#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2r1f s PHE 82 N 0.00 3.61 -0.28 1.57 5.36 -1.26 -4.53 117.98 122.45 2r1f s PHE 82 Ca 0.00 1.08 -0.05 0.00 -0.96 0.00 0.00 56.93 57.00 2r1f s PHE 82 Cb 0.00 -2.58 0.02 0.00 -0.34 0.00 0.00 43.02 40.12 2r1f s PHE 82 CO 0.00 0.28 0.03 0.15 -1.46 0.00 0.00 175.22 174.22 2r1f s LYS 83 N 0.13 2.89 0.46 10.12 1.02 -0.51 -5.01 119.74 128.85 2r1f s LYS 83 Ca 0.29 -0.97 -0.24 0.00 0.02 0.00 0.00 55.97 55.07 2r1f s LYS 83 Cb -0.17 -3.24 -0.07 0.00 -0.52 0.00 0.00 37.83 33.83 2r1f s LYS 83 CO 0.15 -0.47 1.32 0.00 -0.92 0.00 0.00 175.35 175.43 2r1f s ALA 84 N 1.41 3.09 0.00 5.17 0.00 -1.26 -4.75 121.76 125.41 2r1f s ALA 84 Ca 0.01 1.26 0.00 0.00 0.00 0.00 0.00 51.96 53.23 2r1f s ALA 84 Cb -0.17 -3.51 0.00 0.00 0.00 0.00 0.00 23.12 19.43 2r1f s ALA 84 CO -0.00 -1.03 0.00 0.41 0.00 0.00 0.00 175.76 175.14 2r1f n GLY 85 N 0.63 -2.03 3.37 0.00 0.00 -1.26 -5.03 105.19 100.88 2r1f n GLY 85 Ca 0.06 -1.21 -0.43 0.00 0.00 0.00 0.00 46.02 44.45 2r1f n GLY 85 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2r1f s THR 86 N -2.44 4.98 0.29 2.61 2.01 -1.26 -5.06 115.64 116.77 2r1f s THR 86 Ca 0.00 -1.06 0.11 0.00 0.31 0.00 0.00 61.69 61.05 2r1f s THR 86 Cb 0.00 -3.94 -0.05 0.00 0.01 0.00 0.00 72.50 68.52 2r1f s THR 86 CO 0.00 -0.50 -0.11 -0.31 -0.69 0.00 0.00 174.62 173.01 2r1f s TYR 87 N 1.60 2.43 -0.13 4.92 1.51 -1.26 0.22 117.35 126.64 2r1f s TYR 87 Ca 0.04 -0.34 -0.02 0.00 -1.01 0.00 0.00 57.07 55.73 2r1f s TYR 87 Cb -0.23 -1.16 -0.03 0.00 -0.11 0.00 0.00 41.96 40.44 2r1f s TYR 87 CO 0.06 0.64 -0.05 -0.98 -1.11 0.00 0.00 175.55 174.11 2r1f s ARG 88 N -3.59 3.43 -0.27 -0.62 1.70 -1.26 -4.93 118.95 113.40 2r1f s ARG 88 Ca 0.31 -0.54 -0.05 0.00 -0.47 0.00 0.00 55.73 54.98 2r1f s ARG 88 Cb -0.04 -2.81 0.01 0.00 -0.57 0.00 0.00 34.95 31.54 2r1f s ARG 88 CO 0.17 0.35 0.03 -0.06 -1.08 0.00 0.00 175.30 174.70 2r1f s PHE 89 N 0.07 3.10 0.54 5.89 0.40 -1.26 -5.11 117.98 121.62 2r1f s PHE 89 Ca -0.01 -1.10 -0.17 0.00 -0.60 0.00 0.00 56.93 55.05 2r1f s PHE 89 Cb -0.14 -2.19 -0.06 0.00 0.51 0.00 0.00 43.02 41.15 2r1f s PHE 89 CO 0.03 -0.60 1.03 0.95 0.70 0.00 0.00 175.22 177.33 2r1f s THR 90 N 1.46 3.95 0.31 0.64 -4.23 -1.26 -4.98 115.64 111.52 2r1f s THR 90 Ca 0.02 1.02 -0.00 0.00 -1.18 0.00 0.00 61.69 61.55 2r1f s THR 90 Cb -0.17 -3.47 0.27 0.00 1.34 0.00 0.00 72.50 70.47 2r1f s THR 90 CO 0.00 -0.46 1.95 1.55 -0.54 0.00 0.00 174.62 177.12 2r1f h PRO 91 N 0.89 1.02 -4.76 3.99 0.13 -2.09 -3.47 132.00 127.72 2r1f h PRO 91 Ca -0.48 -0.06 -0.67 0.00 -0.87 0.00 0.00 66.00 63.92 2r1f h PRO 91 Cb 1.21 -0.23 -0.21 0.00 0.13 0.00 0.00 31.00 31.90 2r1f h PRO 91 CO 0.59 0.68 -0.53 -1.14 -0.23 0.00 0.00 178.00 177.36 2r1f s GLN 92 N -5.90 3.40 0.04 0.86 2.00 -1.26 -5.21 119.66 113.59 2r1f s GLN 92 Ca -0.11 -0.69 -0.01 0.00 -2.00 0.00 0.00 55.36 52.55 2r1f s GLN 92 Cb 0.19 -3.65 -0.03 0.00 0.80 0.00 0.00 33.01 30.32 2r1f s GLN 92 CO 0.79 -0.42 -0.02 0.95 -0.50 0.00 0.00 175.29 176.10 2r1f s THR 94 N 1.65 0.18 0.37 -0.34 -4.23 -1.26 -5.14 115.64 106.87 2r1f s THR 94 Ca 0.05 -1.47 0.08 0.00 -1.18 0.00 0.00 61.69 59.18 2r1f s THR 94 Cb -0.17 -1.09 0.14 0.00 1.34 0.00 0.00 72.50 72.73 2r1f s THR 94 CO 0.08 -0.81 1.88 0.58 -0.54 0.00 0.00 174.62 175.81 2r1f h VAL 95 N 3.63 1.20 -0.52 2.29 2.07 -2.04 -1.94 116.25 120.94 2r1f h VAL 95 Ca -0.33 -0.86 0.11 0.00 0.82 0.00 0.00 66.70 66.43 2r1f h VAL 95 Cb 1.17 1.22 -0.09 0.00 -1.52 0.00 0.00 31.29 32.06 2r1f h VAL 95 CO 0.57 0.27 -0.06 -0.09 0.02 0.00 0.00 177.57 178.29 2r1f h ARG 96 N 0.27 0.06 -1.22 1.57 9.65 -2.05 -1.35 114.38 121.30 2r1f h ARG 96 Ca 0.05 -0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.93 2r1f h ARG 96 Cb 0.42 -0.01 0.00 0.00 -1.39 0.00 0.00 29.97 28.98 2r1f h ARG 96 CO 0.02 0.04 0.00 0.39 2.80 0.00 0.00 179.97 183.22 2r1f n GLU 97 N -5.30 0.61 0.00 0.20 1.02 -0.73 -2.77 120.64 113.67 2r1f n GLU 97 Ca 0.06 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.20 2r1f n GLU 97 Cb 0.29 -1.22 0.00 0.00 -0.02 0.00 0.00 31.44 30.49 2r1f n GLU 97 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2r1f n LEU 99 N 0.59 0.00 -0.12 -4.62 7.99 -0.51 -0.98 117.00 119.35 2r1f n LEU 99 Ca 0.00 0.00 -0.10 0.00 -0.01 0.00 0.00 56.01 55.90 2r1f n LEU 99 Cb 0.27 0.00 -0.02 0.00 -0.11 0.00 0.00 43.42 43.56 2r1f n LEU 99 CO 0.00 0.00 0.83 0.50 -1.51 0.00 0.00 177.39 177.21 2r1f h LYS 100 N 0.00 0.59 -0.54 3.23 3.64 -1.77 -3.06 116.57 118.65 2r1f h LYS 100 Ca 0.00 -0.16 -0.02 0.00 -1.27 0.00 0.00 60.65 59.20 2r1f h LYS 100 Cb 0.00 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.73 2r1f h LYS 100 CO 0.00 0.65 0.25 1.25 -2.27 0.00 0.00 179.45 179.33 2r1f h LEU 101 N 0.43 0.72 -0.40 5.20 6.46 -1.36 -2.35 115.31 124.02 2r1f h LEU 101 Ca 0.11 -0.14 0.00 0.00 -0.12 0.00 0.00 57.88 57.72 2r1f h LEU 101 Cb 0.35 -0.19 0.00 0.00 -0.73 0.00 0.00 40.66 40.09 2r1f h LEU 101 CO 0.01 0.67 0.00 0.18 -0.62 0.00 0.00 178.44 178.67 2r1f n LEU 102 N -4.55 0.61 -0.07 2.25 4.32 -1.19 -2.46 117.00 115.92 2r1f n LEU 102 Ca 0.03 0.62 -0.12 0.00 -0.02 0.00 0.00 56.01 56.51 2r1f n LEU 102 Cb 0.13 -0.49 -0.14 0.00 -1.62 0.00 0.00 43.42 41.30 2r1f n LEU 102 CO 0.38 -0.39 -0.96 -0.62 -1.22 0.00 0.00 177.39 174.58 2r1f n GLU 103 N -2.14 0.67 0.11 3.23 1.02 -1.16 -1.43 120.64 120.95 2r1f n GLU 103 Ca 0.03 0.14 0.03 0.00 -0.02 0.00 0.00 57.16 57.35 2r1f n GLU 103 Cb 0.29 -1.63 0.42 0.00 -0.02 0.00 0.00 31.44 30.50 2r1f n GLU 103 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2r1f h SER 104 N 0.01 0.24 0.00 1.62 4.64 -1.09 -3.40 113.55 115.57 2r1f h SER 104 Ca -0.46 -0.04 0.00 0.00 -0.47 0.00 0.00 61.79 60.82 2r1f h SER 104 Cb 2.09 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 64.12 2r1f h SER 104 CO 0.03 0.35 0.00 0.61 -0.87 0.00 0.00 176.83 176.95 2r1f n GLY 105 N -1.01 0.82 3.42 -0.77 0.00 -1.24 -4.94 105.19 101.47 2r1f n GLY 105 Ca -0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 2r1f n GLY 105 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2r1f n LYS 106 N -2.14 2.22 -1.53 1.61 5.02 -1.26 -4.95 118.16 117.13 2r1f n LYS 106 Ca 0.00 -2.65 -0.30 0.00 -2.02 0.00 0.00 58.31 53.34 2r1f n LYS 106 Cb 0.01 -3.49 0.21 0.00 -0.02 0.00 0.00 35.03 31.74 2r1f n LYS 106 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 2r1f s GLU 107 N 5.20 -0.15 0.10 1.97 2.02 -1.26 -4.87 118.70 121.70 2r1f s GLU 107 Ca 0.60 -0.22 -0.30 0.00 0.02 