#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h8r s SER 56 N 0.00 4.07 -0.05 0.26 1.04 -1.26 -5.11 113.70 112.65 3h8r s SER 56 Ca 0.00 -0.55 0.04 0.00 0.48 0.00 0.00 55.95 55.92 3h8r s SER 56 Cb 0.00 -1.67 -0.02 0.00 0.10 0.00 0.00 66.02 64.43 3h8r s SER 56 CO 0.00 -0.04 -0.16 0.26 0.98 0.00 0.00 173.24 174.28 3h8r s TRP 57 N 1.41 2.65 -0.32 5.02 0.52 -1.26 -4.70 118.94 122.26 3h8r s TRP 57 Ca 0.04 -0.24 -0.22 0.00 0.02 0.00 0.00 56.10 55.71 3h8r s TRP 57 Cb -0.15 -1.62 -0.00 0.00 -1.15 0.00 0.00 33.47 30.55 3h8r s TRP 57 CO -0.06 0.12 0.70 0.50 0.02 0.00 0.00 176.95 178.24 3h8r s ARG 58 N -0.64 3.88 -0.10 4.98 3.52 0.03 -4.90 118.95 125.71 3h8r s ARG 58 Ca 0.10 0.38 -0.20 0.00 -0.13 0.00 0.00 55.73 55.87 3h8r s ARG 58 Cb -0.11 -3.75 -0.04 0.00 -1.56 0.00 0.00 34.95 29.50 3h8r s ARG 58 CO 0.01 -0.66 0.56 -1.01 -0.81 0.00 0.00 175.30 173.39 3h8r s HIS 59 N 2.80 3.53 -0.42 5.12 3.76 -1.26 -0.65 115.29 128.17 3h8r s HIS 59 Ca 0.28 1.01 -0.10 0.00 -0.15 0.00 0.00 55.06 56.10 3h8r s HIS 59 Cb -0.14 -2.65 0.07 0.00 1.11 0.00 0.00 32.58 30.97 3h8r s HIS 59 CO 0.13 0.13 0.26 0.42 -0.85 0.00 0.00 174.74 174.83 3h8r s ILE 60 N 0.73 4.38 0.05 0.60 -1.09 0.98 -5.00 121.20 121.85 3h8r s ILE 60 Ca 0.30 -1.28 0.06 0.00 -2.23 0.00 0.00 60.65 57.50 3h8r s ILE 60 Cb -0.16 -3.64 -0.02 0.00 -1.58 0.00 0.00 42.46 37.06 3h8r s ILE 60 CO 0.13 -0.47 -0.17 -0.13 -1.23 0.00 0.00 174.94 173.07 3h8r s ARG 61 N 1.47 1.11 0.11 2.79 0.52 -1.26 -1.67 118.95 122.02 3h8r s ARG 61 Ca 0.03 -0.86 -0.12 0.00 -0.52 0.00 0.00 55.73 54.25 3h8r s ARG 61 Cb -0.23 -1.18 0.04 0.00 0.52 0.00 0.00 34.95 34.11 3h8r s ARG 61 CO 0.03 0.29 0.59 0.00 0.02 0.00 0.00 175.30 176.24 3h8r n ALA 62 N 1.80 -1.55 -1.72 2.13 0.00 -1.02 -4.99 120.51 115.16 3h8r n ALA 62 Ca -0.18 -0.59 -0.43 0.00 0.00 0.00 0.00 53.44 52.25 3h8r n ALA 62 Cb 0.54 0.33 -0.03 0.00 0.00 0.00 0.00 19.45 20.29 3h8r n ALA 62 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 3h8r s GLU 63 N -2.03 3.63 0.00 0.00 2.12 -1.26 -1.76 118.70 119.40 3h8r s GLU 63 Ca 0.13 2.19 0.00 0.00 0.36 0.00 0.00 54.97 57.66 3h8r s GLU 63 Cb -0.02 -4.24 0.00 0.00 0.26 0.00 0.00 34.13 30.14 3h8r s GLU 63 CO 0.03 -1.53 0.00 0.41 -0.54 0.00 0.00 175.26 173.64 3h8r n GLY 64 N 5.11 0.58 3.36 -1.50 0.00 -1.26 -4.99 105.19 106.48 3h8r n GLY 64 Ca 0.24 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.91 3h8r n GLY 64 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3h8r s LEU 65 N 0.00 2.99 -0.34 0.99 0.20 -0.73 -3.38 118.68 118.41 3h8r s LEU 65 Ca 0.00 -0.33 -0.00 0.00 0.69 0.00 0.00 54.13 54.49 3h8r s LEU 65 Cb 0.00 -1.75 0.13 0.00 -0.43 0.00 0.00 46.19 44.14 3h8r s LEU 65 CO 0.00 0.02 0.23 -0.62 -0.29 0.00 0.00 176.35 175.69 3h8r s ASP 66 N 1.24 2.71 0.17 3.68 -1.08 -1.26 -2.44 116.67 119.69 3h8r s ASP 66 Ca 0.03 -1.84 0.02 0.00 -0.52 0.00 0.00 52.55 50.24 3h8r s ASP 66 Cb -0.14 -0.18 -0.05 0.00 -1.46 0.00 0.00 42.92 41.09 3h8r s ASP 66 CO -0.01 -0.33 -0.02 -0.44 0.52 0.00 0.00 175.17 174.89 3h8r s SER 67 N 1.39 1.37 0.01 -0.34 0.01 -0.67 -1.15 113.70 114.31 3h8r s SER 67 Ca 0.16 -1.14 -0.02 0.00 1.31 0.00 0.00 55.95 56.26 3h8r s SER 67 Cb -0.20 0.08 -0.01 0.00 0.21 0.00 0.00 66.02 66.11 3h8r s SER 67 CO -0.09 -0.52 0.03 -0.94 0.41 0.00 0.00 173.24 172.13 3h8r s SER 68 N -3.18 0.11 -0.03 2.44 1.04 -0.29 -0.02 113.70 113.78 3h8r s SER 68 Ca 0.22 -0.27 0.04 0.00 0.48 0.00 0.00 55.95 56.43 3h8r s SER 68 Cb 0.05 0.12 -0.01 0.00 0.10 0.00 0.00 66.02 66.29 3h8r s SER 68 CO 0.03 -0.23 -0.16 -0.47 0.98 0.00 0.00 173.24 173.39 3h8r s TYR 69 N -1.01 1.54 0.13 5.02 5.04 0.18 -0.37 117.35 127.87 3h8r s TYR 69 Ca -0.11 -0.38 -0.15 0.00 -2.44 0.00 0.00 57.07 53.99 3h8r s TYR 69 Cb -0.07 -1.03 0.03 0.00 0.35 0.00 0.00 41.96 41.24 3h8r s TYR 69 CO -0.00 -0.11 0.38 -0.08 -1.34 0.00 0.00 175.55 174.40 3h8r s THR 70 N -0.10 0.07 -0.28 4.34 -1.32 -0.26 -0.79 115.64 117.31 3h8r s THR 70 Ca -0.00 -0.72 -0.09 0.00 -1.21 0.00 0.00 61.69 59.67 3h8r s THR 70 Cb -0.09 -1.27 -0.03 0.00 -1.51 0.00 0.00 72.50 69.60 3h8r s THR 70 CO 0.01 -0.34 0.13 -0.69 -2.21 0.00 0.00 174.62 171.51 3h8r s VAL 71 N -3.83 4.65 -0.03 5.08 1.01 -1.26 -0.09 120.40 125.93 3h8r s VAL 71 Ca 0.05 -0.16 -0.10 0.00 0.00 0.00 0.00 61.98 61.77 3h8r s VAL 71 Cb 0.02 -3.25 -0.31 0.00 0.00 0.00 0.00 36.38 32.85 3h8r s VAL 71 CO -0.10 0.23 0.75 -0.07 0.00 0.00 0.00 175.10 175.91 3h8r h LEU 72 N 8.31 0.59 -8.37 3.92 3.38 -1.23 -3.48 115.31 118.42 3h8r h LEU 72 Ca -0.36 -0.84 -0.53 0.00 0.09 0.00 0.00 57.88 56.25 3h8r h LEU 72 Cb 1.17 -0.19 -0.27 0.00 0.09 0.00 0.00 40.66 41.45 3h8r h LEU 72 CO 0.58 1.70 -0.83 -0.36 0.09 0.00 0.00 178.44 179.63 3h8r s PHE 73 N -2.59 1.53 1.11 1.13 0.08 -1.04 -5.08 117.98 113.12 3h8r s PHE 73 Ca -0.14 -0.32 -0.17 0.00 0.12 0.00 0.00 56.93 56.42 3h8r s PHE 73 Cb 0.06 -0.95 0.25 0.00 -0.57 0.00 0.00 43.02 41.81 3h8r s PHE 73 CO 0.86 0.02 1.16 0.20 -0.10 0.00 0.00 175.22 177.36 3h8r s GLY 74 N -0.77 1.63 0.15 4.36 0.00 -1.26 -4.70 107.32 106.72 3h8r s GLY 74 Ca 0.06 -0.94 -0.14 0.00 0.00 0.00 0.00 44.72 43.70 3h8r s GLY 74 CO 0.00 -0.12 1.70 1.70 0.00 0.00 0.00 173.10 176.38 3h8r h LYS 75 N -2.24 0.72 -0.24 2.90 3.64 -1.98 -0.43 116.57 118.94 3h8r h LYS 75 Ca -0.46 -0.13 -0.02 0.00 -1.27 0.00 0.00 60.65 58.77 3h8r h LYS 75 Cb 1.29 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.98 3h8r h LYS 75 CO 0.39 0.65 0.09 0.00 -2.27 0.00 0.00 179.45 178.31 3h8r h ALA 76 N 1.04 0.31 -0.35 5.00 0.00 -1.99 0.20 119.26 123.46 3h8r h ALA 76 Ca 0.16 -0.13 -0.09 0.00 0.00 0.00 0.00 54.91 54.85 3h8r h ALA 76 Cb 0.20 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 3h8r h ALA 76 CO -0.01 -0.08 -0.14 1.49 0.00 0.00 0.00 179.25 180.51 3h8r h GLU 77 N 0.22 0.70 -0.99 0.00 4.81 -1.91 -2.07 114.58 115.35 3h8r h GLU 77 Ca 0.08 -0.29 0.04 0.00 -0.13 0.00 0.00 59.36 59.06 3h8r h GLU 77 Cb 0.20 -0.03 -0.06 0.00 0.63 0.00 0.00 28.75 29.50 3h8r h GLU 77 CO -0.00 0.89 0.64 0.00 -0.73 0.00 0.00 179.01 179.81 3h8r h ALA 78 N 0.79 1.33 -0.24 2.92 0.00 -0.95 -1.67 119.26 121.43 3h8r h ALA 78 Ca 0.08 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.97 3h8r h ALA 78 Cb 0.66 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 3h8r h ALA 78 CO 0.04 0.51 0.12 -0.44 0.00 0.00 0.00 179.25 179.49 3h8r h ASP 79 N 1.23 0.19 -0.63 0.00 3.32 -0.70 0.60 116.42 120.42 3h8r h ASP 79 Ca 0.40 0.01 0.02 0.00 0.02 0.00 0.00 57.03 57.48 3h8r h ASP 79 Cb 0.04 -0.03 -0.04 0.00 0.22 0.00 0.00 39.33 39.53 3h8r h ASP 79 CO -0.14 0.14 0.40 -0.33 -1.72 0.00 0.00 179.24 177.60 3h8r h GLU 80 N 0.26 0.77 -0.51 3.56 5.08 -0.90 -0.03 114.58 122.81 3h8r h GLU 80 Ca 0.10 -0.05 -0.08 0.00 -1.00 0.00 0.00 59.36 58.34 3h8r h GLU 80 Cb 0.02 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.08 3h8r h GLU 80 CO -0.07 0.51 0.02 0.82 -1.00 0.00 0.00 179.01 179.30 3h8r h ILE 81 N 0.79 1.26 -0.13 3.13 2.04 -1.14 -0.89 