0.00 -1.81 0.00 0.00 61.98 58.72 3h7f s VAL 424 Cb 0.08 -1.11 0.00 0.00 0.56 0.00 0.00 36.38 35.92 3h7f s VAL 424 CO 0.69 -0.21 0.00 0.61 -0.31 0.00 0.00 175.10 175.88