0.00 0.00 54.97 55.07 2r1f s GLU 107 Cb 0.05 -1.74 -0.06 0.00 0.10 0.00 0.00 34.13 32.48 2r1f s GLU 107 CO 0.09 -2.97 1.19 0.00 0.02 0.00 0.00 175.26 173.59 2r1f s ALA 108 N -3.46 3.40 -0.08 5.21 0.00 0.13 -4.97 121.76 121.99 2r1f s ALA 108 Ca 0.72 0.86 -0.12 0.00 0.00 0.00 0.00 51.96 53.42 2r1f s ALA 108 Cb -0.07 -3.43 -0.05 0.00 0.00 0.00 0.00 23.12 19.57 2r1f s ALA 108 CO 0.54 -0.40 0.30 -0.65 0.00 0.00 0.00 175.76 175.55 2r1f s GLN 109 N 0.66 3.86 -0.09 0.00 -1.52 -1.26 -4.33 119.66 116.99 2r1f s GLN 109 Ca 0.57 0.16 0.01 0.00 -1.95 0.00 0.00 55.36 54.15 2r1f s GLN 109 Cb -0.30 -3.27 -0.02 0.00 -0.22 0.00 0.00 33.01 29.20 2r1f s GLN 109 CO 0.31 0.60 -0.12 -0.06 -0.25 0.00 0.00 175.29 175.77 2r1f s PHE 110 N -0.64 2.81 0.16 0.91 0.08 0.49 -4.90 117.98 116.89 2r1f s PHE 110 Ca 0.19 -0.31 -0.18 0.00 0.12 0.00 0.00 56.93 56.75 2r1f s PHE 110 Cb -0.14 -1.75 -0.07 0.00 -0.57 0.00 0.00 43.02 40.49 2r1f s PHE 110 CO 0.08 0.05 0.63 -1.25 -0.10 0.00 0.00 175.22 174.63 2r1f s PRO 111 N -0.26 4.15 -0.17 0.24 0.04 -1.26 -1.24 135.00 136.49 2r1f s PRO 111 Ca 0.02 0.71 -0.05 0.00 0.04 0.00 0.00 61.00 61.72 2r1f s PRO 111 Cb -0.13 -2.99 0.06 0.00 0.04 0.00 0.00 34.50 31.48 2r1f s PRO 111 CO 0.03 0.49 0.09 -1.17 0.04 0.00 0.00 177.00 176.47 2r1f s LEU 112 N -1.75 0.40 -0.49 -3.56 2.96 -0.21 -4.97 118.68 111.06 2r1f s LEU 112 Ca 0.38 -0.62 -0.23 0.00 -0.22 0.00 0.00 54.13 53.44 2r1f s LEU 112 Cb -0.17 -0.26 0.03 0.00 0.50 0.00 0.00 46.19 46.29 2r1f s LEU 112 CO 0.20 -0.35 0.80 -0.13 -1.32 0.00 0.00 176.35 175.56 2r1f s ARG 113 N 2.12 3.34 -0.35 1.98 0.52 -1.26 -0.26 118.95 125.03 2r1f s ARG 113 Ca 0.02 -0.27 -0.17 0.00 -0.52 0.00 0.00 55.73 54.79 2r1f s ARG 113 Cb -0.16 -4.00 -0.00 0.00 0.52 0.00 0.00 34.95 31.31 2r1f s ARG 113 CO -0.09 -1.24 0.44 -0.51 0.02 0.00 0.00 175.30 173.92 2r1f s LEU 114 N 3.38 4.43 -0.02 2.53 1.43 -0.27 -4.98 118.68 125.19 2r1f s LEU 114 Ca 0.28 -0.18 -0.15 0.00 -1.03 0.00 0.00 54.13 53.05 2r1f s LEU 114 Cb -0.13 -2.46 -0.06 0.00 0.03 0.00 0.00 46.19 43.57 2r1f s LEU 114 CO 0.20 -0.43 0.40 -0.69 0.23 0.00 0.00 176.35 176.06 2r1f s VAL 115 N 2.21 5.06 0.36 -1.59 1.01 -1.26 -1.98 120.40 124.21 2r1f s VAL 115 Ca 0.15 0.82 -0.28 0.00 0.00 0.00 0.00 61.98 62.67 2r1f s VAL 115 Cb -0.16 -3.71 -0.11 0.00 0.00 0.00 0.00 36.38 32.41 2r1f s VAL 115 CO 0.13 0.56 1.41 -1.83 0.00 0.00 0.00 175.10 175.36 2r1f s GLU 116 N -0.93 4.22 0.00 2.72 -1.05 -1.26 -4.84 118.70 117.56 2r1f s GLU 116 Ca 0.23 2.41 0.00 0.00 -0.15 0.00 0.00 54.97 57.47 2r1f s GLU 116 Cb -0.16 -3.01 0.00 0.00 -0.44 0.00 0.00 34.13 30.51 2r1f s GLU 116 CO 0.13 -0.38 0.00 0.41 0.95 0.00 0.00 175.26 176.37 2r1f n GLY 117 N 0.61 0.67 3.49 -3.83 0.00 0.24 -4.95 105.19 101.41 2r1f n GLY 117 Ca 0.01 -0.08 -0.23 0.00 0.00 0.00 0.00 46.02 45.71 2r1f n GLY 117 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2r1f s ARG 119 N -0.07 1.69 0.34 1.61 0.52 -1.26 -4.53 118.95 117.25 2r1f s ARG 119 Ca 0.00 -1.88 0.02 0.00 -0.52 0.00 0.00 55.73 53.35 2r1f s ARG 119 Cb 0.00 -1.32 0.62 0.00 0.52 0.00 0.00 34.95 34.77 2r1f s ARG 119 CO 0.00 0.02 1.99 1.25 0.02 0.00 0.00 175.30 178.58 2r1f h LEU 120 N 2.12 0.76 -1.77 2.53 5.85 -1.94 -2.19 115.31 120.67 2r1f h LEU 120 Ca -0.41 -0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.30 2r1f h LEU 120 Cb 1.24 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 42.08 2r1f h LEU 120 CO 0.70 0.54 0.13 0.77 -0.34 0.00 0.00 178.44 180.24 2r1f h SER 121 N 0.89 0.25 -0.51 1.25 4.64 -1.99 0.13 113.55 118.21 2r1f h SER 121 Ca 0.27 -0.01 -0.12 0.00 -0.47 0.00 0.00 61.79 61.46 2r1f h SER 121 Cb -0.00 -0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 62.01 2r1f h SER 121 CO -0.07 0.19 -0.17 0.44 -0.87 0.00 0.00 176.83 176.35 2r1f h ASP 122 N 0.29 1.04 -0.49 4.97 3.32 -1.84 -2.32 116.42 121.38 2r1f h ASP 122 Ca 0.08 -0.38 -0.13 0.00 0.02 0.00 0.00 57.03 56.62 2r1f h ASP 122 Cb -0.02 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.24 2r1f h ASP 122 CO -0.02 1.17 -0.19 1.88 -1.72 0.00 0.00 179.24 180.37 2r1f h TYR 123 N 0.89 1.14 -0.77 4.55 0.05 -1.02 -2.43 116.97 119.36 2r1f h TYR 123 Ca 0.12 -0.27 -0.02 0.00 0.05 0.00 0.00 58.73 58.61 2r1f h TYR 123 Cb 0.74 -0.27 -0.04 0.00 1.01 0.00 0.00 36.73 38.18 2r1f h TYR 123 CO 0.05 1.09 0.39 -0.07 -1.05 0.00 0.00 178.16 178.57 2r1f h LEU 124 N 0.85 0.99 -0.73 3.88 3.38 -0.72 -1.06 115.31 121.91 2r1f h LEU 124 Ca 0.11 -0.10 -0.06 0.00 0.09 0.00 0.00 57.88 57.92 2r1f h LEU 124 Cb 0.77 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.24 2r1f h LEU 124 CO 0.06 0.83 0.23 0.50 0.09 0.00 0.00 178.44 180.15 2r1f h LYS 125 N 1.09 1.13 -0.32 1.13 3.64 -1.33 -2.51 116.57 119.40 2r1f h LYS 125 Ca 0.27 -0.24 -0.05 0.00 -1.27 0.00 0.00 60.65 59.35 2r1f h LYS 125 Cb 0.09 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 31.73 2r1f h LYS 125 CO -0.04 0.96 -0.04 1.96 -2.27 0.00 0.00 179.45 180.03 2r1f h GLN 126 N 1.07 0.50 -0.08 1.90 4.20 -0.86 -2.53 115.11 119.31 2r1f h GLN 126 Ca 0.23 -0.12 -0.13 0.00 0.06 0.00 0.00 58.65 58.70 2r1f h GLN 126 Cb 0.30 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.00 2r1f h GLN 126 CO -0.01 0.56 -0.55 -0.07 -0.67 0.00 0.00 178.83 178.09 2r1f h LEU 127 N 0.48 0.25 -1.33 1.46 3.38 -0.97 -1.91 115.31 116.66 2r1f h LEU 127 Ca 0.10 -0.13 -0.06 0.00 0.09 0.00 0.00 57.88 57.88 2r1f h LEU 127 Cb 0.37 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 2r1f h LEU 127 CO 0.02 0.75 -0.26 0.03 0.09 0.00 0.00 178.44 179.06 2r1f h ARG 128 N 0.18 0.00 -0.02 1.13 2.47 -1.04 -3.15 114.38 113.94 2r1f h ARG 128 Ca 0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 2r1f h ARG 128 Cb 1.02 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.34 2r1f h ARG 128 CO 0.08 0.26 -0.07 0.39 0.56 0.00 0.00 179.97 181.20 2r1f n GLU 129 N -3.63 1.49 -2.86 0.04 1.02 -1.04 -4.99 120.64 110.67 2r1f n GLU 129 Ca -0.01 -1.41 -0.40 0.00 -0.02 0.00 0.00 57.16 55.31 2r1f n GLU 129 Cb 0.39 -1.33 -0.05 0.00 -0.02 0.00 0.00 31.44 30.43 2r1f n GLU 129 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2r1f s ALA 130 N -1.56 3.32 0.33 0.62 0.00 -0.73 -5.03 121.76 118.71 2r1f s ALA 130 Ca 0.19 0.44 -0.29 0.00 0.00 0.00 0.00 51.96 52.30 2r1f s ALA 130 Cb 0.14 -3.13 -0.10 0.00 0.00 0.00 0.00 23.12 20.04 2r1f s ALA 130 CO 0.26 0.06 1.32 -1.25 0.00 0.00 0.00 175.76 176.15 2r1f s PRO 131 N -0.24 4.34 -1.52 0.00 0.04 -1.26 -3.62 135.00 132.74 2r1f s PRO 131 