117.51 122.57 3h8r h ILE 81 Ca 0.25 -1.05 -0.00 0.00 1.00 0.00 0.00 64.86 65.06 3h8r h ILE 81 Cb -0.01 0.93 -0.01 0.00 -0.74 0.00 0.00 36.82 36.99 3h8r h ILE 81 CO -0.09 0.37 0.08 0.15 0.00 0.00 0.00 178.15 178.66 3h8r h PHE 82 N 0.76 0.17 -0.74 1.37 3.57 -0.54 0.99 116.94 122.52 3h8r h PHE 82 Ca 0.15 0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.70 3h8r h PHE 82 Cb 0.49 -0.06 -0.05 0.00 2.79 0.00 0.00 35.95 39.12 3h8r h PHE 82 CO 0.04 0.14 0.45 1.96 -2.23 0.00 0.00 178.31 178.66 3h8r h GLN 83 N 0.15 0.81 -0.45 1.11 4.20 -0.80 -0.38 115.11 119.76 3h8r h GLN 83 Ca 0.05 -0.05 -0.13 0.00 0.06 0.00 0.00 58.65 58.58 3h8r h GLN 83 Cb 0.02 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 27.60 3h8r h GLN 83 CO -0.01 0.53 -0.22 1.49 -0.67 0.00 0.00 178.83 179.95 3h8r h GLU 84 N 0.83 0.92 -0.92 1.46 4.81 -0.77 -1.24 114.58 119.69 3h8r h GLU 84 Ca 0.32 -0.39 0.03 0.00 -0.13 0.00 0.00 59.36 59.19 3h8r h GLU 84 Cb 0.13 -0.03 -0.05 0.00 0.63 0.00 0.00 28.75 29.42 3h8r h GLU 84 CO -0.16 1.04 0.60 -0.07 -0.73 0.00 0.00 179.01 179.70 3h8r h LEU 85 N 0.79 1.00 -0.87 1.64 3.38 -0.43 -0.19 115.31 120.63 3h8r h LEU 85 Ca 0.10 -0.01 -0.11 0.00 0.09 0.00 0.00 57.88 57.95 3h8r h LEU 85 Cb 0.78 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 3h8r h LEU 85 CO 0.06 0.69 -0.40 -0.33 0.09 0.00 0.00 178.44 178.55 3h8r h GLU 86 N 1.17 0.33 -0.26 1.13 4.39 -0.67 -1.78 114.58 118.89 3h8r h GLU 86 Ca 0.36 -0.16 -0.19 0.00 0.34 0.00 0.00 59.36 59.71 3h8r h GLU 86 Cb -0.02 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.63 3h8r h GLU 86 CO -0.11 0.68 -0.59 -0.22 -1.16 0.00 0.00 179.01 177.61 3h8r h LYS 87 N 0.28 0.84 0.00 2.33 3.64 -0.79 -3.40 116.57 119.46 3h8r h LYS 87 Ca 0.03 -0.55 -0.26 0.00 -1.27 0.00 0.00 60.65 58.59 3h8r h LYS 87 Cb 0.83 0.07 -0.05 0.00 -0.41 0.00 0.00 32.23 32.68 3h8r h LYS 87 CO 0.07 1.18 -2.04 0.39 -2.27 0.00 0.00 179.45 176.78 3h8r n GLU 88 N -3.99 1.39 -2.45 1.90 -0.58 -0.12 -4.97 120.64 111.81 3h8r n GLU 88 Ca -0.05 -0.02 -0.41 0.00 -0.42 0.00 0.00 57.16 56.26 3h8r n GLU 88 Cb 0.65 -1.40 -0.04 0.00 -0.57 0.00 0.00 31.44 30.08 3h8r n GLU 88 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 3h8r s VAL 89 N -2.44 3.82 -0.26 2.62 1.01 -0.68 -5.00 120.40 119.47 3h8r s VAL 89 Ca -0.08 1.49 -0.07 0.00 0.00 0.00 0.00 61.98 63.33 3h8r s VAL 89 Cb 0.05 -3.95 -0.01 0.00 0.00 0.00 0.00 36.38 32.46 3h8r s VAL 89 CO 0.64 0.22 0.07 -1.61 0.00 0.00 0.00 175.10 174.42 3h8r s GLU 90 N -0.01 3.45 0.14 2.72 2.02 -1.26 -4.97 118.70 120.79 3h8r s GLU 90 Ca 0.52 -0.61 -0.10 0.00 0.02 0.00 0.00 54.97 54.80 3h8r s GLU 90 Cb -0.30 -3.33 -0.06 0.00 0.10 0.00 0.00 34.13 30.53 3h8r s GLU 90 CO 0.34 -0.28 0.47 0.71 0.02 0.00 0.00 175.26 176.52 3h8r s TYR 91 N 1.57 3.53 0.61 1.61 2.02 -1.26 -4.71 117.35 120.72 3h8r s TYR 91 Ca 0.05 0.84 -0.19 0.00 -0.37 0.00 0.00 57.07 57.40 3h8r s TYR 91 Cb -0.16 -2.21 -0.03 0.00 -0.40 0.00 0.00 41.96 39.16 3h8r s TYR 91 CO 0.03 0.43 1.23 -0.06 -1.57 0.00 0.00 175.55 175.60 3h8r s PHE 92 N -1.55 2.32 0.24 2.71 0.08 0.29 -4.98 117.98 117.10 3h8r s PHE 92 Ca 0.39 1.51 0.02 0.00 0.12 0.00 0.00 56.93 58.96 3h8r s PHE 92 Cb -0.13 -3.53 -0.05 0.00 -0.57 0.00 0.00 43.02 38.74 3h8r s PHE 92 CO 0.20 -2.37 0.07 0.95 -0.10 0.00 0.00 175.22 173.97 3h8r s THR 93 N -1.56 0.66 0.00 0.64 -4.23 -1.26 -4.61 115.64 105.28 3h8r s THR 93 Ca 0.78 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 59.30 3h8r s THR 93 Cb -0.32 -2.53 0.00 0.00 1.34 0.00 0.00 72.50 70.99 3h8r s THR 93 CO 0.34 -0.11 0.00 0.61 -0.54 0.00 0.00 174.62 174.92 3h8r n GLY 94 N -0.44 3.34 0.29 3.99 0.00 -1.26 -1.78 105.19 109.33 3h8r n GLY 94 Ca -0.02 -0.13 0.17 0.00 0.00 0.00 0.00 46.02 46.04 3h8r n GLY 94 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h8r h ALA 95 N -0.84 1.13 -0.31 4.61 0.00 -1.98 -1.21 119.26 120.65 3h8r h ALA 95 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3h8r h ALA 95 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 3h8r h ALA 95 CO 0.00 0.07 0.00 1.28 0.00 0.00 0.00 179.25 180.60 3h8r n LEU 96 N -3.34 2.13 -0.16 0.00 4.77 -0.74 -3.65 117.00 116.02 3h8r n LEU 96 Ca -0.01 -1.07 0.04 0.00 -0.03 0.00 0.00 56.01 54.93 3h8r n LEU 96 Cb 0.21 -0.32 0.05 0.00 -2.33 0.00 0.00 43.42 41.04 3h8r n LEU 96 CO 0.27 0.43 0.43 0.00 -1.33 0.00 0.00 177.39 177.18 3h8r n ALA 97 N 0.41 1.96 -2.52 -1.18 0.00 -0.46 -4.60 120.51 114.12 3h8r n ALA 97 Ca 0.11 -1.56 -0.32 0.00 0.00 0.00 0.00 53.44 51.67 3h8r n ALA 97 Cb 0.39 -0.28 -0.14 0.00 0.00 0.00 0.00 19.45 19.42 3h8r n ALA 97 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3h8r s ARG 98 N -1.32 2.51 0.24 0.00 0.52 -1.23 -0.85 118.95 118.82 3h8r s ARG 98 Ca 0.12 -0.76 0.06 0.00 -0.52 0.00 0.00 55.73 54.64 3h8r s ARG 98 Cb 0.11 -2.32 -0.05 0.00 0.52 0.00 0.00 34.95 33.21 3h8r s ARG 98 CO 0.01 0.56 -0.08 0.14 0.02 0.00 0.00 175.30 175.95 3h8r s VAL 99 N -0.57 1.56 -0.17 3.52 -7.23 -0.33 -4.64 120.40 112.54 3h8r s VAL 99 Ca 0.08 -2.13 0.01 0.00 -1.81 0.00 0.00 61.98 58.13 3h8r s VAL 99 Cb -0.11 -2.28 0.01 0.00 0.56 0.00 0.00 36.38 34.56 3h8r s VAL 99 CO 0.01 -0.41 -0.19 -1.58 -0.31 0.00 0.00 175.10 172.62 3h8r s GLN 100 N -3.72 3.05 -0.02 4.82 0.74 0.29 -0.74 119.66 124.08 3h8r s GLN 100 Ca 0.27 -0.82 -0.00 0.00 0.05 0.00 0.00 55.36 54.86 3h8r s GLN 100 Cb 0.03 -2.56 0.02 0.00 1.10 0.00 0.00 33.01 31.60 3h8r s GLN 100 CO 0.09 -0.11 0.03 0.08 -0.55 0.00 0.00 175.29 174.83 3h8r s VAL 101 N 1.08 -0.04 -1.34 1.34 1.01 -0.25 -4.46 120.40 117.74 3h8r s VAL 101 Ca -0.00 0.15 -0.08 0.00 0.00 0.00 0.00 61.98 62.05 3h8r s VAL 101 Cb -0.14 -0.08 0.06 0.00 0.00 0.00 0.00 36.38 36.22 3h8r s VAL 101 CO -0.07 0.06 0.51 0.49 0.00 0.00 0.00 175.10 176.09 3h8r n PHE 102 N 3.85 -1.82 -0.86 5.22 3.72 -1.26 -1.87 117.46 124.44 3h8r n PHE 102 Ca -0.23 0.47 0.00 0.00 -0.05 0.00 0.00 57.45 57.64 3h8r n PHE 102 Cb 0.53 -3.30 0.00 0.00 -0.94 0.00 0.00 39.48 35.77 3h8r n PHE 102 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3h8r n GLY 103 N -1.25 0.75 3.15 1.37 0.00 -1.26 -5.03 105.19 102.93 3h8r n GLY 103 Ca -0.04 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.77 3h8r n GLY 103 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3h8r s LYS 104 N -0.14 1.03 0.06 1.61 2.20 -0.78 -5.14 119.74 118.58 3h8r s LYS 104 Ca 0.00 -0.75 -0.12 0.00 -0.36 0.00 0.00 55.97 54.74 3h8r s LYS 104 Cb 0.00 -1.05 -0.06 0.00 -1.51 0.00 0.00 37.83 35.21 3h8r s LYS 104 CO 0.00 0.26 0.43 -1.58 -0.36 0.00 0.00 175.35 174.10 3h8r s TRP 105 N -0.78 3.64 -0.02 4.03 0.52 -1.26 -1.09 118.94 123.98 3h8r s TRP 105 Ca 0.03 0.90 -0.04 0.00 0.02 0.00 0.00 56.10 57.01 3h8r s TRP 105 Cb -0.08 -2.24 0.00 0.00 -1.15 0.00 0.00 33.47 30.01 3h8r s TRP 105 CO 0.01 0.55 0.10 -1.01 0.02 0.00 0.00 176.95 176.61 3h8r s HIS 106 N -1.30 -0.02 0.21 -1.98 3.76 0.08 -4.97 115.29 111.06 3h8r s HIS 106 Ca 0.31 0.06 -0.30 0.00 -0.15 0.00 0.00 55.06 54.98 3h8r s HIS 106 Cb -0.15 -0.02 -0.08 0.00 1.11 0.00 0.00 32.58 33.44 3h8r s HIS 106 CO 0.17 -0.14 1.11 -1.12 -0.85 0.00 0.00 174.74 173.91 3h8r s SER 107 N -0.54 7.24 0.36 1.40 0.01 -1.26 -1.19 113.70 119.73 3h8r s SER 107 Ca -0.06 2.17 -0.28 0.00 1.31 0.00 0.00 55.95 59.09 3h8r s SER 107 Cb -0.04 -2.61 -0.10 0.00 0.21 0.00 0.00 66.02 63.48 3h8r s SER 107 CO 0.00 -0.21 1.33 0.68 0.41 0.00 0.00 173.24 175.45 3h8r s VAL 108 N -0.53 2.58 -1.30 3.43 -7.23 -0.03 -4.89 120.40 112.44 3h8r s VAL 108 Ca 0.48 0.57 -0.08 0.00 -1.81 0.00 0.00 61.98 61.14 3h8r s VAL 108 Cb -0.31 -3.35 -0.03 0.00 0.56 0.00 0.00 36.38 33.25 3h8r s VAL 108 CO 0.37 0.12 2.84 -0.81 -0.31 0.00 0.00 175.10 177.31 3h8r n PRO 109 N 0.51 3.74 -3.22 4.82 -0.04 -1.26 -4.75 135.00 134.79 3h8r n PRO 109 Ca 0.01 -2.48 0.00 0.00 -0.04 0.00 0.00 63.50 60.99 3h8r n PRO 109 Cb 0.42 -2.63 0.00 0.00 -0.04 0.00 0.00 33.50 31.25 3h8r n PRO 109 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 3h8r n ARG 110 N 2.73 -2.16 -4.49 0.54 1.85 -1.26 -1.11 116.66 112.76 3h8r n ARG 110 Ca 0.68 0.00 -0.29 0.00 -1.00 0.00 0.00 57.85 57.24 3h8r n ARG 110 Cb 0.32 0.00 -0.13 0.00 -1.05 0.00 0.00 32.46 31.60 3h8r n ARG 110 CO 0.00 0.00 0.00 0.15 -0.01 0.00 0.00 177.63 177.77 3h8r s LYS 111 N -1.17 1.63 0.07 2.89 1.02 -0.26 -4.97 119.74 118.94 3h8r s LYS 111 Ca 0.00 -1.23 0.05 0.00 0.02 0.00 0.00 55.97 54.81 3h8r s LYS 111 Cb 0.00 -1.99 -0.03 0.00 -0.52 0.00 0.00 37.83 35.29 3h8r s LYS 111 CO 0.00 0.48 -0.13 -0.65 -0.92 0.00 0.00 175.35 174.13 3h8r s GLN 112 N -1.87 0.78 0.02 1.68 -0.21 -1.26 -0.34 119.66 118.46 3h8r s GLN 112 Ca 0.15 -0.91 -0.07 0.00 0.02 0.00 0.00 55.36 54.54 3h8r s GLN 112 Cb -0.10 -0.75 -0.00 0.00 1.00 0.00 0.00 33.01 33.15 3h8r s GLN 112 CO 0.06 0.17 0.14 0.00 -2.12 0.00 0.00 175.29 173.54 3h8r s ALA 113 N -1.26 -0.27 -0.04 6.09 0.00 -0.18 -0.54 121.76 125.56 3h8r s ALA 113 Ca -0.03 -0.27 0.03 0.00 0.00 0.00 0.00 51.96 51.69 3h8r s ALA 113 Cb -0.10 0.19 0.00 0.00 0.00 0.00 0.00 23.12 23.21 3h8r s ALA 113 CO 0.02 -0.27 -0.12 0.95 0.00 0.00 0.00 175.76 176.33 3h8r s THR 114 N -1.99 1.06 0.12 0.00 -4.23 -1.26 -0.43 115.64 108.91 3h8r s THR 114 Ca -0.10 -0.51 0.05 0.00 -1.18 0.00 0.00 61.69 59.96 3h8r s THR 114 Cb -0.04 -0.93 -0.04 0.00 1.34 0.00 0.00 72.50 72.83 3h8r s THR 114 CO -0.01 0.32 -0.13 -0.31 -0.54 0.00 0.00 174.62 173.95 3h8r s TYR 115 N 0.17 1.30 -4.62 3.99 2.02 -0.65 -0.67 117.35 118.90 3h8r s TYR 115 Ca -0.04 -0.60 0.00 0.00 -0.37 0.00 0.00 57.07 56.06 3h8r s TYR 115 Cb -0.10 -0.68 0.00 0.00 -0.40 0.00 0.00 41.96 40.78 3h8r s TYR 115 CO 0.01 0.10 0.00 0.41 -1.57 0.00 0.00 175.55 174.51 3h8r n GLY 116 N 0.46 -2.30 3.74 0.71 0.00 -0.58 -0.65 105.19 106.58 3h8r n GLY 116 Ca -0.15 -1.27 -0.37 0.00 0.00 0.00 0.00 46.02 44.23 3h8r n GLY 116 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3h8r s ASP 117 N -1.44 4.83 0.53 1.61 1.01 -0.87 -4.21 116.67 118.14 3h8r s ASP 117 Ca 0.00 2.66 -0.22 0.00 0.71 0.00 0.00 52.55 55.71 3h8r s ASP 117 Cb 0.00 -2.62 -0.06 0.00 1.01 0.00 0.00 42.92 41.24 3h8r s ASP 117 CO 0.00 -1.86 1.19 0.00 0.21 0.00 0.00 175.17 174.72 3h8r n ALA 118 N -1.62 0.96 0.00 5.23 0.00 -1.26 -3.47 120.51 120.36 3h8r n ALA 118 Ca 0.14 0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.70 3h8r n ALA 118 Cb 0.47 -2.24 0.00 0.00 0.00 0.00 0.00 19.45 17.68 3h8r n ALA 118 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h8r n GLY 119 N 0.97 3.15 3.84 0.00 0.00 -1.26 -5.04 105.19 106.85 3h8r n GLY 119 Ca 0.11 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.81 3h8r n GLY 119 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h8r s LEU 120 N 0.00 3.58 0.10 0.99 1.43 -1.23 -4.97 118.68 118.58 3h8r s LEU 120 Ca 0.00 1.58 -0.00 0.00 -1.03 0.00 0.00 54.13 54.68 3h8r s LEU 120 Cb 0.00 -4.51 -0.04 0.00 0.03 0.00 0.00 46.19 41.67 3h8r s LEU 120 CO 0.00 -0.67 0.00 0.42 0.23 0.00 0.00 176.35 176.34 3h8r s THR 121 N -2.65 0.26 -0.09 5.49 -4.23 -1.26 -4.16 115.64 108.99 3h8r s THR 121 Ca 0.59 -1.88 -0.03 0.00 -1.18 0.00 0.00 61.69 59.19 3h8r s THR 121 Cb -0.11 -1.81 0.04 0.00 1.34 0.00 0.00 72.50 71.97 3h8r s THR 121 CO 0.34 -0.72 0.09 -0.47 -0.54 0.00 0.00 174.62 173.31 3h8r s TYR 122 N -3.92 0.07 -0.05 3.99 5.04 -0.80 -4.99 117.35 116.68 3h8r s TYR 122 Ca 0.16 0.10 0.04 0.00 -2.44 0.00 0.00 57.07 54.93 3h8r s TYR 122 Cb 0.07 -0.53 0.00 0.00 0.35 0.00 0.00 41.96 41.86 3h8r s TYR 122 CO -0.03 -0.32 -0.17 0.99 -1.34 0.00 0.00 175.55 174.68 3h8r s THR 123 N 2.18 1.42 -0.07 4.34 2.01 -1.26 -0.76 115.64 123.50 3h8r s THR 123 Ca 0.04 -0.69 -0.30 0.00 0.31 0.00 0.00 61.69 61.05 3h8r s THR 123 Cb -0.13 -1.24 0.07 0.00 0.01 0.00 0.00 72.50 71.21 3h8r s THR 123 CO -0.06 0.41 0.67 0.72 -0.69 0.00 0.00 174.62 175.68 3h8r s PHE 124 N 0.23 -0.66 -1.63 4.92 -0.71 -0.38 -4.97 117.98 114.78 3h8r s PHE 124 Ca -0.08 1.17 -0.13 0.00 -1.04 0.00 0.00 56.93 56.85 3h8r s PHE 124 Cb -0.13 0.39 0.11 0.00 -1.21 0.00 0.00 43.02 42.18 3h8r s PHE 124 CO 0.03 -0.58 0.62 0.43 -1.34 0.00 0.00 175.22 174.38 3h8r n SER 125 N 1.08 -2.14 0.00 1.98 7.64 -1.26 -1.13 113.62 119.79 3h8r n SER 125 Ca -0.19 -1.04 0.00 0.00 1.01 0.00 0.00 58.87 58.65 3h8r n SER 125 Cb 0.57 -2.69 0.00 0.00 -1.01 0.00 0.00 64.21 61.08 3h8r n SER 125 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3h8r n GLY 126 N -1.63 0.57 3.22 0.23 0.00 -1.26 -0.54 105.19 105.77 3h8r n GLY 126 Ca -0.05 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.64 3h8r n GLY 126 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3h8r s LEU 127 N 0.00 2.16 -0.19 0.99 2.96 -0.28 -4.85 118.68 119.47 3h8r s LEU 127 Ca 0.00 -0.55 -0.03 0.00 -0.22 0.00 0.00 54.13 53.33 3h8r s LEU 127 Cb 0.00 -1.44 -0.02 0.00 0.50 0.00 0.00 46.19 45.23 3h8r s LEU 127 CO 0.00 0.14 -0.05 -0.89 -1.32 0.00 0.00 176.35 174.23 3h8r s THR 128 N 0.49 3.52 -0.10 3.68 2.01 -1.26 -1.25 115.64 122.72 3h8r s THR 128 Ca -0.15 -0.47 -0.01 0.00 0.31 0.00 0.00 61.69 61.38 3h8r s THR 128 Cb -0.17 -2.56 -0.03 0.00 0.01 0.00 0.00 72.50 69.75 3h8r s THR 128 CO 0.06 0.46 -0.06 -0.76 -0.69 0.00 0.00 174.62 173.62 3h8r s LEU 129 N 0.95 3.19 -0.06 4.42 1.02 0.06 -4.97 118.68 123.28 3h8r s LEU 129 Ca -0.00 -0.06 -0.01 0.00 0.02 0.00 0.00 54.13 54.07 3h8r s LEU 129 Cb -0.15 -1.72 -0.03 0.00 0.02 0.00 0.00 46.19 44.31 3h8r s LEU 129 CO 0.01 0.29 0.02 -0.44 0.02 0.00 0.00 176.35 176.25 3h8r s SER 130 N -0.38 5.35 0.08 2.29 0.01 -1.26 -1.91 113.70 117.88 3h8r s SER 130 Ca 0.06 0.14 -0.30 0.00 1.31 0.00 0.00 55.95 57.16 3h8r s SER 130 Cb -0.12 -1.51 -0.05 0.00 0.21 0.00 0.00 66.02 64.55 3h8r s SER 130 CO 0.02 0.35 1.03 -2.16 0.41 0.00 0.00 173.24 172.89 3h8r s PRO 131 N -1.13 4.59 0.47 12.44 0.04 -1.26 -4.74 135.00 145.41 3h8r s PRO 131 Ca 0.16 1.53 -0.21 0.00 0.04 0.00 0.00 61.00 62.52 3h8r s PRO 131 Cb -0.11 -3.38 -0.08 0.00 0.04 0.00 0.00 34.50 30.96 3h8r s PRO 131 CO 0.05 0.03 1.05 