Ca 0.42 2.24 0.00 0.00 0.04 0.00 0.00 61.00 63.70 2r1f s PRO 131 Cb -0.22 -3.07 0.00 0.00 0.04 0.00 0.00 34.50 31.25 2r1f s PRO 131 CO 0.27 -0.21 0.00 0.66 0.04 0.00 0.00 177.00 177.75 2r1f n TYR 132 N 0.85 -0.64 -3.51 0.56 4.02 -1.26 -4.95 117.16 112.23 2r1f n TYR 132 Ca 0.00 0.00 -0.37 0.00 -0.01 0.00 0.00 57.90 57.52 2r1f n TYR 132 Cb 0.42 -3.31 -0.08 0.00 -0.02 0.00 0.00 39.34 36.35 2r1f n TYR 132 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 2r1f s ILE 133 N -2.80 5.28 -0.41 -0.72 -1.09 -1.24 -0.96 121.20 119.26 2r1f s ILE 133 Ca 0.00 0.54 -0.29 0.00 -2.23 0.00 0.00 60.65 58.67 2r1f s ILE 133 Cb 0.00 -3.64 0.02 0.00 -1.58 0.00 0.00 42.46 37.26 2r1f s ILE 133 CO 0.00 0.34 1.10 -0.75 -1.23 0.00 0.00 174.94 174.40 2r1f s LYS 134 N 0.85 3.85 -0.67 2.79 2.20 -0.68 -4.92 119.74 123.16 2r1f s LYS 134 Ca 0.16 0.74 -0.23 0.00 -0.36 0.00 0.00 55.97 56.27 2r1f s LYS 134 Cb -0.14 -3.84 0.06 0.00 -1.51 0.00 0.00 37.83 32.40 2r1f s LYS 134 CO 0.05 -1.18 1.02 -1.01 -0.36 0.00 0.00 175.35 173.86 2r1f s HIS 135 N 4.10 2.61 -0.05 4.03 3.76 -1.26 -1.63 115.29 126.85 2r1f s HIS 135 Ca 0.46 -0.43 0.18 0.00 -0.15 0.00 0.00 55.06 55.12 2r1f s HIS 135 Cb -0.09 -4.34 -0.28 0.00 1.11 0.00 0.00 32.58 28.98 2r1f s HIS 135 CO 0.25 -1.70 0.35 0.25 -0.85 0.00 0.00 174.74 173.03 2r1f n THR 136 N 6.02 0.23 -2.05 1.30 -2.24 -1.26 -4.95 114.28 111.33 2r1f n THR 136 Ca -0.02 -0.49 -0.42 0.00 -2.27 0.00 0.00 64.05 60.84 2r1f n THR 136 Cb 0.46 -0.05 -0.03 0.00 -2.10 0.00 0.00 70.33 68.62 2r1f n THR 136 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2r1f s LEU 137 N -4.50 4.35 0.23 3.22 1.43 -1.26 -4.92 118.68 117.22 2r1f s LEU 137 Ca -0.07 2.34 -0.07 0.00 -1.03 0.00 0.00 54.13 55.30 2r1f s LEU 137 Cb 0.11 -3.56 0.20 0.00 0.03 0.00 0.00 46.19 42.97 2r1f s LEU 137 CO 0.77 -0.81 1.85 0.77 0.23 0.00 0.00 176.35 179.16 2r1f h SER 138 N 8.01 1.12 -5.29 2.29 4.64 -1.95 -3.45 113.55 118.92 2r1f h SER 138 Ca -0.41 -0.10 -0.11 0.00 -0.47 0.00 0.00 61.79 60.70 2r1f h SER 138 Cb 1.19 -0.28 -0.08 0.00 -0.31 0.00 0.00 62.40 62.92 2r1f h SER 138 CO 0.92 0.90 -0.10 1.51 -0.87 0.00 0.00 176.83 179.18 2r1f s ASP 139 N -6.22 0.16 -0.20 4.97 1.47 -1.26 -5.06 116.67 110.53 2r1f s ASP 139 Ca -0.13 -1.09 0.12 0.00 1.18 0.00 0.00 52.55 52.63 2r1f s ASP 139 Cb 0.17 0.63 0.69 0.00 -0.34 0.00 0.00 42.92 44.07 2r1f s ASP 139 CO 0.83 -1.23 1.56 0.47 0.68 0.00 0.00 175.17 177.47 2r1f n ASP 140 N -0.73 4.98 -4.76 2.11 8.00 -1.26 -4.66 116.55 120.22 2r1f n ASP 140 Ca -0.02 -2.77 -0.39 0.00 0.71 0.00 0.00 54.79 52.33 2r1f n ASP 140 Cb 0.62 -0.65 0.01 0.00 -0.02 0.00 0.00 41.12 41.07 2r1f n ASP 140 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 2r1f s LYS 141 N -2.46 3.69 0.44 -1.24 1.02 -1.26 -4.91 119.74 115.03 2r1f s LYS 141 Ca 0.46 2.20 0.16 0.00 0.02 0.00 0.00 55.97 58.81 2r1f s LYS 141 Cb 0.35 -2.58 1.01 0.00 -0.52 0.00 0.00 37.83 36.09 2r1f s LYS 141 CO 0.14 -0.73 1.98 1.88 -0.92 0.00 0.00 175.35 177.69 2r1f h TYR 142 N 2.25 0.00 -0.14 3.18 -1.99 -1.99 -1.93 116.97 116.34 2r1f h TYR 142 Ca -0.50 0.00 -0.11 0.00 2.00 0.00 0.00 58.73 60.12 2r1f h TYR 142 Cb 1.26 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.98 2r1f h TYR 142 CO 0.51 0.20 -0.39 0.00 -0.00 0.00 0.00 178.16 178.48 2r1f h ALA 143 N 1.80 1.06 -0.04 3.88 0.00 -1.91 0.06 119.26 124.11 2r1f h ALA 143 Ca -0.00 -0.41 -0.01 0.00 0.00 0.00 0.00 54.91 54.49 2r1f h ALA 143 Cb 0.38 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 2r1f h ALA 143 CO 0.03 0.60 0.00 1.15 0.00 0.00 0.00 179.25 181.03 2r1f h THR 144 N 0.27 1.23 -0.74 0.00 2.02 -1.68 -2.05 112.91 111.95 2r1f h THR 144 Ca 0.03 -0.68 -0.02 0.00 0.77 0.00 0.00 66.41 66.51 2r1f h THR 144 Cb 0.82 1.61 -0.03 0.00 -1.74 0.00 0.00 68.15 68.81 2r1f h THR 144 CO 0.07 0.18 0.40 0.58 0.37 0.00 0.00 175.52 177.11 2r1f h VAL 145 N -0.20 1.23 -0.60 3.16 2.07 -1.33 -0.96 116.25 119.61 2r1f h VAL 145 Ca 0.01 -0.59 -0.04 0.00 0.82 0.00 0.00 66.70 66.90 2r1f h VAL 145 Cb 0.29 0.26 -0.03 0.00 -1.52 0.00 0.00 31.29 30.29 2r1f h VAL 145 CO 0.00 0.26 0.21 0.00 0.02 0.00 0.00 177.57 178.05 2r1f h ALA 146 N 1.20 1.24 -0.21 1.67 0.00 -0.96 -1.15 119.26 121.05 2r1f h ALA 146 Ca 0.26 -0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 2r1f h ALA 146 Cb 0.06 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.60 2r1f h ALA 146 CO -0.04 0.55 -0.13 0.37 0.00 0.00 0.00 179.25 179.99 2r1f h GLN 147 N 0.87 0.46 -0.27 0.00 5.75 -0.94 -1.76 115.11 119.21 2r1f h GLN 147 Ca 0.20 -0.21 -0.07 0.00 -0.15 0.00 0.00 58.65 58.41 2r1f h GLN 147 Cb 0.22 -0.01 -0.02 0.00 1.07 0.00 0.00 27.48 28.75 2r1f h GLN 147 CO -0.01 0.76 -0.14 0.00 -2.65 0.00 0.00 178.83 176.79 2r1f h ALA 148 N 0.68 1.26 0.00 3.38 0.00 -1.03 -2.36 119.26 121.20 2r1f h ALA 148 Ca 0.04 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2r1f h ALA 148 Cb 0.64 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.31 2r1f h ALA 148 CO 0.04 0.49 -0.27 1.28 0.00 0.00 0.00 179.25 180.78 2r1f n LEU 149 N -4.20 0.48 -3.48 0.00 4.77 -0.45 -4.98 117.00 109.14 2r1f n LEU 149 Ca 0.00 0.33 -0.21 0.00 -0.03 0.00 0.00 56.01 56.11 2r1f n LEU 149 Cb 0.33 -0.32 0.06 0.00 -2.33 0.00 0.00 43.42 41.15 2r1f n LEU 149 CO 0.40 -0.03 -0.01 -0.62 -1.33 0.00 0.00 177.39 175.81 2r1f n GLU 150 N -1.83 -3.22 -2.70 3.23 1.02 -0.70 -4.99 120.64 111.46 2r1f n GLU 150 Ca 0.05 0.71 -0.36 0.00 -0.02 0.00 0.00 57.16 57.55 2r1f n GLU 150 Cb 0.38 -5.28 -0.06 0.00 -0.02 0.00 0.00 31.44 26.47 2r1f n GLU 150 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2r1f s LEU 151 N -6.08 4.14 0.04 -4.62 1.43 -0.98 -4.99 118.68 107.61 2r1f s LEU 151 Ca 0.29 1.87 -0.27 0.00 -1.03 0.00 0.00 54.13 55.00 2r1f s LEU 151 Cb -0.06 -4.24 -0.17 0.00 0.03 0.00 0.00 46.19 41.74 2r1f s LEU 151 CO 0.78 -0.33 1.42 -0.33 0.23 0.00 0.00 176.35 178.13 2r1f h GLU 152 N 2.52 -0.42 -4.43 1.70 3.07 -1.94 -3.38 114.58 111.71 2r1f h GLU 152 Ca -0.48 0.03 -0.71 0.00 -0.50 0.00 0.00 59.36 57.69 2r1f h GLU 152 Cb 1.20 0.09 -0.30 0.00 -0.84 0.00 0.00 28.75 28.91 2r1f h GLU 152 CO 0.63 -0.15 -0.47 1.21 -1.40 0.00 0.00 179.01 178.83 2r1f s ASN 153 N -4.97 5.56 0.00 1.42 3.84 -1.26 -4.97 114.94 114.56 2r1f s ASN 153 Ca -0.15 -1.70 0.11 0.00 0.21 0.00 0.00 52.86 51.34 2r1f s ASN 153 Cb 0.03 -1.96 0.52 0.00 -0.55 0.00 0.00 41.25 39.29 2r1f s ASN 153 CO 0.59 -0.57 1.32 -2.65 -2.79 0.00 0.00 177.10 173.00 2r1f n PRO 154 N 4.85 0.07 0.01 0.43 -0.02 -1.26 -2.00 135.00 137.08 2r1f n PRO 154 Ca -0.08 0.26 0.11 0.00 -2.02 0.00 0.00 63.50 61.77 2r1f n PRO 154 Cb 0.42 -1.50 0.12 0.00 -0.02 0.00 0.00 33.50 32.52 2r1f n PRO 154 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2r1f n GLU 155 N -1.41 0.11 -2.98 -0.52 -0.58 -1.26 -4.40 120.64 109.60 2r1f n GLU 155 Ca 0.04 0.01 -0.44 0.00 -0.42 0.00 0.00 57.16 56.35 2r1f n GLU 155 Cb 0.11 -1.55 0.00 0.00 -0.57 0.00 0.00 31.44 29.44 2r1f n GLU 155 CO 0.00 0.00 0.00 0.91 -0.48 0.00 0.00 177.13 177.56 2r1f n TRP 156 N -1.69 4.09 0.03 -0.32 7.02 -0.85 -4.68 117.44 121.04 2r1f n TRP 156 Ca 0.04 -3.26 0.00 0.00 -1.02 0.00 0.00 57.50 53.26 2r1f n TRP 156 Cb 0.37 -1.77 0.00 0.00 -2.42 0.00 0.00 31.31 27.49 2r1f n TRP 156 CO 0.00 0.00 0.00 1.51 -2.02 0.00 0.00 177.69 177.18 2r1f n ILE 157 N 2.98 0.49 -1.92 -0.99 3.06 -1.26 -4.90 119.36 116.81 2r1f n ILE 157 Ca 0.31 0.16 -0.42 0.00 -2.50 0.00 0.00 62.75 60.30 2r1f n ILE 157 Cb 0.38 -1.40 -0.03 0.00 0.54 0.00 0.00 39.64 39.13 2r1f n ILE 157 CO 0.00 0.00 0.00 -0.70 -2.50 0.00 0.00 176.55 173.35 2r1f s GLU 158 N -2.00 4.21 0.00 9.51 2.56 -1.26 -2.24 118.70 129.48 2r1f s GLU 158 Ca 0.00 2.38 0.00 0.00 0.00 0.00 0.00 54.97 57.35 2r1f s GLU 158 Cb 0.00 -3.15 0.00 0.00 2.00 0.00 0.00 34.13 32.98 2r1f s GLU 158 CO 0.00 -0.61 0.00 0.41 -0.56 0.00 0.00 175.26 174.50 2r1f n GLY 159 N 3.73 0.84 2.37 -1.50 0.00 -1.25 -4.13 105.19 105.25 2r1f n GLY 159 Ca 0.14 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.81 2r1f n GLY 159 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2r1f n TRP 160 N -2.00 3.16 -3.86 1.61 7.02 -0.95 -4.54 117.44 117.88 2r1f n TRP 160 Ca 0.00 -2.88 -0.16 0.00 -1.02 0.00 0.00 57.50 53.44 2r1f n TRP 160 Cb 0.00 -1.30 -0.16 0.00 -2.42 0.00 0.00 31.31 27.43 2r1f n TRP 160 CO 0.00 0.00 0.00 -0.06 -2.02 0.00 0.00 177.69 175.61 2r1f s PHE 161 N -3.83 0.21 -0.06 -5.99 0.40 -1.26 -4.17 117.98 103.27 2r1f s PHE 161 Ca 0.62 0.05 -0.30 0.00 -0.60 0.00 0.00 56.93 56.70 2r1f s PHE 161 Cb 0.49 -0.35 -0.03 0.00 0.51 0.00 0.00 43.02 43.63 2r1f s PHE 161 CO -0.06 -0.12 1.26 -0.46 0.70 0.00 0.00 175.22 176.55 2r1f s TRP 162 N 1.09 3.04 -0.10 0.36 -0.11 -0.56 -4.86 118.94 117.80 2r1f s TRP 162 Ca -0.09 1.08 -0.25 0.00 1.22 0.00 0.00 56.10 58.06 2r1f s TRP 162 Cb -0.13 -3.50 -0.03 0.00 -1.50 0.00 0.00 33.47 28.32 2r1f s TRP 162 CO -0.02 -1.66 0.80 -1.25 -4.62 0.00 0.00 176.95 170.19 2r1f s PRO 163 N 2.49 4.40 0.20 5.86 0.04 -1.26 -4.89 135.00 141.84 2r1f s PRO 163 Ca 0.58 1.02 -0.22 0.00 0.04 0.00 0.00 61.00 62.42 2r1f s PRO 163 Cb -0.26 -3.50 0.07 0.00 0.04 0.00 0.00 34.50 30.85 2r1f s PRO 163 CO 0.22 -0.12 1.00 0.34 0.04 0.00 0.00 177.00 178.48 2r1f s ASP 164 N 0.99 -0.03 -0.50 6.66 -1.08 -0.83 -4.88 116.67 117.00 2r1f s ASP 164 Ca 0.40 -0.67 -0.25 0.00 -0.52 0.00 0.00 52.55 51.52 2r1f s ASP 164 Cb -0.18 0.53 0.03 0.00 -1.46 0.00 0.00 42.92 41.85 2r1f s ASP 164 CO 0.17 -1.04 0.93 -0.89 0.52 0.00 0.00 175.17 174.86 2r1f s THR 165 N -2.40 4.44 0.00 1.71 2.01 -1.26 -1.11 115.64 119.03 2r1f s THR 165 Ca 0.19 0.54 0.00 0.00 0.31 0.00 0.00 61.69 62.73 2r1f s THR 165 Cb -0.03 -4.47 0.00 0.00 0.01 0.00 0.00 72.50 68.01 2r1f s THR 165 CO 0.05 -0.94 0.00 0.79 -0.69 0.00 0.00 174.62 173.83 2r1f n TRP 166 N 7.27 -0.65 0.00 4.92 7.02 0.64 -4.86 117.44 131.78 2r1f n TRP 166 Ca 0.04 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.52 2r1f n TRP 166 Cb 0.48 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.37 2r1f n TRP 166 CO 0.00 0.00 0.00 2.48 -2.02 0.00 0.00 177.69 178.15 2r1f n TYR 168 N -0.26 0.00 -2.17 -5.99 0.18 -0.38 -1.05 117.16 107.50 2r1f n TYR 168 Ca 0.00 0.00 -0.31 0.00 1.88 0.00 0.00 57.90 59.47 2r1f n TYR 168 Cb 0.00 0.00 -0.01 0.00 -0.38 0.00 0.00 39.34 38.95 2r1f n TYR 168 CO 0.00 0.00 0.00 0.95 -2.08 0.00 0.00 176.86 175.73 2r1f s THR 169 N -1.56 4.67 0.56 -3.48 -4.23 -1.26 -0.38 115.64 109.95 2r1f s THR 169 Ca 0.00 0.93 -0.21 0.00 -1.18 0.00 0.00 61.69 61.23 2r1f s THR 169 Cb 0.00 -3.81 -0.04 0.00 1.34 0.00 0.00 72.50 69.99 2r1f s THR 169 CO 0.00 -0.93 1.33 0.00 -0.54 0.00 0.00 174.62 174.48 2r1f s ALA 170 N -2.90 2.76 0.00 3.99 0.00 -1.26 -2.82 121.76 121.53 2r1f s ALA 170 Ca 0.56 1.27 0.00 0.00 0.00 0.00 0.00 51.96 53.79 2r1f s ALA 170 Cb -0.11 -3.55 0.00 0.00 0.00 0.00 0.00 23.12 19.47 2r1f s ALA 170 CO 0.44 -1.34 0.00 -1.71 0.00 0.00 0.00 175.76 173.15 2r1f n ASN 171 N -1.13 -3.41 -4.75 0.00 5.15 -0.13 -4.93 115.26 106.06 2r1f n ASN 171 Ca 0.11 0.00 -0.41 0.00 -0.60 0.00 0.00 54.58 53.68 2r1f n ASN 171 Cb 0.46 -1.82 -0.02 0.00 -0.53 0.00 0.00 39.78 37.86 2r1f n ASN 171 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 2r1f s THR 172 N -1.74 2.46 0.62 -0.44 2.01 -1.13 -4.51 115.64 112.91 2r1f s THR 172 Ca 0.00 0.39 -0.14 0.00 0.31 0.00 0.00 61.69 62.25 2r1f s THR 172 Cb 0.00 -3.25 -0.02 0.00 0.01 0.00 0.00 72.50 69.23 2r1f s THR 172 CO 0.00 0.07 1.05 0.42 -0.69 0.00 0.00 174.62 175.47 2r1f s THR 173 N -0.13 3.95 0.20 -0.82 -4.23 -1.26 -1.69 115.64 111.67 2r1f s THR 173 Ca 0.59 0.82 -0.10 0.00 -1.18 0.00 0.00 61.69 61.82 2r1f s THR 173 Cb -0.44 -3.42 0.13 0.00 1.34 0.00 0.00 72.50 70.11 2r1f s THR 173 CO 0.46 -0.65 1.82 -2.24 -0.54 0.00 0.00 174.62 173.47 2r1f h ASP 174 N 0.07 0.58 -0.70 3.99 3.04 -1.66 -2.86 116.42 118.87 2r1f h ASP 174 Ca -0.46 0.02 0.01 0.00 -3.24 0.00 0.00 57.03 53.36 2r1f h ASP 174 Cb 1.21 -0.10 -0.03 0.00 -1.04 0.00 0.00 39.33 39.36 2r1f h ASP 174 CO 0.58 0.39 0.46 0.58 -2.04 0.00 0.00 179.24 179.21 2r1f h VAL 175 N 0.72 1.18 -0.14 4.15 2.07 -1.94 -2.18 116.25 120.11 2r1f h VAL 175 Ca 0.27 -0.33 -0.09 0.00 0.82 0.00 0.00 66.70 67.37 2r1f h VAL 175 Cb 0.11 0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.01 2r1f h VAL 175 CO -0.14 0.18 -0.30 0.00 0.02 0.00 0.00 177.57 177.33 2r1f h ALA 176 N 1.25 1.24 -0.13 1.67 0.00 -1.92 0.25 119.26 121.62 2r1f h ALA 176 Ca 0.26 -0.34 -0.21 0.00 0.00 0.00 0.00 54.91 54.62 2r1f h ALA 176 Cb -0.11 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 17.60 2r1f h ALA 176 CO -0.06 0.51 -0.75 1.25 0.00 0.00 0.00 179.25 180.21 2r1f h LEU 177 N 0.24 0.88 -0.98 0.00 5.85 -1.36 -2.64 115.31 117.31 2r1f h LEU 177 Ca 0.03 -0.64 -0.09 0.00 0.84 0.00 0.00 57.88 58.02 2r1f h LEU 177 Cb 0.65 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.41 2r1f h LEU 177 CO 0.05 1.38 -0.18 -0.07 -0.34 0.00 0.00 178.44 179.28 2r1f h LEU 178 N 0.44 0.53 -0.79 2.25 3.38 -1.18 -2.11 115.31 117.82 