0.15 0.04 0.00 0.00 177.00 178.33 3h8r s LYS 132 N 0.44 3.85 0.50 4.56 1.02 0.16 -4.64 119.74 125.62 3h8r s LYS 132 Ca 0.51 1.42 -0.23 0.00 0.02 0.00 0.00 55.97 57.70 3h8r s LYS 132 Cb -0.24 -2.19 -0.07 0.00 -0.52 0.00 0.00 37.83 34.80 3h8r s LYS 132 CO 0.30 -0.40 1.17 -2.30 -0.92 0.00 0.00 175.35 173.20 3h8r n PRO 133 N -0.78 1.51 -1.52 -1.68 -0.02 -1.26 -1.52 135.00 129.72 3h8r n PRO 133 Ca 0.08 0.55 -0.41 0.00 -2.02 0.00 0.00 63.50 61.71 3h8r n PRO 133 Cb 0.52 -2.32 0.02 0.00 -0.02 0.00 0.00 33.50 31.70 3h8r n PRO 133 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 3h8r n TRP 134 N -0.84 0.18 -4.40 6.00 7.02 -1.26 -4.76 117.44 119.38 3h8r n TRP 134 Ca 0.10 0.55 -0.24 0.00 -1.02 0.00 0.00 57.50 56.88 3h8r n TRP 134 Cb 0.43 -2.08 -0.11 0.00 -2.42 0.00 0.00 31.31 27.12 3h8r n TRP 134 CO 0.00 0.00 0.00 0.96 -2.02 0.00 0.00 177.69 176.63 3h8r s ILE 135 N -1.44 2.17 0.24 -0.99 -4.36 -1.26 -5.02 121.20 110.54 3h8r s ILE 135 Ca 0.65 -2.08 -0.07 0.00 -0.26 0.00 0.00 60.65 58.89 3h8r s ILE 135 Cb -0.55 -2.06 0.24 0.00 1.25 0.00 0.00 42.46 41.34 3h8r s ILE 135 CO 0.56 -0.26 1.66 -0.65 0.24 0.00 0.00 174.94 176.48 3h8r h PRO 136 N 2.99 0.16 -0.93 0.37 0.11 -1.99 -0.69 132.00 132.03 3h8r h PRO 136 Ca -0.43 -0.01 0.01 0.00 0.11 0.00 0.00 66.00 65.68 3h8r h PRO 136 Cb 1.22 -0.04 -0.05 0.00 0.11 0.00 0.00 31.00 32.24 3h8r h PRO 136 CO 0.52 0.11 0.62 -0.24 -0.21 0.00 0.00 178.00 178.80 3h8r h VAL 137 N 0.17 1.23 -0.05 3.15 3.04 -1.97 -0.19 116.25 121.63 3h8r h VAL 137 Ca 0.40 -0.43 -0.20 0.00 -1.01 0.00 0.00 66.70 65.46 3h8r h VAL 137 Cb 0.69 -0.13 -0.00 0.00 -2.01 0.00 0.00 31.29 29.83 3h8r h VAL 137 CO -0.58 0.23 -0.81 -0.07 -1.01 0.00 0.00 177.57 175.33 3h8r h LEU 138 N 1.25 0.50 -0.66 3.16 3.38 -1.60 -2.74 115.31 118.61 3h8r h LEU 138 Ca 0.35 -0.36 -0.08 0.00 0.09 0.00 0.00 57.88 57.88 3h8r h LEU 138 Cb -0.12 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.45 3h8r h LEU 138 CO -0.08 1.12 0.09 -0.33 0.09 0.00 0.00 178.44 179.34 3h8r h GLU 139 N 0.26 1.09 -0.37 1.13 5.08 -0.70 -0.70 114.58 120.37 3h8r h GLU 139 Ca -0.05 -0.30 -0.01 0.00 -1.00 0.00 0.00 59.36 58.00 3h8r h GLU 139 Cb 1.41 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 30.52 3h8r h GLU 139 CO 0.14 1.01 0.18 0.00 -1.00 0.00 0.00 179.01 179.34 3h8r h ARG 140 N 1.01 0.52 -0.10 2.33 3.08 -0.98 0.29 114.38 120.54 3h8r h ARG 140 Ca 0.20 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 60.17 3h8r h ARG 140 Cb 0.46 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 30.40 3h8r h ARG 140 CO 0.02 0.46 0.04 0.82 -1.07 0.00 0.00 179.97 180.23 3h8r h ILE 141 N 0.46 1.14 -0.52 2.04 2.04 -1.42 -0.55 117.51 120.70 3h8r h ILE 141 Ca 0.13 -0.41 0.10 0.00 1.00 0.00 0.00 64.86 65.68 3h8r h ILE 141 Cb 0.10 1.24 -0.09 0.00 -0.74 0.00 0.00 36.82 37.33 3h8r h ILE 141 CO -0.02 0.12 0.00 -0.09 0.00 0.00 0.00 178.15 178.17 3h8r h ARG 142 N 0.00 0.12 -0.19 2.37 2.43 -0.91 -0.40 114.38 117.79 3h8r h ARG 142 Ca 0.03 -0.01 -0.14 0.00 -0.81 0.00 0.00 59.98 59.06 3h8r h ARG 142 Cb 0.16 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.67 3h8r h ARG 142 CO -0.00 0.08 -0.45 -0.44 -1.51 0.00 0.00 179.97 177.64 3h8r h ASP 143 N 0.12 0.53 -0.10 -3.80 3.32 -0.80 0.35 116.42 116.04 3h8r h ASP 143 Ca 0.27 -0.25 -0.01 0.00 0.02 0.00 0.00 57.03 57.06 3h8r h ASP 143 Cb 0.40 -0.15 -0.00 0.00 0.22 0.00 0.00 39.33 39.80 3h8r h ASP 143 CO -0.44 0.91 0.02 -0.74 -1.72 0.00 0.00 179.24 177.27 3h8r h HIS 144 N 0.40 0.17 -0.62 4.55 2.76 -0.46 -0.89 115.15 121.05 3h8r h HIS 144 Ca 0.03 -0.02 0.03 0.00 -2.20 0.00 0.00 60.37 58.21 3h8r h HIS 144 Cb 0.95 -0.05 -0.04 0.00 1.55 0.00 0.00 27.41 29.82 3h8r h HIS 144 CO 0.03 0.36 0.37 0.28 -1.30 0.00 0.00 177.93 177.68 3h8r h VAL 145 N -0.07 1.05 -0.73 5.26 2.07 -0.88 -0.56 116.25 122.39 3h8r h VAL 145 Ca 0.03 -0.25 0.02 0.00 0.82 0.00 0.00 66.70 67.32 3h8r h VAL 145 Cb 0.28 0.26 -0.04 0.00 -1.52 0.00 0.00 31.29 30.27 3h8r h VAL 145 CO 0.00 0.13 0.47 0.28 0.02 0.00 0.00 177.57 178.47 3h8r h SER 146 N 0.73 0.78 -0.28 0.57 0.02 -0.86 -0.04 113.55 114.47 3h8r h SER 146 Ca 0.26 -0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 61.19 3h8r h SER 146 Cb 0.05 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.40 3h8r h SER 146 CO -0.12 0.54 0.12 1.23 -1.14 0.00 0.00 176.83 177.46 3h8r h GLY 147 N 0.92 0.44 2.00 -3.77 0.00 -0.48 0.17 103.07 102.35 3h8r h GLY 147 Ca 0.29 -0.23 -0.09 0.00 0.00 0.00 0.00 47.33 47.29 3h8r h GLY 147 CO -0.10 0.22 -0.45 -2.08 0.00 0.00 0.00 176.54 174.14 3h8r h VAL 148 N 0.30 1.10 0.00 4.60 2.07 -0.85 -3.34 116.25 120.13 3h8r h VAL 148 Ca 0.09 -1.66 -0.04 0.00 0.82 0.00 0.00 66.70 65.91 3h8r h VAL 148 Cb 0.16 1.96 -0.01 0.00 -1.52 0.00 0.00 31.29 31.88 3h8r h VAL 148 CO -0.01 0.44 -1.68 0.35 0.02 0.00 0.00 177.57 176.69 3h8r n THR 149 N -3.68 0.15 -1.00 2.57 -2.24 -0.05 -4.87 114.28 105.16 3h8r n THR 149 Ca -0.01 -0.36 0.00 0.00 -2.27 0.00 0.00 64.05 61.42 3h8r n THR 149 Cb 0.53 0.04 0.00 0.00 -2.10 0.00 0.00 70.33 68.80 3h8r n THR 149 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3h8r n GLY 150 N 1.80 0.74 3.96 3.38 0.00 0.59 -5.04 105.19 110.63 3h8r n GLY 150 Ca -0.06 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.76 3h8r n GLY 150 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3h8r s GLN 151 N -0.02 3.26 0.11 1.61 -1.52 -1.23 -5.04 119.66 116.83 3h8r s GLN 151 Ca 0.00 -0.90 0.09 0.00 -1.95 0.00 0.00 55.36 52.61 3h8r s GLN 151 Cb 0.00 -2.83 -0.04 0.00 -0.22 0.00 0.00 33.01 29.93 3h8r s GLN 151 CO 0.00 0.27 -0.23 0.95 -0.25 0.00 0.00 175.29 176.03 3h8r s THR 152 N -2.08 1.92 0.02 -0.19 -4.23 -1.26 -4.27 115.64 105.55 3h8r s THR 152 Ca 0.38 -1.64 0.01 0.00 -1.18 0.00 0.00 61.69 59.27 3h8r s THR 152 Cb -0.09 -1.73 -0.01 0.00 1.34 0.00 0.00 72.50 72.01 3h8r s THR 152 CO 0.29 -0.01 -0.04 -0.36 -0.54 0.00 0.00 174.62 173.96 3h8r s PHE 153 N -1.16 0.33 -0.04 3.99 0.08 -1.26 -4.61 117.98 115.31 3h8r s PHE 153 Ca 0.10 -0.31 0.07 0.00 0.12 0.00 0.00 56.93 56.90 3h8r s PHE 153 Cb -0.10 -0.21 0.10 0.00 -0.57 0.00 0.00 43.02 42.24 3h8r s PHE 153 CO 0.05 -0.08 0.98 0.27 -0.10 0.00 0.00 175.22 176.33 3h8r n ASN 154 N 2.18 1.56 -3.58 1.36 6.94 -0.44 -4.97 115.26 118.32 3h8r n ASN 154 Ca -0.19 -2.23 -0.15 0.00 -0.02 0.00 0.00 54.58 52.00 3h8r n ASN 154 Cb 0.57 -0.17 -0.06 0.00 -2.36 0.00 0.00 39.78 37.75 3h8r n ASN 154 CO 0.00 0.00 0.00 0.12 -1.03 0.00 0.00 177.26 176.35 3h8r s PHE 155 N -1.36 -0.65 -0.02 -2.53 5.36 -1.02 -2.05 117.98 115.71 3h8r s PHE 155 Ca 0.11 1.34 0.00 0.00 -0.96 0.00 0.00 56.93 57.42 3h8r s PHE 155 Cb 0.10 0.36 0.02 0.00 -0.34 0.00 0.00 43.02 43.16 3h8r s PHE 155 CO 0.01 -0.46 0.02 0.54 -1.46 0.00 0.00 175.22 173.87 3h8r s VAL 156 N -0.50 0.01 -0.19 3.12 0.11 0.18 -0.61 120.40 122.53 3h8r s VAL 156 Ca -0.05 0.13 -0.11 0.00 -2.93 0.00 0.00 61.98 59.03 3h8r s VAL 156 Cb -0.02 -0.11 -0.05 0.00 -1.53 0.00 0.00 