2r1f h LEU 178 Ca -0.06 -0.16 -0.05 0.00 0.09 0.00 0.00 57.88 57.70 2r1f h LEU 178 Cb 1.39 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.96 2r1f h LEU 178 CO 0.15 0.72 0.26 0.50 0.09 0.00 0.00 178.44 180.16 2r1f h LYS 179 N 0.48 1.16 -0.68 1.13 3.64 -0.96 0.24 116.57 121.58 2r1f h LYS 179 Ca 0.08 -0.23 -0.07 0.00 -1.27 0.00 0.00 60.65 59.16 2r1f h LYS 179 Cb 0.59 -0.17 -0.03 0.00 -0.41 0.00 0.00 32.23 32.21 2r1f h LYS 179 CO 0.04 0.97 0.15 0.00 -2.27 0.00 0.00 179.45 178.34 2r1f h ARG 180 N 1.12 1.10 -0.29 1.90 3.08 -1.25 -1.80 114.38 118.23 2r1f h ARG 180 Ca 0.25 -0.27 -0.08 0.00 0.07 0.00 0.00 59.98 59.95 2r1f h ARG 180 Cb 0.28 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.18 2r1f h ARG 180 CO -0.01 0.98 -0.13 0.00 -1.07 0.00 0.00 179.97 179.74 2r1f h ALA 181 N 1.07 0.41 -0.12 0.04 0.00 -0.86 -2.59 119.26 117.21 2r1f h ALA 181 Ca 0.21 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2r1f h ALA 181 Cb 0.39 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 2r1f h ALA 181 CO 0.00 0.29 0.08 1.25 0.00 0.00 0.00 179.25 180.87 2r1f h HIS 182 N 0.35 0.15 -0.79 0.00 -0.00 -0.51 -1.48 115.15 112.86 2r1f h HIS 182 Ca 0.07 0.00 -0.02 0.00 -0.00 0.00 0.00 60.37 60.42 2r1f h HIS 182 Cb 0.64 -0.05 -0.04 0.00 -0.00 0.00 0.00 27.41 27.97 2r1f h HIS 182 CO 0.06 0.09 0.42 0.87 -0.00 0.00 0.00 177.93 179.37 2r1f h LYS 183 N 0.16 1.12 -1.17 5.26 1.57 -1.32 -0.50 116.57 121.69 2r1f h LYS 183 Ca 0.04 -0.14 0.00 0.00 -1.87 0.00 0.00 60.65 58.68 2r1f h LYS 183 Cb -0.02 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 32.08 2r1f h LYS 183 CO -0.01 0.84 0.00 1.17 -0.57 0.00 0.00 179.45 180.88 2r1f n LYS 184 N -4.40 0.23 0.00 3.15 4.81 -0.98 -2.02 118.16 118.95 2r1f n LYS 184 Ca 0.07 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.51 2r1f n LYS 184 Cb 0.11 -1.28 0.00 0.00 0.02 0.00 0.00 35.03 33.88 2r1f n LYS 184 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 2r1f n VAL 186 N 0.69 0.00 -0.18 3.15 0.31 -0.20 -1.84 118.33 120.27 2r1f n VAL 186 Ca 0.00 0.00 -0.07 0.00 -0.01 0.00 0.00 64.34 64.26 2r1f n VAL 186 Cb 0.09 0.00 0.02 0.00 -0.91 0.00 0.00 33.84 33.04 2r1f n VAL 186 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 2r1f h LYS 187 N 0.00 0.71 -0.61 5.55 1.57 -1.68 -0.97 116.57 121.13 2r1f h LYS 187 Ca 0.00 -0.06 -0.09 0.00 -1.87 0.00 0.00 60.65 58.64 2r1f h LYS 187 Cb 0.00 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.13 2r1f h LYS 187 CO 0.00 0.50 0.04 0.00 -0.57 0.00 0.00 179.45 179.42 2r1f h ALA 188 N 1.17 0.91 -0.16 3.86 0.00 -1.64 -2.22 119.26 121.17 2r1f h ALA 188 Ca 0.19 -0.29 -0.13 0.00 0.00 0.00 0.00 54.91 54.68 2r1f h ALA 188 Cb -0.03 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.53 2r1f h ALA 188 CO -0.04 0.66 -0.41 0.28 0.00 0.00 0.00 179.25 179.74 2r1f h VAL 189 N 0.97 1.34 -0.83 0.00 2.07 -1.80 -1.39 116.25 116.60 2r1f h VAL 189 Ca 0.18 -1.67 0.02 0.00 0.82 0.00 0.00 66.70 66.06 2r1f h VAL 189 Cb 0.50 1.98 -0.04 0.00 -1.52 0.00 0.00 31.29 32.20 2r1f h VAL 189 CO 0.02 0.51 0.55 0.44 0.02 0.00 0.00 177.57 179.11 2r1f h ASP 190 N 0.21 0.92 -0.07 0.57 5.19 -1.16 0.19 116.42 122.27 2r1f h ASP 190 Ca -0.00 -0.02 -0.15 0.00 -0.62 0.00 0.00 57.03 56.24 2r1f h ASP 190 Cb 1.02 -0.22 -0.01 0.00 0.18 0.00 0.00 39.33 40.30 2r1f h ASP 190 CO 0.09 0.65 -0.47 -1.28 -3.12 0.00 0.00 179.24 175.10 2r1f h SER 191 N 1.08 0.69 -0.30 6.45 0.87 -1.32 -2.25 113.55 118.76 2r1f h SER 191 Ca 0.32 -0.34 -0.07 0.00 -1.23 0.00 0.00 61.79 60.47 2r1f h SER 191 Cb -0.04 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 61.72 2r1f h SER 191 CO -0.08 1.05 -0.08 0.00 -0.53 0.00 0.00 176.83 177.18 2r1f h ALA 192 N 0.97 0.41 0.09 6.23 0.00 -0.60 -2.91 119.26 123.46 2r1f h ALA 192 Ca 0.03 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 54.64 2r1f h ALA 192 Cb 1.01 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.70 2r1f h ALA 192 CO 0.09 0.25 -0.05 2.35 0.00 0.00 0.00 179.25 181.89 2r1f h TRP 193 N 0.35 -0.13 -0.19 0.00 2.91 -0.62 -1.73 115.95 116.53 2r1f h TRP 193 Ca 0.07 -0.00 -0.10 0.00 1.13 0.00 0.00 58.89 59.99 2r1f h TRP 193 Cb 0.58 0.05 -0.01 0.00 -0.51 0.00 0.00 29.16 29.26 2r1f h TRP 193 CO 0.05 -0.08 -0.31 0.93 -1.03 0.00 0.00 178.44 178.00 2r1f h GLU 194 N -0.13 0.39 -0.13 2.65 4.39 -1.49 -3.00 114.58 117.26 2r1f h GLU 194 Ca -0.01 -0.16 0.00 0.00 0.34 0.00 0.00 59.36 59.54 2r1f h GLU 194 Cb 0.11 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 28.74 2r1f h GLU 194 CO 0.01 0.66 0.00 0.41 -1.16 0.00 0.00 179.01 178.93 2r1f n GLY 195 N -0.33 0.44 3.71 -3.84 0.00 -1.10 -5.00 105.19 99.08 2r1f n GLY 195 Ca -0.01 -0.49 -0.32 0.00 0.00 0.00 0.00 46.02 45.20 2r1f n GLY 195 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2r1f s ARG 196 N -1.85 1.63 0.64 1.61 1.70 -0.66 -5.00 118.95 117.02 2r1f s ARG 196 Ca 0.34 1.50 -0.18 0.00 -0.47 0.00 0.00 55.73 56.93 2r1f s ARG 196 Cb 0.20 -1.80 -0.01 0.00 -0.57 0.00 0.00 34.95 32.76 2r1f s ARG 196 CO 0.30 -2.17 1.21 0.00 -1.08 0.00 0.00 175.30 173.56 2r1f s ALA 197 N -2.55 2.42 0.36 7.88 0.00 -0.38 -5.01 121.76 124.48 2r1f s ALA 197 Ca 0.67 0.99 -0.21 0.00 0.00 0.00 0.00 51.96 53.40 2r1f s ALA 197 Cb -0.23 -3.46 -0.10 0.00 0.00 0.00 0.00 23.12 19.33 2r1f s ALA 197 CO 0.54 -1.39 0.88 0.16 0.00 0.00 0.00 175.76 175.95 2r1f s ASP 198 N -1.72 7.03 -0.62 0.00 3.84 -1.26 -4.12 116.67 119.82 2r1f s ASP 198 Ca 0.77 1.63 0.00 0.00 -0.00 0.00 0.00 52.55 54.94 2r1f s ASP 198 Cb -0.31 -2.51 0.00 0.00 -1.38 0.00 0.00 42.92 38.73 2r1f s ASP 198 CO 0.37 -0.21 0.00 0.61 -0.00 0.00 0.00 175.17 175.94 2r1f n GLY 199 N -0.11 0.23 3.82 2.12 0.00 -1.26 -5.04 105.19 104.94 2r1f n GLY 199 Ca 0.04 -0.62 -0.36 0.00 0.00 0.00 0.00 46.02 45.08 2r1f n GLY 199 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2r1f s LEU 200 N -1.94 4.30 0.00 0.99 1.43 -1.26 -5.00 118.68 117.21 2r1f s LEU 200 Ca 0.00 1.43 0.09 0.00 -1.03 0.00 0.00 54.13 54.62 2r1f s LEU 200 Cb 0.00 -3.68 0.35 0.00 0.03 0.00 0.00 46.19 42.89 2r1f s LEU 200 CO 0.00 -0.01 1.25 -0.81 0.23 0.00 0.00 176.35 177.01 2r1f n PRO 201 N 0.57 1.34 -2.31 1.29 -0.05 -1.26 -4.91 135.00 129.68 2r1f n PRO 201 Ca -0.01 -0.53 -0.41 0.00 -0.05 0.00 0.00 63.50 62.50 2r1f n PRO 201 Cb 0.51 -1.18 -0.03 0.00 -0.05 0.00 0.00 33.50 32.75 2r1f n PRO 201 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 175.50 176.16 2r1f s TYR 202 N -1.83 3.33 -0.13 0.54 2.02 -1.26 -4.97 117.35 115.06 