36.38 34.67 3h8r s VAL 156 CO 0.04 0.08 0.19 -0.22 -3.33 0.00 0.00 175.10 171.86 3h8r s LEU 157 N 0.81 4.22 -0.18 2.54 2.96 -0.65 -1.63 118.68 126.74 3h8r s LEU 157 Ca -0.07 0.32 -0.02 0.00 -0.22 0.00 0.00 54.13 54.14 3h8r s LEU 157 Cb -0.10 -2.19 -0.01 0.00 0.50 0.00 0.00 46.19 44.39 3h8r s LEU 157 CO -0.02 0.15 -0.10 -0.63 -1.32 0.00 0.00 176.35 174.43 3h8r s ILE 158 N 0.42 3.09 -0.14 6.68 1.01 0.43 -0.47 121.20 132.21 3h8r s ILE 158 Ca 0.11 -0.61 0.01 0.00 0.00 0.00 0.00 60.65 60.16 3h8r s ILE 158 Cb -0.12 -2.35 -0.00 0.00 0.01 0.00 0.00 42.46 40.00 3h8r s ILE 158 CO 0.00 0.48 -0.17 0.20 0.00 0.00 0.00 174.94 175.45 3h8r s ASN 159 N 0.99 3.55 -0.16 3.58 0.01 -0.22 -1.01 114.94 121.69 3h8r s ASN 159 Ca -0.01 -0.48 -0.02 0.00 -0.71 0.00 0.00 52.86 51.65 3h8r s ASN 159 Cb -0.15 -1.53 -0.01 0.00 0.41 0.00 0.00 41.25 39.97 3h8r s ASN 159 CO -0.01 0.11 -0.09 -0.60 -1.51 0.00 0.00 177.10 175.00 3h8r s ARG 160 N 0.65 3.41 -0.36 -0.60 3.52 0.54 -0.59 118.95 125.53 3h8r s ARG 160 Ca -0.09 -0.65 -0.05 0.00 -0.13 0.00 0.00 55.73 54.81 3h8r s ARG 160 Cb -0.16 -2.78 0.06 0.00 -1.56 0.00 0.00 34.95 30.51 3h8r s ARG 160 CO 0.02 0.09 0.13 0.71 -0.81 0.00 0.00 175.30 175.44 3h8r s TYR 161 N 0.70 3.32 0.43 5.12 2.02 0.47 -1.10 117.35 128.31 3h8r s TYR 161 Ca -0.05 -1.68 0.17 0.00 -0.37 0.00 0.00 57.07 55.14 3h8r s TYR 161 Cb -0.15 -2.51 1.05 0.00 -0.40 0.00 0.00 41.96 39.94 3h8r s TYR 161 CO 0.02 -0.80 1.98 1.57 -1.57 0.00 0.00 175.55 176.75 3h8r h LYS 162 N 8.18 0.00 0.00 -0.62 2.10 -1.88 0.11 116.57 124.46 3h8r h LYS 162 Ca -0.21 0.00 0.03 0.00 -2.00 0.00 0.00 60.65 58.47 3h8r h LYS 162 Cb 1.07 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.40 3h8r h LYS 162 CO 0.63 0.20 0.14 -0.40 -2.00 0.00 0.00 179.45 178.03 3h8r n ASP 163 N -4.13 -0.50 0.00 7.07 5.68 -1.26 -2.35 116.55 121.05 3h8r n ASP 163 Ca -0.02 -1.29 0.08 0.00 -0.50 0.00 0.00 54.79 53.05 3h8r n ASP 163 Cb 0.27 0.83 0.34 0.00 -1.14 0.00 0.00 41.12 41.42 3h8r n ASP 163 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3h8r n GLY 164 N -0.18 -1.01 0.14 6.12 0.00 -0.02 -2.04 105.19 108.20 3h8r n GLY 164 Ca -0.01 -0.06 0.05 0.00 0.00 0.00 0.00 46.02 46.01 3h8r n GLY 164 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3h8r h SER 165 N 0.00 0.00 -3.96 1.61 0.02 -1.82 0.60 113.55 110.00 3h8r h SER 165 Ca 0.00 0.00 -0.48 0.00 -0.84 0.00 0.00 61.79 60.47 3h8r h SER 165 Cb 0.25 0.00 0.02 0.00 0.14 0.00 0.00 62.40 62.81 3h8r h SER 165 CO 0.00 0.33 0.42 -1.81 -1.14 0.00 0.00 176.83 174.62 3h8r s ASP 166 N -6.09 6.72 0.33 3.07 1.11 -0.87 -4.90 116.67 116.05 3h8r s ASP 166 Ca 0.03 2.06 -0.18 0.00 0.18 0.00 0.00 52.55 54.63 3h8r s ASP 166 Cb 0.08 -2.59 0.05 0.00 1.07 0.00 0.00 42.92 41.53 3h8r s ASP 166 CO 0.75 -0.52 0.80 -1.38 1.18 0.00 0.00 175.17 176.00 3h8r s HIS 167 N -1.65 0.03 -0.01 4.23 -3.43 -0.26 -4.72 115.29 109.48 3h8r s HIS 167 Ca 0.58 -0.61 0.00 0.00 -0.80 0.00 0.00 55.06 54.23 3h8r s HIS 167 Cb -0.22 0.79 0.01 0.00 -1.43 0.00 0.00 32.58 31.72 3h8r s HIS 167 CO 0.28 -1.40 0.01 -1.50 -2.00 0.00 0.00 174.74 170.12 3h8r s ILE 168 N -2.74 0.01 0.81 -5.38 2.07 -1.01 -4.56 121.20 110.40 3h8r s ILE 168 Ca 0.15 0.05 -0.12 0.00 -1.41 0.00 0.00 60.65 59.32 3h8r s ILE 168 Cb -0.05 -0.05 0.08 0.00 0.13 0.00 0.00 42.46 42.57 3h8r s ILE 168 CO 0.09 0.03 1.14 -0.83 -1.91 0.00 0.00 174.94 173.47 3h8r s GLY 169 N 0.28 1.60 0.18 1.50 0.00 -1.26 -1.98 107.32 107.64 3h8r s GLY 169 Ca -0.02 -0.50 -0.32 0.00 0.00 0.00 0.00 44.72 43.88 3h8r s GLY 169 CO -0.01 -0.03 1.73 -0.54 0.00 0.00 0.00 173.10 174.25 3h8r s GLU 170 N -5.41 4.14 0.16 2.90 2.02 -1.26 -4.56 118.70 116.69 3h8r s GLU 170 Ca 0.61 2.56 -0.24 0.00 0.02 0.00 0.00 54.97 57.93 3h8r s GLU 170 Cb -0.12 -3.22 0.06 0.00 0.10 0.00 0.00 34.13 30.95 3h8r s GLU 170 CO 0.51 -0.75 0.76 -3.38 0.02 0.00 0.00 175.26 172.42 3h8r s HIS 171 N 1.59 -0.32 0.03 1.61 -3.43 -0.56 -4.91 115.29 109.30 3h8r s HIS 171 Ca 0.76 0.04 0.00 0.00 -0.80 0.00 0.00 55.06 55.06 3h8r s HIS 171 Cb -0.48 0.61 -0.04 0.00 -1.43 0.00 0.00 32.58 31.25 3h8r s HIS 171 CO 0.33 -0.89 0.14 1.03 -2.00 0.00 0.00 174.74 173.35 3h8r s ARG 172 N -3.57 3.20 -1.21 -0.38 0.52 -1.26 -0.72 118.95 115.53 3h8r s ARG 172 Ca 0.07 -0.49 -0.12 0.00 -0.52 0.00 0.00 55.73 54.68 3h8r s ARG 172 Cb -0.02 -2.93 0.19 0.00 0.52 0.00 0.00 34.95 32.71 3h8r s ARG 172 CO -0.04 0.62 1.49 -0.25 0.02 0.00 0.00 175.30 177.14 3h8r n ASP 173 N 0.71 5.31 -2.69 0.23 8.00 -1.26 -4.73 116.55 122.12 3h8r n ASP 173 Ca -0.09 -3.04 -0.17 0.00 0.71 0.00 0.00 54.79 52.20 3h8r n ASP 173 Cb 0.52 -1.51 0.01 0.00 -0.02 0.00 0.00 41.12 40.12 3h8r n ASP 173 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 3h8r n ASP 174 N 4.57 2.62 -4.52 -2.24 5.68 -1.26 -4.88 116.55 116.52 3h8r n ASP 174 Ca 0.35 -3.14 -0.38 0.00 -0.50 0.00 0.00 54.79 51.12 3h8r n ASP 174 Cb 0.40 -0.52 0.04 0.00 -1.14 0.00 0.00 41.12 39.90 3h8r n ASP 174 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3h8r h ARG 176 N 0.43 1.07 0.00 0.00 3.08 -1.98 -3.08 114.38 113.90 3h8r h ARG 176 Ca -0.46 -0.17 0.00 0.00 0.07 0.00 0.00 59.98 59.42 3h8r h ARG 176 Cb 1.38 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 31.25 3h8r h ARG 176 CO 0.49 0.85 0.00 -0.85 -1.07 0.00 0.00 179.97 179.40 3h8r n GLU 177 N -4.38 0.04 -2.56 0.04 0.00 -1.26 -4.65 120.64 107.86 3h8r n GLU 177 Ca 0.06 0.23 -0.43 0.00 0.00 0.00 0.00 57.16 57.03 3h8r n GLU 177 Cb 0.15 -1.50 -0.02 0.00 0.00 0.00 0.00 31.44 30.07 3h8r n GLU 177 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 3h8r s LEU 178 N -2.92 4.23 0.12 -1.84 1.43 -1.16 -0.05 118.68 118.47 3h8r s LEU 178 Ca 0.08 1.64 -0.35 0.00 -1.03 0.00 0.00 54.13 54.47 3h8r s LEU 178 Cb 0.10 -3.55 -0.15 0.00 0.03 0.00 0.00 46.19 42.62 3h8r s LEU 178 CO 0.26 -0.57 1.52 0.00 0.23 0.00 0.00 176.35 177.78 3h8r n ALA 179 N 5.49 0.58 -1.65 4.21 0.00 -0.71 -4.85 120.51 123.59 3h8r n ALA 179 Ca 0.11 0.46 -0.48 0.00 0.00 0.00 0.00 53.44 53.53 3h8r n ALA 179 Cb 0.47 -2.27 -0.05 0.00 0.00 0.00 0.00 19.45 17.60 3h8r n ALA 179 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3h8r n PRO 180 N 3.34 1.85 -0.82 0.00 -0.02 -1.26 -2.16 135.00 135.92 3h8r n PRO 180 Ca 0.18 0.67 0.00 0.00 -2.02 0.00 0.00 63.50 62.33 3h8r n PRO 180 Cb 0.25 -2.40 0.00 0.00 -0.02 0.00 0.00 33.50 31.33 3h8r n PRO 180 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3h8r n GLY 181 N 3.20 0.63 3.77 -1.23 0.00 -1.26 -5.00 105.19 105.31 3h8r n GLY 181 Ca 0.18 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.82 3h8r n GLY 181 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3h8r s SER 182 N -2.62 6.61 0.55 1.61 1.04 -0.92 -4.37 113.70 115.60 3h8r s SER 182 Ca 0.00 2.20 -0.14 0.00 0.48 0.00 0.00 55.95 58.50 3h8r s SER 182 Cb 0.00 -2.60 -0.06 0.00 0.10 0.00 0.00 66.02 63.46 3h8r s SER 182 CO 0.00 -0.60 0.99 -2.16 0.98 0.00 0.00 173.24 172.45 3h8r s PRO 183 N -2.39 3.79 -0.14 4.02 0.04 -1.26 -4.61 135.00 134.46 3h8r s PRO 183 Ca 0.58 0.84 -0.02 0.00 0.04 0.00 0.00 61.00 62.44 3h8r s PRO 183 Cb -0.27 -2.13 -0.02 0.00 0.04 0.00 0.00 34.50 32.13 3h8r s PRO 183 CO 0.33 -0.39 -0.09 0.42 0.04 0.00 0.00 177.00 177.32 3h8r s ILE 184 N -2.85 3.40 -0.29 0.56 1.01 -0.59 -4.55 121.20 117.89 3h8r s ILE 184 Ca 0.57 -0.54 -0.08 0.00 0.00 0.00 0.00 60.65 60.60 3h8r s ILE 184 Cb -0.10 -2.45 -0.01 0.00 0.01 0.00 0.00 42.46 39.91 3h8r s ILE 184 CO 0.41 0.51 0.10 0.00 0.00 0.00 0.00 174.94 175.96 3h8r s ALA 185 N 0.34 3.15 -0.36 9.38 0.00 -0.70 -0.77 121.76 132.79 3h8r s ALA 185 Ca -0.08 -1.34 -0.09 0.00 0.00 0.00 0.00 51.96 50.45 3h8r s ALA 185 Cb -0.15 -2.20 0.03 0.00 0.00 0.00 0.00 23.12 20.81 3h8r s ALA 185 CO 0.05 -0.79 0.15 0.45 0.00 0.00 0.00 175.76 175.62 3h8r s SER 186 N 1.57 5.52 -0.14 0.00 0.15 0.28 -0.29 113.70 120.80 3h8r s SER 186 Ca 0.04 -1.08 -0.01 0.00 0.70 0.00 0.00 55.95 55.61 3h8r s SER 186 Cb -0.17 -1.94 -0.02 0.00 -1.71 0.00 0.00 66.02 62.18 3h8r s SER 186 CO 0.04 -0.36 -0.11 -0.69 1.20 0.00 0.00 173.24 173.32 3h8r s VAL 187 N 1.47 3.26 -0.05 4.45 1.01 0.21 -0.49 120.40 130.26 3h8r s VAL 187 Ca 0.00 -0.59 0.06 0.00 0.00 0.00 0.00 61.98 61.45 3h8r s VAL 187 Cb -0.19 -2.38 -0.02 0.00 0.00 0.00 0.00 36.38 33.79 3h8r s VAL 187 CO 0.05 0.52 -0.23 -0.44 0.00 0.00 0.00 175.10 174.99 3h8r s SER 188 N 0.35 3.24 0.04 3.32 0.01 -0.75 0.29 113.70 120.19 3h8r s SER 188 Ca -0.09 -0.45 0.04 0.00 1.31 0.00 0.00 55.95 56.76 3h8r s SER 188 Cb -0.15 -0.76 -0.02 0.00 0.21 0.00 0.00 66.02 65.29 3h8r s SER 188 CO 0.05 0.27 -0.13 -0.36 0.41 0.00 0.00 173.24 173.48 3h8r s PHE 189 N -0.31 1.14 0.00 2.43 0.08 0.03 0.00 117.98 121.35 3h8r s PHE 189 Ca 0.01 -0.35 0.00 0.00 0.12 0.00 0.00 56.93 56.71 3h8r s PHE 189 Cb -0.13 -0.68 0.00 0.00 -0.57 0.00 0.00 43.02 41.64 3h8r s PHE 189 CO 0.02 0.02 0.00 0.41 -0.10 0.00 0.00 175.22 175.57 3h8r n GLY 190 N 1.94 1.07 3.76 4.36 0.00 -1.26 -0.48 105.19 114.58 3h8r n GLY 190 Ca -0.18 -1.64 -0.41 0.00 0.00 0.00 0.00 46.02 43.79 3h8r n GLY 190 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h8r s ALA 191 N -2.00 3.54 0.33 4.61 0.00 -0.53 -3.97 121.76 123.74 3h8r s ALA 191 Ca 0.00 1.30 -0.29 0.00 0.00 0.00 0.00 51.96 52.97 3h8r s ALA 191 Cb 0.00 -3.51 -0.11 0.00 0.00 0.00 0.00 23.12 19.50 3h8r s ALA 191 CO 0.00 -0.70 1.50 0.45 0.00 0.00 0.00 175.76 177.02 3h8r s SER 192 N -0.19 6.43 0.03 0.00 0.15 -1.26 -4.73 113.70 114.12 3h8r s SER 192 Ca 0.52 2.94 0.03 0.00 0.70 0.00 0.00 55.95 60.14 3h8r s SER 192 Cb -0.41 -2.65 -0.02 0.00 -1.71 0.00 0.00 66.02 61.24 3h8r s SER 192 CO 0.51 -0.84 -0.10 -0.13 1.20 0.00 0.00 173.24 173.88 3h8r s ARG 193 N -1.29 0.67 0.06 5.44 1.81 -1.14 -4.96 118.95 119.54 3h8r s ARG 193 Ca 0.57 -0.61 -0.30 0.00 -1.72 0.00 0.00 55.73 53.67 3h8r s ARG 193 Cb -0.46 -0.59 -0.05 0.00 -0.45 0.00 0.00 34.95 33.41 3h8r s ARG 193 CO 0.54 0.14 1.11 -0.51 -0.68 0.00 0.00 175.30 175.91 3h8r s ASP 194 N -1.03 7.21 -0.09 0.23 1.01 -1.26 -1.01 116.67 121.73 3h8r s ASP 194 Ca -0.02 1.91 0.02 0.00 0.71 0.00 0.00 52.55 55.17 3h8r s ASP 194 Cb -0.07 -2.58 -0.02 0.00 1.01 0.00 0.00 42.92 41.26 3h8r s ASP 194 CO 0.01 -0.36 -0.15 0.12 0.21 0.00 0.00 175.17 175.00 3h8r s PHE 195 N 0.84 2.73 -0.11 4.23 5.36 0.03 -4.02 117.98 127.04 3h8r s PHE 195 Ca 0.55 -0.46 0.02 0.00 -0.96 0.00 0.00 56.93 56.08 3h8r s PHE 195 Cb -0.27 -1.73 0.01 0.00 -0.34 0.00 0.00 43.02 40.70 3h8r s PHE 195 CO 0.30 -0.05 -0.16 0.08 -1.46 0.00 0.00 175.22 173.92 3h8r s VAL 196 N -0.14 1.57 -0.16 3.12 1.01 -0.78 -1.24 120.40 123.79 3h8r s VAL 196 Ca -0.01 -0.69 -0.07 0.00 0.00 0.00 0.00 61.98 61.20 3h8r s VAL 196 Cb -0.14 -1.43 -0.04 0.00 0.00 0.00 0.00 36.38 34.78 3h8r s VAL 196 CO 0.03 0.46 0.08 -0.36 0.00 0.00 0.00 175.10 175.31 3h8r s PHE 197 N 0.92 3.34 -0.03 5.22 0.08 0.53 -1.53 117.98 126.51 3h8r s PHE 197 Ca -0.08 0.23 0.01 0.00 0.12 0.00 0.00 56.93 57.22 3h8r s PHE 197 Cb -0.15 -2.02 0.02 0.00 -0.57 0.00 0.00 43.02 40.30 3h8r s PHE 197 CO -0.01 0.35 -0.05 0.50 -0.10 0.00 0.00 175.22 175.92 3h8r s ARG 198 N -0.13 0.74 0.20 0.44 3.52 0.34 -1.29 118.95 122.77 3h8r s ARG 198 Ca 0.08 -0.12 -0.30 0.00 -0.13 0.00 0.00 55.73 55.26 3h8r s ARG 198 Cb -0.12 -0.75 -0.08 0.00 -1.56 0.00 0.00 34.95 32.44 3h8r s ARG 198 CO 0.01 -0.03 1.23 -1.58 -0.81 0.00 0.00 175.30 174.11 3h8r s HIS 199 N 0.68 3.37 0.31 5.12 5.65 -1.26 -0.00 115.29 129.16 3h8r s HIS 199 Ca -0.09 1.38 0.08 0.00 0.25 0.00 0.00 55.06 56.68 3h8r s HIS 199 Cb -0.12 -3.48 0.89 0.00 -1.18 0.00 0.00 32.58 28.69 3h8r s HIS 199 CO 0.00 -1.39 1.64 1.57 -0.65 0.00 0.00 174.74 175.91 3h8r h LYS 200 N 5.14 0.21 0.00 2.88 2.10 -1.61 -1.53 116.57 123.76 3h8r h LYS 200 Ca -0.45 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.19 3h8r h LYS 200 Cb 1.21 -0.05 0.00 0.00 -0.90 0.00 0.00 32.23 32.50 3h8r h LYS 200 CO 0.75 0.14 0.00 -0.25 -2.00 0.00 0.00 179.45 178.08 3h8r n ASP 201 N -5.20 0.00 -1.46 7.07 8.00 -1.26 -3.47 116.55 120.23 3h8r n ASP 201 Ca 0.26 -0.58 0.02 0.00 0.71 0.00 0.00 54.79 55.21 3h8r n ASP 201 Cb 0.84 -0.11 0.30 0.00 -0.02 0.00 0.00 41.12 42.12 3h8r n ASP 201 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 3h8r n SER 202 N -1.11 4.40 -4.82 -2.24 3.41 -0.57 -2.69 113.62 110.00 3h8r n SER 202 Ca 0.18 -3.15 -0.24 0.00 -0.26 0.00 0.00 58.87 55.40 3h8r n SER 202 Cb 0.14 -0.65 -0.05 0.00 -0.26 0.00 0.00 64.21 63.40 3h8r n SER 202 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3h8r s ARG 203 N -2.92 2.93 -0.09 4.33 0.52 -1.23 -4.85 118.95 117.65 3h8r s ARG 203 Ca 0.49 -0.94 -0.01 0.00 -0.52 0.00 0.00 55.73 54.75 3h8r s ARG 203 Cb 0.40 -2.62 0.00 0.00 0.52 0.00 0.00 34.95 33.24 3h8r s ARG 203 CO 0.11 0.45 0.09 0.41 0.02 0.00 0.00 175.30 176.38 3h8r n GLY 204 N -0.73 -0.53 5.00 -3.53 0.00 -1.26 -3.99 105.19 100.16 3h8r n GLY 204 Ca -0.08 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.89 3h8r n GLY 204 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3h8r n LYS 205 N -0.93 0.00 -3.73 1.61 4.81 -1.26 -3.92 118.16 114.75 3h8r n LYS 205 Ca 0.00 0.00 -0.28 0.00 -0.87 0.00 0.00 58.31 57.17 3h8r n LYS 205 Cb 0.38 0.00 -0.11 0.00 0.02 0.00 0.00 35.03 35.32 3h8r n LYS 205 CO 0.00 0.00 0.00 -1.13 1.17 0.00 0.00 177.40 177.44 3h8r n SER 206 N 1.80 3.06 -4.69 3.14 3.41 -1.26 -5.11 113.62 113.97 3h8r n SER 206 Ca 0.00 -3.24 -0.36 0.00 -0.26 0.00 0.00 58.87 55.01 3h8r n SER 206 Cb 0.00 -0.72 0.08 0.00 -0.26 0.00 0.00 64.21 63.31 3h8r n SER 206 CO 0.00 0.00 0.00 -2.65 -0.16 0.00 0.00 175.04 172.23 3h8r n PRO 207 N 1.65 0.78 -0.28 4.33 -0.02 -1.25 -4.91 135.00 135.29 3h8r n PRO 207 Ca 0.23 0.33 0.02 0.00 -2.02 0.00 0.00 63.50 62.06 3h8r n PRO 207 Cb 0.38 -2.41 0.15 0.00 -0.02 0.00 0.00 33.50 31.59 3h8r n PRO 207 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 3h8r h SER 208 N 0.08 0.68 -2.37 2.55 0.87 -1.76 -3.45 113.55 110.14 3h8r h SER 208 Ca -0.49 0.04 -0.09 0.00 -1.23 0.00 0.00 61.79 60.02 3h8r h SER 208 Cb 1.33 -0.09 -0.02 0.00 -0.44 0.00 0.00 62.40 63.18 3h8r h SER 208 CO 0.50 0.40 -0.05 0.54 -0.53 0.00 0.00 176.83 177.70 3h8r n ARG 209 N -4.73 0.24 -3.32 2.24 1.74 -1.13 -5.08 116.66 106.61 3h8r n ARG 209 Ca 0.12 -0.93 -0.25 0.00 -0.77 0.00 0.00 57.85 56.02 3h8r n ARG 209 Cb 0.24 0.91 -0.08 0.00 -1.02 0.00 0.00 32.46 32.51 3h8r n ARG 209 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3h8r n ARG 210 N -0.19 1.22 -2.44 5.56 1.74 -1.26 -4.19 116.66 117.09 3h8r n ARG 210 Ca 0.00 -3.69 -0.42 0.00 -0.77 0.00 0.00 57.85 52.97 3h8r n ARG 210 Cb 0.20 -1.62 -0.03 0.00 -1.02 0.00 0.00 32.46 29.99 3h8r n ARG 210 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3h8r s VAL 211 N -1.42 3.94 0.44 1.55 1.01 -1.26 -4.98 120.40 119.67 3h8r s VAL 211 Ca 0.36 1.49 -0.25 0.00 0.00 0.00 0.00 61.98 63.57 3h8r s VAL 211 Cb 0.14 -3.95 -0.08 0.00 0.00 0.00 0.00 36.38 32.49 3h8r s VAL 211 CO -0.10 0.17 1.27 0.00 0.00 0.00 0.00 175.10 176.44 3h8r s ALA 212 N 0.57 3.12 0.56 5.51 0.00 -1.26 -4.71 121.76 125.55 3h8r s ALA 212 Ca 0.55 1.15 -0.21 0.00 0.00 0.00 0.00 51.96 53.46 3h8r s ALA 212 Cb -0.30 -3.46 -0.04 0.00 0.00 0.00 0.00 23.12 19.32 3h8r s ALA 212 CO 0.32 -0.83 1.29 0.08 0.00 0.00 0.00 175.76 176.62 3h8r s VAL 213 N -1.35 2.30 -0.17 0.00 1.01 -1.26 -4.77 120.40 116.16 3h8r s VAL 213 Ca 0.60 0.21 -0.02 0.00 0.00 0.00 0.00 61.98 62.78 3h8r s VAL 213 Cb -0.35 -3.10 -0.01 0.00 0.00 0.00 0.00 36.38 32.92 3h8r s VAL 213 CO 0.44 -0.02 -0.10 -0.69 0.00 0.00 0.00 175.10 174.74 3h8r s VAL 214 N -1.40 3.09 -0.07 2.92 1.01 -0.41 -4.99 120.40 120.55 3h8r s VAL 214 Ca 0.74 -0.62 0.05 0.00 0.00 0.00 0.00 61.98 62.15 3h8r s VAL 214 Cb -0.37 -2.35 -0.01 0.00 0.00 0.00 0.00 36.38 33.66 3h8r s VAL 214 CO 0.42 0.48 -0.23 -0.13 0.00 0.00 0.00 175.10 175.64 3h8r s ARG 215 N 0.93 2.70 -0.07 2.72 0.52 -1.26 -0.35 118.95 124.14 3h8r s ARG 215 Ca -0.02 -0.87 -0.03 0.00 -0.52 0.00 0.00 55.73 54.29 3h8r s ARG 215 Cb -0.15 -2.24 0.04 0.00 0.52 0.00 0.00 34.95 33.13 3h8r s ARG 215 CO -0.00 0.35 0.17 -1.17 0.02 0.00 0.00 175.30 174.66 3h8r s LEU 216 N -0.07 0.65 0.18 2.53 2.96 -0.37 -4.99 118.68 119.57 3h8r s LEU 216 Ca -0.06 0.35 -0.30 0.00 -0.22 0.00 0.00 54.13 53.90 3h8r s LEU 216 Cb -0.14 0.45 -0.08 0.00 0.50 0.00 0.00 46.19 46.92 3h8r s LEU 216 CO 0.05 -0.15 1.21 -2.16 -1.32 0.00 0.00 176.35 173.97 3h8r s PRO 217 N 1.18 4.48 -0.35 0.98 0.04 -1.26 -0.79 135.00 139.28 3h8r s PRO 217 Ca -0.09 1.89 -0.11 0.00 0.04 0.00 0.00 61.00 62.73 3h8r s PRO 217 Cb -0.11 -3.24 0.01 0.00 0.04 0.00 0.00 34.50 31.20 3h8r s PRO 217 CO -0.06 -0.12 0.20 -0.51 0.04 0.00 0.00 177.00 176.54 3h8r s LEU 218 N -0.13 4.51 0.60 -3.56 1.43 -0.18 -4.93 118.68 116.42 3h8r s LEU 218 Ca 0.54 -0.78 -0.08 0.00 -1.03 0.00 0.00 54.13 52.78 3h8r s LEU 218 Cb -0.33 -2.03 -0.01 0.00 0.03 0.00 0.00 46.19 43.85 3h8r s LEU 218 CO 0.36 -0.31 0.94 0.00 0.23 0.00 0.00 176.35 177.58 3h8r s ALA 219 N 1.60 3.20 -0.05 4.21 0.00 -1.26 -2.86 121.76 126.59 3h8r s ALA 219 Ca 0.03 -0.48 -0.37 0.00 0.00 0.00 0.00 51.96 51.15 3h8r s ALA 219 Cb -0.18 -2.77 -0.15 0.00 0.00 0.00 0.00 23.12 20.01 3h8r s ALA 219 CO 0.07 -0.77 1.60 1.58 0.00 0.00 0.00 175.76 178.24 3h8r n HIS 220 N -2.64 1.95 -0.87 0.00 -0.00 -1.25 -2.28 115.22 110.12 3h8r n HIS 220 Ca 0.04 0.44 0.00 0.00 0.46 0.00 0.00 57.72 58.66 3h8r n HIS 220 Cb 0.56 -2.46 0.00 0.00 -0.12 0.00 0.00 29.99 27.97 3h8r n HIS 220 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 3h8r n GLY 221 N 3.52 0.55 3.94 1.57 0.00 0.10 -4.89 105.19 109.98 3h8r n GLY 221 Ca 0.21 -0.17 -0.24 0.00 0.00 0.00 0.00 46.02 45.83 3h8r n GLY 221 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3h8r s SER 222 N -2.15 6.31 -0.12 1.61 1.04 -0.97 -0.70 113.70 118.73 3h8r s SER 222 Ca 0.00 0.44 0.02 0.00 0.48 0.00 0.00 55.95 56.89 3h8r s SER 222 Cb 0.00 -2.03 0.01 0.00 0.10 0.00 0.00 66.02 64.10 3h8r s SER 222 CO 0.00 -0.26 -0.17 -0.22 0.98 0.00 0.00 173.24 173.57 3h8r s LEU 223 N -4.19 1.84 -0.28 2.42 2.96 0.86 -1.80 118.68 120.49 3h8r s LEU 223 Ca 0.40 -0.48 -0.05 0.00 -0.22 0.00 0.00 54.13 53.77 3h8r s LEU 223 Cb -0.10 -1.20 0.02 0.00 0.50 0.00 0.00 46.19 45.41 3h8r s LEU 223 CO 0.35 0.03 0.03 -0.22 -1.32 0.00 0.00 176.35 175.23 3h8r s LEU 224 N 0.95 3.65 -0.19 -0.68 2.96 0.36 -1.10 118.68 124.62 3h8r s LEU 224 Ca -0.06 -0.78 -0.18 0.00 -0.22 0.00 0.00 54.13 52.89 3h8r s LEU 224 Cb -0.15 -1.81 -0.03 0.00 0.50 0.00 0.00 46.19 44.70 3h8r s LEU 224 CO -0.02 -0.17 0.51 -0.04 -1.32 0.00 0.00 176.35 175.30 3h8r s MET 225 N 1.44 4.20 -0.38 1.98 -1.94 0.50 -0.55 119.30 124.54 3h8r s MET 225 Ca 0.02 0.40 -0.08 0.00 -1.71 0.00 0.00 55.69 54.31 3h8r s MET 225 Cb -0.17 -3.55 0.05 0.00 2.01 0.00 0.00 34.83 33.17 3h8r s MET 225 CO 0.00 -0.11 0.19 -1.64 -0.01 0.00 0.00 175.02 173.45 3h8r s MET 226 N 1.53 2.64 0.15 2.03 -1.94 0.05 -1.14 119.30 122.62 3h8r s MET 226 Ca 0.24 -1.28 -0.00 0.00 -1.71 0.00 0.00 55.69 52.94 3h8r s MET 226 Cb -0.15 -3.65 -0.04 0.00 2.01 0.00 0.00 34.83 33.00 3h8r s MET 226 CO 0.10 -0.79 0.32 -0.80 -0.01 0.00 0.00 175.02 173.84 3h8r s ASN 227 N 1.71 6.38 0.34 3.03 0.01 -0.30 -1.54 114.94 124.57 3h8r s ASN 227 Ca 0.01 0.33 -0.26 0.00 -0.71 0.00 0.00 52.86 52.24 3h8r s ASN 227 Cb -0.21 -1.98 -0.13 0.00 0.41 0.00 0.00 41.25 39.34 3h8r s ASN 227 CO 0.03 0.04 0.84 1.57 -1.51 0.00 0.00 177.10 178.07 3h8r n HIS 228 N -0.34 0.61 -1.34 2.20 -0.00 -1.26 -0.33 115.22 114.76 3h8r n HIS 228 Ca -0.05 0.67 -0.29 0.00 -0.00 0.00 0.00 57.72 58.05 3h8r n HIS 228 Cb 0.53 -2.15 0.12 0.00 -0.00 0.00 0.00 29.99 28.49 3h8r n HIS 228 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.34 175.99 3h8r n PRO 229 N 0.59 2.53 -0.29 1.57 -0.04 -1.26 -4.76 135.00 133.34 3h8r n PRO 229 Ca 0.11 -3.23 0.11 0.00 -0.04 0.00 0.00 63.50 60.45 3h8r n PRO 229 Cb 0.35 -2.22 0.27 0.00 -0.04 0.00 0.00 33.50 31.85 3h8r n PRO 229 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 3h8r h THR 230 N 1.06 0.38 -0.05 0.52 2.02 -0.69 -0.29 112.91 115.87 3h8r h THR 230 Ca 0.58 -0.08 0.00 0.00 0.77 0.00 0.00 66.41 67.68 3h8r h THR 230 Cb 1.64 0.11 0.00 0.00 -1.74 0.00 0.00 68.15 68.16 3h8r h THR 230 CO 1.31 0.05 0.00 0.59 0.37 0.00 0.00 175.52 177.83 3h8r n ASN 231 N -5.19 0.88 -0.02 4.18 4.13 -1.26 -1.19 115.26 116.79 3h8r n ASN 231 Ca 0.20 -1.42 -0.10 0.00 1.68 0.00 0.00 54.58 54.93 3h8r n ASN 231 Cb 0.63 -0.03 -0.14 0.00 -1.54 0.00 0.00 39.78 38.70 3h8r n ASN 231 CO 0.00 0.00 0.00 0.35 0.28 0.00 0.00 177.26 177.89 3h8r n THR 232 N -0.26 1.62 0.06 3.41 -2.24 -0.13 -4.32 114.28 112.43 3h8r n THR 232 Ca 0.18 -0.78 0.06 0.00 -2.27 0.00 0.00 64.05 61.25 3h8r n THR 232 Cb 0.23 -1.11 -0.09 0.00 -2.10 0.00 0.00 70.33 67.26 3h8r n THR 232 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 3h8r n HIS 233 N -3.09 0.00 -4.94 4.78 8.25 -1.11 -4.99 115.22 114.12 3h8r n HIS 233 Ca -0.20 0.00 -0.27 