2r1f s TYR 202 Ca 0.15 1.54 -0.10 0.00 -0.37 0.00 0.00 57.07 58.29 2r1f s TYR 202 Cb 0.08 -3.48 -0.25 0.00 -0.40 0.00 0.00 41.96 37.91 2r1f s TYR 202 CO 0.11 -1.21 0.37 0.87 -1.57 0.00 0.00 175.55 174.12 2r1f h LYS 203 N 3.83 0.23 -4.92 -0.62 1.57 -1.97 -3.50 116.57 111.20 2r1f h LYS 203 Ca -0.47 -0.39 -0.44 0.00 -1.87 0.00 0.00 60.65 57.47 2r1f h LYS 203 Cb 1.22 0.15 -0.14 0.00 0.08 0.00 0.00 32.23 33.54 2r1f h LYS 203 CO 0.67 1.19 -0.55 0.16 -0.57 0.00 0.00 179.45 180.36 2r1f s ASP 204 N -7.03 1.77 0.40 0.86 1.47 -1.26 -5.05 116.67 107.83 2r1f s ASP 204 Ca -0.23 -1.59 0.11 0.00 1.18 0.00 0.00 52.55 52.02 2r1f s ASP 204 Cb 0.06 0.41 0.84 0.00 -0.34 0.00 0.00 42.92 43.89 2r1f s ASP 204 CO 0.74 -0.90 1.94 0.11 0.68 0.00 0.00 175.17 177.74 2r1f h LYS 205 N 2.14 0.18 -0.08 2.11 1.57 -1.99 -2.61 116.57 117.89 2r1f h LYS 205 Ca -0.33 -0.04 -0.04 0.00 -1.87 0.00 0.00 60.65 58.37 2r1f h LYS 205 Cb 1.25 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.53 2r1f h LYS 205 CO 0.52 0.33 -0.13 -0.97 -0.57 0.00 0.00 179.45 178.62 2r1f h ASN 206 N 0.17 0.11 0.01 0.86 -1.24 -1.99 -2.11 115.58 111.39 2r1f h ASN 206 Ca 0.03 -0.02 -0.18 0.00 0.71 0.00 0.00 56.30 56.85 2r1f h ASN 206 Cb 0.36 -0.03 -0.00 0.00 0.73 0.00 0.00 38.32 39.38 2r1f h ASN 206 CO 0.02 0.26 -0.61 1.56 -1.29 0.00 0.00 177.43 177.37 2r1f h GLN 207 N 0.11 0.60 -0.43 6.67 4.20 -1.88 0.34 115.11 124.73 2r1f h GLN 207 Ca 0.02 -0.41 -0.02 0.00 0.06 0.00 0.00 58.65 58.31 2r1f h GLN 207 Cb 0.31 0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.13 2r1f h GLN 207 CO 0.02 1.03 0.21 1.25 -0.67 0.00 0.00 178.83 180.66 2r1f h LEU 208 N 0.45 0.56 -0.91 1.46 5.85 -1.46 -2.89 115.31 118.37 2r1f h LEU 208 Ca -0.00 -0.12 -0.05 0.00 0.84 0.00 0.00 57.88 58.54 2r1f h LEU 208 Cb 1.18 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 42.03 2r1f h LEU 208 CO 0.12 0.53 0.21 0.58 -0.34 0.00 0.00 178.44 179.53 2r1f h VAL 209 N 0.55 1.24 0.00 1.05 2.07 -1.28 -0.95 116.25 118.93 2r1f h VAL 209 Ca 0.15 -0.84 0.00 0.00 0.82 0.00 0.00 66.70 66.83 2r1f h VAL 209 Cb 0.11 0.51 0.00 0.00 -1.52 0.00 0.00 31.29 30.39 2r1f h VAL 209 CO -0.02 0.33 0.00 0.41 0.02 0.00 0.00 177.57 178.31 2r1f n THR 210 N -4.27 0.00 0.00 2.57 -1.04 0.10 -1.38 114.28 110.26 2r1f n THR 210 Ca 0.05 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.06 2r1f n THR 210 Cb 0.21 -0.18 0.00 0.00 -1.82 0.00 0.00 70.33 68.54 2r1f n THR 210 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2r1f n ALA 212 N 0.18 0.00 0.09 2.41 0.00 -0.36 -1.82 120.51 121.01 2r1f n ALA 212 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.41 2r1f n ALA 212 Cb 0.05 0.00 0.21 0.00 0.00 0.00 0.00 19.45 19.71 2r1f n ALA 212 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2r1f h SER 213 N 0.00 0.27 -0.23 0.00 4.64 -1.49 -0.38 113.55 116.36 2r1f h SER 213 Ca 0.00 -0.12 -0.07 0.00 -0.47 0.00 0.00 61.79 61.14 2r1f h SER 213 Cb 0.00 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 62.01 2r1f h SER 213 CO 0.00 0.67 -0.12 0.40 -0.87 0.00 0.00 176.83 176.91 2r1f h ILE 214 N 0.21 1.31 -0.84 0.95 2.04 -1.63 -2.20 117.51 117.35 2r1f h ILE 214 Ca 0.02 -1.20 -0.01 0.00 1.00 0.00 0.00 64.86 64.67 2r1f h ILE 214 Cb 0.85 1.61 -0.04 0.00 -0.74 0.00 0.00 36.82 38.49 2r1f h ILE 214 CO 0.07 0.37 0.48 0.40 0.00 0.00 0.00 178.15 179.47 2r1f h ILE 215 N 0.19 1.24 -0.54 -0.67 2.04 -1.82 -2.66 117.51 115.29 2r1f h ILE 215 Ca 0.05 -0.57 0.02 0.00 1.00 0.00 0.00 64.86 65.36 2r1f h ILE 215 Cb 0.62 0.10 -0.03 0.00 -0.74 0.00 0.00 36.82 36.77 2r1f h ILE 215 CO 0.04 0.26 0.34 -0.08 0.00 0.00 0.00 178.15 178.71 2r1f h GLU 216 N 1.16 0.67 -0.00 2.37 4.57 -0.94 -1.25 114.58 121.16 2r1f h GLU 216 Ca 0.30 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.44 2r1f h GLU 216 Cb -0.00 -0.15 0.00 0.00 -0.16 0.00 0.00 28.75 28.44 2r1f h GLU 216 CO -0.05 0.44 -0.04 1.63 -1.18 0.00 0.00 179.01 179.81 2r1f n LYS 217 N -4.74 0.20 -0.08 1.92 4.76 -0.84 -3.79 118.16 115.59 2r1f n LYS 217 Ca 0.04 -0.02 -0.09 0.00 -2.87 0.00 0.00 58.31 55.37 2r1f n LYS 217 Cb 0.05 -1.50 -0.11 0.00 -1.84 0.00 0.00 35.03 31.63 2r1f n LYS 217 CO 0.00 0.00 0.00 -1.91 -1.37 0.00 0.00 177.40 174.12 2r1f n GLU 218 N -1.38 1.26 -2.18 1.97 4.07 -1.01 -4.90 120.64 118.47 2r1f n GLU 218 Ca 0.10 0.03 -0.42 0.00 -0.06 0.00 0.00 57.16 56.80 2r1f n GLU 218 Cb 0.30 -1.38 -0.03 0.00 -0.06 0.00 0.00 31.44 30.27 2r1f n GLU 218 CO 0.00 0.00 0.00 0.99 -0.06 0.00 0.00 177.13 178.06 2r1f s THR 219 N -2.37 3.77 -0.06 6.31 2.01 -0.50 -4.89 115.64 119.91 2r1f s THR 219 Ca -0.13 1.03 0.09 0.00 0.31 0.00 0.00 61.69 62.99 2r1f s THR 219 Cb 0.05 -3.66 -0.13 0.00 0.01 0.00 0.00 72.50 68.77 2r1f s THR 219 CO 0.56 -0.06 0.10 0.00 -0.69 0.00 0.00 174.62 174.54 2r1f n ALA 220 N 6.32 2.00 -3.48 7.40 0.00 -1.26 -4.98 120.51 126.51 2r1f n ALA 220 Ca 0.15 -0.46 -0.27 0.00 0.00 0.00 0.00 53.44 52.86 2r1f n ALA 220 Cb 0.43 -0.09 -0.17 0.00 0.00 0.00 0.00 19.45 19.63 2r1f n ALA 220 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2r1f s VAL 221 N -2.40 1.45 0.40 0.00 1.01 -1.26 -5.05 120.40 114.55 2r1f s VAL 221 Ca -0.04 -0.65 0.09 0.00 0.00 0.00 0.00 61.98 61.38 2r1f s VAL 221 Cb 0.04 -1.30 0.19 0.00 0.00 0.00 0.00 36.38 35.31 2r1f s VAL 221 CO 0.38 0.43 1.96 0.00 0.00 0.00 0.00 175.10 177.87 2r1f h ALA 222 N 7.07 1.57 0.00 5.51 0.00 -2.01 -2.18 119.26 129.23 2r1f h ALA 222 Ca -0.28 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.48 2r1f h ALA 222 Cb 1.19 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.88 2r1f h ALA 222 CO 0.48 0.31 0.00 -1.13 0.00 0.00 0.00 179.25 178.91 2r1f n SER 223 N -4.35 0.23 -0.64 0.00 3.41 -1.26 -2.81 113.62 108.20 2r1f n SER 223 Ca 0.00 0.54 0.09 0.00 -0.26 0.00 0.00 58.87 59.24 2r1f n SER 223 Cb 0.20 -0.59 0.05 0.00 -0.26 0.00 0.00 64.21 63.61 2r1f n SER 223 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2r1f n GLU 224 N -1.73 1.63 -0.05 4.33 1.02 -0.82 -4.70 120.64 120.33 2r1f n GLU 224 Ca 0.05 -1.36 -0.09 0.00 -0.02 0.00 0.00 57.16 55.74 2r1f n GLU 224 Cb 0.28 -1.36 -0.03 0.00 -0.02 0.00 0.00 31.44 30.31 2r1f n GLU 224 CO 0.00 0.00 0.00 -0.09 1.18 0.00 0.00 177.13 178.22 2r1f h ARG 225 N 3.13 0.21 0.00 3.49 2.43 -1.49 -0.89 114.38 121.26 2r1f h ARG 225 Ca 0.00 -0.01 -0.06 0.00 -0.81 0.00 0.00 59.98 59.10 2r1f h ARG 225 Cb 0.74 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.23 2r1f h ARG 225 CO 0.00 0.14 -0.28 -0.44 -1.51 0.00 0.00 179.97 