0.00 -0.26 0.00 0.00 57.72 56.99 3h8r n HIS 233 Cb 1.06 -0.24 -0.16 0.00 1.12 0.00 0.00 29.99 31.76 3h8r n HIS 233 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 3h8r s TRP 234 N -2.76 1.90 0.36 4.41 0.52 -0.33 -1.43 118.94 121.61 3h8r s TRP 234 Ca -0.03 -0.56 -0.13 0.00 0.02 0.00 0.00 56.10 55.40 3h8r s TRP 234 Cb 0.08 -1.27 -0.08 0.00 -1.15 0.00 0.00 33.47 31.06 3h8r s TRP 234 CO 0.51 -0.18 0.75 0.71 0.02 0.00 0.00 176.95 178.75 3h8r s TYR 235 N 0.00 3.42 0.17 -1.98 2.02 1.00 -4.60 117.35 117.38 3h8r s TYR 235 Ca -0.04 1.12 0.03 0.00 -0.37 0.00 0.00 57.07 57.81 3h8r s TYR 235 Cb -0.12 -2.48 -0.05 0.00 -0.40 0.00 0.00 41.96 38.91 3h8r s TYR 235 CO 0.03 -0.01 -0.03 -3.38 -1.57 0.00 0.00 175.55 170.59 3h8r s HIS 236 N -2.18 1.24 0.24 2.71 -3.43 0.10 -0.50 115.29 113.46 3h8r s HIS 236 Ca 0.53 -0.94 -0.16 0.00 -0.80 0.00 0.00 55.06 53.68 3h8r s HIS 236 Cb -0.10 -0.69 0.01 0.00 -1.43 0.00 0.00 32.58 30.36 3h8r s HIS 236 CO 0.25 -0.12 0.56 -1.54 -2.00 0.00 0.00 174.74 171.88 3h8r s SER 237 N -3.18 -0.19 -0.41 7.38 1.04 -0.58 -1.49 113.70 116.27 3h8r s SER 237 Ca 0.22 -0.71 0.03 0.00 0.48 0.00 0.00 55.95 55.97 3h8r s SER 237 Cb 0.05 0.62 0.12 0.00 0.10 0.00 0.00 66.02 66.91 3h8r s SER 237 CO 0.03 -1.17 0.17 -0.22 0.98 0.00 0.00 173.24 173.03 3h8r s LEU 238 N -2.95 3.63 0.74 2.42 2.96 -0.84 -1.87 118.68 122.77 3h8r s LEU 238 Ca 0.15 -2.45 -0.11 0.00 -0.22 0.00 0.00 54.13 51.51 3h8r s LEU 238 Cb -0.02 -1.34 0.03 0.00 0.50 0.00 0.00 46.19 45.36 3h8r s LEU 238 CO 0.05 -0.31 1.07 -2.16 -1.32 0.00 0.00 176.35 173.68 3h8r s PRO 239 N 0.52 2.58 0.33 0.98 0.04 -1.26 -2.39 135.00 135.81 3h8r s PRO 239 Ca 0.14 0.92 -0.29 0.00 0.04 0.00 0.00 61.00 61.81 3h8r s PRO 239 Cb -0.22 -1.95 -0.11 0.00 0.04 0.00 0.00 34.50 32.25 3h8r s PRO 239 CO -0.06 -1.34 1.53 0.28 0.04 0.00 0.00 177.00 177.44 3h8r n VAL 240 N -3.29 1.49 -3.55 -0.36 0.31 -1.26 -4.87 118.33 106.80 3h8r n VAL 240 Ca 0.08 -0.37 -0.29 0.00 -0.01 0.00 0.00 64.34 63.74 3h8r n VAL 240 Cb 0.54 -1.93 -0.13 0.00 -0.91 0.00 0.00 33.84 31.42 3h8r n VAL 240 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 3h8r s ARG 241 N -1.26 0.74 0.59 5.55 1.81 0.20 -5.02 118.95 121.56 3h8r s ARG 241 Ca 0.59 -1.44 0.31 0.00 -1.72 0.00 0.00 55.73 53.47 3h8r s ARG 241 Cb -0.50 -1.62 1.83 0.00 -0.45 0.00 0.00 34.95 34.21 3h8r s ARG 241 CO 0.56 -1.17 2.24 0.87 -0.68 0.00 0.00 175.30 177.12 3h8r h LYS 242 N 7.11 0.00 0.00 3.54 1.79 -1.94 -1.61 116.57 125.46 3h8r h LYS 242 Ca 0.01 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.48 3h8r h LYS 242 Cb 0.96 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.61 3h8r h LYS 242 CO 0.35 0.02 0.00 0.87 -1.08 0.00 0.00 179.45 179.61 3h8r h LYS 243 N 0.00 0.00 -6.13 3.15 1.57 -1.95 -3.44 116.57 109.77 3h8r h LYS 243 Ca -0.00 0.00 -0.57 0.00 -1.87 0.00 0.00 60.65 58.21 3h8r h LYS 243 Cb 0.06 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.32 3h8r h LYS 243 CO 0.00 0.00 0.86 0.08 -0.57 0.00 0.00 179.45 179.82 3h8r s VAL 244 N -3.19 4.45 -0.44 0.50 1.01 -0.61 -4.90 120.40 117.23 3h8r s VAL 244 Ca 0.08 1.75 0.19 0.00 0.00 0.00 0.00 61.98 64.00 3h8r s VAL 244 Cb 0.10 -4.15 -0.25 0.00 0.00 0.00 0.00 36.38 32.08 3h8r s VAL 244 CO 0.58 -0.17 0.60 0.18 0.00 0.00 0.00 175.10 176.28 3h8r n LEU 245 N 6.53 0.42 -4.79 3.92 4.77 -1.26 -0.84 117.00 125.75 3h8r n LEU 245 Ca 0.13 -0.24 -0.23 0.00 -0.03 0.00 0.00 56.01 55.63 3h8r n LEU 245 Cb 0.45 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.49 3h8r n LEU 245 CO 0.54 0.11 -0.21 0.00 -1.33 0.00 0.00 177.39 176.50 3h8r s ALA 246 N -3.04 3.51 0.53 -1.18 0.00 -1.26 -4.68 121.76 115.63 3h8r s ALA 246 Ca -0.00 -1.39 -0.19 0.00 0.00 0.00 0.00 51.96 50.38 3h8r s ALA 246 Cb 0.13 -1.24 -0.07 0.00 0.00 0.00 0.00 23.12 21.95 3h8r s ALA 246 CO 0.78 0.33 1.06 -1.25 0.00 0.00 0.00 175.76 176.68 3h8r s PRO 247 N -3.58 3.56 -0.03 0.00 0.04 -0.99 -4.09 135.00 129.91 3h8r s PRO 247 Ca 0.32 1.38 0.03 0.00 0.04 0.00 0.00 61.00 62.77 3h8r s PRO 247 Cb -0.08 -2.06 0.00 0.00 0.04 0.00 0.00 34.50 32.40 3h8r s PRO 247 CO 0.24 -0.64 -0.10 0.50 0.04 0.00 0.00 177.00 177.04 3h8r s ARG 248 N -3.46 1.08 -0.17 4.56 3.52 0.37 -1.45 118.95 123.40 3h8r s ARG 248 Ca 0.68 -0.35 -0.00 0.00 -0.13 0.00 0.00 55.73 55.92 3h8r s ARG 248 Cb -0.18 -1.00 0.00 0.00 -1.56 0.00 0.00 34.95 32.21 3h8r s ARG 248 CO 0.26 0.13 -0.14 0.08 -0.81 0.00 0.00 175.30 174.82 3h8r s VAL 249 N 0.18 2.69 -0.13 7.11 1.01 0.36 -0.39 120.40 131.23 3h8r s VAL 249 Ca -0.03 -0.75 -0.00 0.00 0.00 0.00 0.00 61.98 61.20 3h8r s VAL 249 Cb -0.09 -2.16 -0.02 0.00 0.00 0.00 0.00 36.38 34.12 3h8r s VAL 249 CO 0.01 0.50 -0.13 0.21 0.00 0.00 0.00 175.10 175.69 3h8r s ASN 250 N 1.04 4.05 -0.21 3.32 2.47 0.25 -0.79 114.94 125.08 3h8r s ASN 250 Ca -0.01 -0.31 -0.04 0.00 0.42 0.00 0.00 52.86 52.91 3h8r s ASN 250 Cb -0.15 -1.59 -0.02 0.00 -1.45 0.00 0.00 41.25 38.05 3h8r s ASN 250 CO -0.03 0.17 -0.02 -0.76 -3.72 0.00 0.00 177.10 172.74 3h8r s LEU 251 N 0.30 3.11 -0.37 3.21 1.02 0.14 -1.05 118.68 125.05 3h8r s LEU 251 Ca -0.10 -0.28 -0.04 0.00 0.02 0.00 0.00 54.13 53.73 3h8r s LEU 251 Cb -0.16 -1.79 0.07 0.00 0.02 0.00 0.00 46.19 44.34 3h8r s LEU 251 CO 0.05 0.03 0.14 0.42 0.02 0.00 0.00 176.35 177.01 3h8r s THR 252 N 1.18 3.46 0.15 5.49 -4.23 0.38 0.66 115.64 122.74 3h8r s THR 252 Ca 0.03 -1.58 -0.25 0.00 -1.18 0.00 0.00 61.69 58.71 3h8r s THR 252 Cb -0.15 -3.14 -0.08 0.00 1.34 0.00 0.00 72.50 70.48 3h8r s THR 252 CO 0.00 -0.40 0.77 -0.36 -0.54 0.00 0.00 174.62 174.10 3h8r s PHE 253 N 1.27 3.88 0.06 3.99 0.08 0.60 -1.64 117.98 126.23 3h8r s PHE 253 Ca 0.02 1.61 -0.03 0.00 0.12 0.00 0.00 56.93 58.65 3h8r s PHE 253 Cb -0.21 -2.77 -0.03 0.00 -0.57 0.00 0.00 43.02 39.43 3h8r s PHE 253 CO -0.01 0.48 0.02 1.03 -0.10 0.00 0.00 175.22 176.64 3h8r s ARG 254 N -0.98 0.68 -0.38 0.44 0.52 0.21 -1.73 118.95 117.71 3h8r s ARG 254 Ca 0.36 -1.19 -0.12 0.00 -0.52 0.00 0.00 55.73 54.27 3h8r s ARG 254 Cb -0.23 0.24 0.03 0.00 0.52 0.00 0.00 34.95 35.51 3h8r s ARG 254 CO 0.26 -0.15 0.23 0.21 0.02 0.00 0.00 175.30 175.86 3h8r s LYS 255 N -3.92 2.84 -0.09 3.54 2.47 -1.26 -1.33 119.74 121.99 3h8r s LYS 255 Ca 0.08 -1.08 -0.02 0.00 -1.56 0.00 0.00 55.97 53.38 3h8r s LYS 255 Cb 0.07 -3.78 -0.03 0.00 -1.46 0.00 0.00 37.83 32.62 3h8r s LYS 255 CO -0.09 -0.72 0.01 0.42 0.16 0.00 0.00 175.35 175.13 3h8r s ILE 256 N 1.57 4.39 0.08 5.43 -1.09 -1.26 -1.74 121.20 128.59 3h8r s ILE 256 Ca 0.02 -0.22 -0.24 0.00 -2.23 0.00 0.00 60.65 57.99 3h8r s ILE 256 Cb -0.19 -2.85 -0.06 0.00 -1.58 0.00 0.00 42.46 37.77 3h8r s ILE 256 CO 0.07 0.60 0.72 -0.76 -1.23 0.00 0.00 174.94 174.34 3h8r s LEU 257 N -0.86 4.51 0.00 2.97 1.43 0.92 -4.87 118.68 122.78 3h8r s LEU 257 Ca 0.13 1.45 0.19 0.00 -1.03 0.00 0.00 54.13 54.87 3h8r s LEU 257 Cb -0.11 -3.16 1.11 0.00 0.03 0.00 0.00 46.19 44.05 3h8r s LEU 257 CO 0.02 0.13 1.51 -0.11 0.23 0.00 0.00 176.35 178.13