177.88 2r1f h ASP 226 N 0.21 0.00 0.64 -3.80 3.32 -1.84 -1.41 116.42 113.55 2r1f h ASP 226 Ca 0.09 0.00 -0.27 0.00 0.02 0.00 0.00 57.03 56.87 2r1f h ASP 226 Cb 0.03 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.57 2r1f h ASP 226 CO -0.07 0.28 -1.28 1.56 -1.72 0.00 0.00 179.24 178.01 2r1f h GLN 227 N 0.00 0.22 -0.01 3.56 4.20 -1.80 -1.70 115.11 119.59 2r1f h GLN 227 Ca -0.00 -0.37 -0.00 0.00 0.06 0.00 0.00 58.65 58.34 2r1f h GLN 227 Cb 0.63 0.14 -0.00 0.00 0.30 0.00 0.00 27.48 28.54 2r1f h GLN 227 CO 0.04 1.14 0.00 0.28 -0.67 0.00 0.00 178.83 179.62 2r1f h VAL 228 N 0.06 1.08 -0.61 -0.54 2.07 -0.92 -2.01 116.25 115.37 2r1f h VAL 228 Ca -0.14 -0.22 0.13 0.00 0.82 0.00 0.00 66.70 67.28 2r1f h VAL 228 Cb 1.95 1.22 -0.10 0.00 -1.52 0.00 0.00 31.29 32.84 2r1f h VAL 228 CO 0.18 0.06 0.06 0.00 0.02 0.00 0.00 177.57 177.89 2r1f h ALA 229 N 0.91 0.66 -0.50 1.67 0.00 -1.33 -2.31 119.26 118.37 2r1f h ALA 229 Ca 0.00 0.17 0.04 0.00 0.00 0.00 0.00 54.91 55.12 2r1f h ALA 229 Cb 0.09 0.27 -0.04 0.00 0.00 0.00 0.00 17.79 18.11 2r1f h ALA 229 CO -0.00 -0.36 0.26 1.03 0.00 0.00 0.00 179.25 180.17 2r1f h SER 230 N 0.17 0.38 -0.13 0.00 0.87 -1.14 -1.18 113.55 112.54 2r1f h SER 230 Ca 0.32 0.02 0.02 0.00 -1.23 0.00 0.00 61.79 60.93 2r1f h SER 230 Cb 0.52 -0.05 -0.02 0.00 -0.44 0.00 0.00 62.40 62.41 2r1f h SER 230 CO -0.48 0.27 -0.00 0.58 -0.53 0.00 0.00 176.83 176.66 2r1f h VAL 231 N 0.51 0.91 -0.52 2.23 2.07 -0.84 0.12 116.25 120.73 2r1f h VAL 231 Ca 0.21 -0.01 -0.09 0.00 0.82 0.00 0.00 66.70 67.63 2r1f h VAL 231 Cb 0.11 0.87 -0.02 0.00 -1.52 0.00 0.00 31.29 30.73 2r1f h VAL 231 CO -0.14 0.01 -0.04 -0.26 0.02 0.00 0.00 177.57 177.15 2r1f h PHE 232 N 0.04 1.04 -0.18 1.57 0.04 -1.24 -1.29 116.94 116.92 2r1f h PHE 232 Ca 0.06 -0.20 -0.20 0.00 2.80 0.00 0.00 57.97 60.44 2r1f h PHE 232 Cb 0.07 -0.27 0.00 0.00 2.20 0.00 0.00 35.95 37.96 2r1f h PHE 232 CO -0.14 0.97 -0.67 0.82 -0.60 0.00 0.00 178.31 178.69 2r1f h ILE 233 N 0.82 1.30 -0.21 -0.55 2.04 -1.17 -0.79 117.51 118.95 2r1f h ILE 233 Ca 0.14 -1.91 0.05 0.00 1.00 0.00 0.00 64.86 64.15 2r1f h ILE 233 Cb 0.58 1.87 -0.05 0.00 -0.74 0.00 0.00 36.82 38.48 2r1f h ILE 233 CO 0.03 0.60 -0.13 0.78 0.00 0.00 0.00 178.15 179.44 2r1f h ASN 234 N 0.51 -0.42 -0.63 1.72 2.35 -0.67 -1.09 115.58 117.36 2r1f h ASN 234 Ca -0.02 0.09 0.00 0.00 -0.55 0.00 0.00 56.30 55.83 2r1f h ASN 234 Cb 1.27 0.22 -0.03 0.00 0.05 0.00 0.00 38.32 39.83 2r1f h ASN 234 CO 0.13 -0.17 0.41 0.03 -1.65 0.00 0.00 177.43 176.19 2r1f h ARG 235 N -0.12 0.83 -0.74 0.81 3.08 -1.11 -2.60 114.38 114.53 2r1f h ARG 235 Ca 0.12 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 60.10 2r1f h ARG 235 Cb 0.30 -0.18 -0.04 0.00 0.08 0.00 0.00 29.97 30.13 2r1f h ARG 235 CO -0.29 0.56 0.41 1.25 -1.07 0.00 0.00 179.97 180.83 2r1f h LEU 236 N 0.85 0.93 -0.29 3.04 5.85 -0.81 0.22 115.31 125.09 2r1f h LEU 236 Ca 0.23 -0.09 0.01 0.00 0.84 0.00 0.00 57.88 58.86 2r1f h LEU 236 Cb -0.09 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 40.69 2r1f h LEU 236 CO -0.05 0.75 0.19 -0.09 -0.34 0.00 0.00 178.44 178.90 2r1f h ARG 237 N 1.03 0.37 -0.01 1.25 2.43 -1.02 -3.24 114.38 115.18 2r1f h ARG 237 Ca 0.26 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.41 2r1f h ARG 237 Cb 0.03 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.50 2r1f h ARG 237 CO -0.04 0.25 -0.35 0.44 -1.51 0.00 0.00 179.97 178.75 2r1f n ILE 238 N -4.90 0.00 -0.55 1.20 -5.35 -1.00 -5.10 119.36 103.67 2r1f n ILE 238 Ca -0.01 -0.21 0.00 0.00 -0.27 0.00 0.00 62.75 62.26 2r1f n ILE 238 Cb 0.03 0.88 0.00 0.00 -1.74 0.00 0.00 39.64 38.81 2r1f n ILE 238 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2r1f n GLY 239 N 1.38 -1.04 3.43 3.28 0.00 0.04 -5.08 105.19 107.19 2r1f n GLY 239 Ca 0.11 -0.62 -0.32 0.00 0.00 0.00 0.00 46.02 45.18 2r1f n GLY 239 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2r1f s ARG 241 N -0.22 2.61 0.33 1.61 0.52 -1.26 -4.88 118.95 117.66 2r1f s ARG 241 Ca 0.00 -0.73 0.16 0.00 -0.52 0.00 0.00 55.73 54.64 2r1f s ARG 241 Cb 0.00 -2.37 0.49 0.00 0.52 0.00 0.00 34.95 33.59 2r1f s ARG 241 CO 0.00 0.53 1.65 -0.07 0.02 0.00 0.00 175.30 177.43 2r1f h LEU 242 N 5.63 0.00 -2.80 2.53 3.38 -1.79 -3.48 115.31 118.79 2r1f h LEU 242 Ca -0.42 0.00 -0.50 0.00 0.09 0.00 0.00 57.88 57.06 2r1f h LEU 242 Cb 1.16 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.91 2r1f h LEU 242 CO 0.51 0.47 -0.94 0.00 0.09 0.00 0.00 178.44 178.57 2r1f n GLN 243 N -3.52 -1.78 -4.32 1.13 6.02 -0.17 -4.96 117.38 109.78 2r1f n GLN 243 Ca -0.00 0.35 -0.34 0.00 -0.01 0.00 0.00 57.00 57.00 2r1f n GLN 243 Cb 0.58 -3.95 -0.15 0.00 1.02 0.00 0.00 30.24 27.74 2r1f n GLN 243 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.06 175.97 2r1f s THR 244 N -3.72 2.78 0.20 5.09 -1.32 -1.26 -4.96 115.64 112.45 2r1f s THR 244 Ca 0.28 -0.72 -0.10 0.00 -1.21 0.00 0.00 61.69 59.95 2r1f s THR 244 Cb -0.12 -2.20 0.13 0.00 -1.51 0.00 0.00 72.50 68.80 2r1f s THR 244 CO 0.90 0.50 1.77 0.44 -2.21 0.00 0.00 174.62 176.02 2r1f h ASP 245 N 7.56 0.98 -0.79 8.08 3.32 -1.99 -2.96 116.42 130.62 2r1f h ASP 245 Ca -0.37 -0.16 0.20 0.00 0.02 0.00 0.00 57.03 56.73 2r1f h ASP 245 Cb 1.18 -0.25 -0.04 0.00 0.22 0.00 0.00 39.33 40.43 2r1f h ASP 245 CO 0.59 0.86 0.55 -0.65 -1.72 0.00 0.00 179.24 178.87 2r1f h PRO 246 N 1.02 0.20 0.00 3.56 0.11 -1.96 -1.01 132.00 133.91 2r1f h PRO 246 Ca 0.24 -0.01 -0.11 0.00 0.11 0.00 0.00 66.00 66.23 2r1f h PRO 246 Cb 0.17 -0.04 -0.02 0.00 0.11 0.00 0.00 31.00 31.22 2r1f h PRO 246 CO -0.02 0.13 -0.53 1.79 -0.21 0.00 0.00 178.00 179.16 2r1f h THR 247 N 0.20 1.19 -0.20 -1.15 1.35 -1.81 -0.60 112.91 111.90 2r1f h THR 247 Ca 0.39 -1.93 -0.08 0.00 -0.55 0.00 0.00 66.41 64.25 2r1f h THR 247 Cb 1.23 2.10 -0.00 0.00 -1.73 0.00 0.00 68.15 69.74 2r1f h THR 247 CO -0.08 0.51 -0.18 0.58 -0.25 0.00 0.00 175.52 176.10 2r1f h VAL 248 N 0.00 1.33 0.20 6.82 2.07 -1.27 -2.48 116.25 122.92 2r1f h VAL 248 Ca -0.01 -1.34 0.01 0.00 0.82 0.00 0.00 66.70 66.19 2r1f h VAL 248 Cb 1.05 1.76 -0.02 0.00 -1.52 0.00 0.00 31.29 32.56 2r1f h VAL 248 CO 0.07 0.41 -0.26 0.40 0.02 0.00 0.00 177.57 178.21 2r1f h ILE 249 N 0.14 0.44 -0.83 4.57 2.04 -1.14 -2.71 117.51 120.03 2r1f h ILE 249 Ca 0.03 0.00 0.16 0.00 1.00 0.00 0.00 64.86 66.05 2r1f h ILE 249 Cb 0.72 0.44 -0.10 0.00 -0.74 0.00 0.00 36.82 37.14 2r1f h ILE 249 CO 0.05 0.00 0.38 0.22 0.00 0.00 0.00 178.15 178.79 2r1f h TYR 250 N -0.52 0.65 0.00 1.37 3.20 -1.18 -3.14 116.97 117.35 2r1f h TYR 250 Ca 0.01 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.91 2r1f h TYR 250 Cb 0.50 -0.16 0.00 0.00 1.54 0.00 0.00 36.73 38.61 2r1f h TYR 250 CO -0.20 0.09 0.00 0.41 -1.64 0.00 0.00 178.16 176.82 2r1f n GLY 251 N -1.33 1.28 0.00 1.82 0.00 -0.93 -4.93 105.19 101.09 2r1f n GLY 251 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 2r1f n GLY 251 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2r1f n GLY 253 N 1.54 -0.49 0.09 -0.02 0.00 -1.19 -4.88 105.19 100.24 2r1f n GLY 253 Ca 0.00 0.22 0.15 0.00 0.00 0.00 0.00 46.02 46.38 2r1f n GLY 253 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2r1f n GLU 254 N 0.00 0.79 0.07 1.61 0.28 -1.26 -2.91 120.64 119.23 2r1f n GLU 254 Ca 0.00 -0.18 0.11 0.00 -0.16 0.00 0.00 57.16 56.93 2r1f n GLU 254 Cb 0.00 -1.50 0.45 0.00 1.43 0.00 0.00 31.44 31.82 2r1f n GLU 254 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 2r1f n ARG 255 N -0.94 0.13 -2.43 3.44 1.74 -1.26 -4.67 116.66 112.67 2r1f n ARG 255 Ca 0.17 0.27 -0.42 0.00 -0.77 0.00 0.00 57.85 57.11 2r1f n ARG 255 Cb 0.23 -1.71 -0.03 0.00 -1.02 0.00 0.00 32.46 29.94 2r1f n ARG 255 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 2r1f s TYR 256 N -3.14 2.35 -0.49 -1.55 5.04 -1.15 -4.89 117.35 113.53 2r1f s TYR 256 Ca 0.08 0.47 0.25 0.00 -2.44 0.00 0.00 57.07 55.43 2r1f s TYR 256 Cb 0.11 -4.42 0.67 0.00 0.35 0.00 0.00 41.96 38.68 2r1f s TYR 256 CO 0.42 -1.90 1.72 -2.95 -1.34 0.00 0.00 175.55 171.50 2r1f h ASN 257 N 10.75 0.00 0.00 4.32 -0.00 -1.91 -3.46 115.58 125.27 2r1f h ASN 257 Ca -0.26 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.04 2r1f h ASN 257 Cb 1.09 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 39.41 2r1f h ASN 257 CO 1.18 0.00 0.00 0.61 -0.00 0.00 0.00 177.43 179.22 2r1f n GLY 258 N 0.97 0.49 3.18 9.14 0.00 -1.26 -5.12 105.19 112.58 2r1f n GLY 258 Ca 0.04 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.83 2r1f n GLY 258 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2r1f s LYS 259 N 0.00 1.16 -0.10 1.61 1.02 -1.26 -5.14 119.74 117.03 2r1f s LYS 259 Ca 0.00 -0.77 -0.01 0.00 0.02 0.00 0.00 55.97 55.21 2r1f s LYS 259 Cb 0.00 -1.20 0.03 0.00 -0.52 0.00 0.00 37.83 36.14 2r1f s LYS 259 CO 0.00 0.31 -0.06 -1.17 -0.92 0.00 0.00 175.35 173.51 2r1f s LEU 260 N -0.96 1.04 0.00 3.17 2.96 -1.26 -4.99 118.68 118.64 2r1f s LEU 260 Ca 0.05 -0.25 0.01 0.00 -0.22 0.00 0.00 54.13 53.72 2r1f s LEU 260 Cb -0.08 -0.74 0.01 0.00 0.50 0.00 0.00 46.19 45.89 2r1f s LEU 260 CO 0.01 -0.14 0.09 -1.54 -1.32 0.00 0.00 176.35 173.45 2r1f n SER 261 N 4.97 3.16 0.05 3.68 3.41 -1.26 -5.02 113.62 122.62 2r1f n SER 261 Ca -0.11 -3.01 -0.02 0.00 -0.26 0.00 0.00 58.87 55.47 2r1f n SER 261 Cb 0.50 0.25 0.24 0.00 -0.26 0.00 0.00 64.21 64.94 2r1f n SER 261 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 2r1f h ARG 262 N 0.00 0.38 -0.70 4.33 9.65 -2.00 -2.12 114.38 123.92 2r1f h ARG 262 Ca -0.38 -0.14 -0.07 0.00 -1.10 0.00 0.00 59.98 58.29 2r1f h ARG 262 Cb 1.19 -0.03 -0.03 0.00 -1.39 0.00 0.00 29.97 29.72 2r1f h ARG 262 CO 0.62 0.62 0.16 0.00 2.80 0.00 0.00 179.97 184.17 2r1f h ALA 263 N 1.39 0.95 -0.46 2.80 0.00 -1.98 -2.26 119.26 119.70 2r1f h ALA 263 Ca 0.05 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.67 2r1f h ALA 263 Cb 0.64 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 2r1f h ALA 263 CO 0.05 0.67 0.13 -0.44 0.00 0.00 0.00 179.25 179.65 2r1f h ASP 264 N 1.07 0.68 0.19 0.00 3.32 -1.88 -2.58 116.42 117.22 2r1f h ASP 264 Ca 0.22 -0.22 -0.03 0.00 0.02 0.00 0.00 57.03 57.02 2r1f h ASP 264 Cb 0.38 -0.18 -0.00 0.00 0.22 0.00 0.00 39.33 39.75 2r1f h ASP 264 CO 0.00 0.72 -0.15 -0.07 -1.72 0.00 0.00 179.24 178.03 2r1f h LEU 265 N 0.61 0.00 -0.59 1.55 3.38 -1.19 -3.03 115.31 116.04 2r1f h LEU 265 Ca 0.15 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.12 2r1f h LEU 265 Cb 0.29 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.04 2r1f h LEU 265 CO -0.00 0.15 -0.55 -0.62 0.09 0.00 0.00 178.44 177.51 2r1f n GLU 266 N -4.21 0.77 -2.91 1.13 1.02 -0.87 -4.69 120.64 110.88 2r1f n GLU 266 Ca -0.02 -0.59 -0.42 0.00 -0.02 0.00 0.00 57.16 56.11 2r1f n GLU 266 Cb 0.22 -1.49 -0.04 0.00 -0.02 0.00 0.00 31.44 30.11 2r1f n GLU 266 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 2r1f s THR 267 N -2.64 4.79 0.16 2.62 2.01 -0.99 -5.03 115.64 116.56 2r1f s THR 267 Ca 0.17 1.34 -0.31 0.00 0.31 0.00 0.00 61.69 63.20 2r1f s THR 267 Cb 0.18 -4.16 -0.08 0.00 0.01 0.00 0.00 72.50 68.45 2r1f s THR 267 CO 0.64 -0.21 1.36 -2.84 -0.69 0.00 0.00 174.62 172.88 2r1f s PRO 268 N 2.97 4.34 0.26 4.92 0.02 -1.26 -4.93 135.00 141.32 2r1f s PRO 268 Ca 0.34 2.08 0.01 0.00 0.02 0.00 0.00 61.00 63.46 2r1f s PRO 268 Cb -0.14 -3.22 -0.04 0.00 0.02 0.00 0.00 34.50 31.12 2r1f s PRO 268 CO 0.11 -0.36 0.13 0.95 -0.33 0.00 0.00 177.00 177.50 2r1f s THR 269 N 0.65 0.31 0.54 0.99 -4.23 -1.26 -5.03 115.64 107.61 2r1f s THR 269 Ca 0.61 -2.00 0.25 0.00 -1.18 0.00 0.00 61.69 59.37 2r1f s THR 269 Cb -0.37 -2.56 0.31 0.00 1.34 0.00 0.00 72.50 71.23 2r1f s THR 269 CO 0.34 0.00 2.19 0.00 -0.54 0.00 0.00 174.62 176.61 2r1f h ALA 270 N 2.39 1.61 0.00 3.99 0.00 -1.96 -2.79 119.26 122.50 2r1f h ALA 270 Ca -0.36 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.52 2r1f h ALA 270 Cb 1.25 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.03 2r1f h ALA 270 CO 0.55 0.04 -0.90 0.66 0.00 0.00 0.00 179.25 179.60 2r1f n TYR 271 N -4.01 0.01 -2.28 0.00 4.01 -1.26 -4.30 117.16 109.33 2r1f n TYR 271 Ca -0.03 0.00 -0.40 0.00 -0.16 0.00 0.00 57.90 57.31 2r1f n TYR 271 Cb 0.12 -0.09 -0.03 0.00 -0.31 0.00 0.00 39.34 39.03 2r1f n TYR 271 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 2r1f s ASN 272 N -3.07 5.81 0.00 7.72 3.84 -1.05 -4.31 114.94 123.88 2r1f s ASN 272 Ca 0.08 0.18 0.05 0.00 0.21 0.00 0.00 52.86 53.39 2r1f s ASN 272 Cb 0.16 -2.54 0.32 0.00 -0.55 0.00 0.00 41.25 38.64 2r1f s ASN 272 CO 0.83 -1.98 1.10 0.35 -2.79 0.00 0.00 177.10 174.60 2r1f n THR 273 N 6.90 0.00 0.26 -5.21 -2.24 -1.26 -1.29 114.28 111.44 2r1f n THR 273 Ca 0.14 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 62.03 2r1f n THR 273 Cb 0.50 -0.16 -0.04 0.00 -2.10 0.00 0.00 70.33 68.54 2r1f n THR 273 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 2r1f n TYR 274 N -0.60 0.45 -0.05 4.78 4.01 -1.26 -1.00 117.16 123.49 2r1f n TYR 274 Ca 0.04 0.13 -0.07 0.00 -0.16 0.00 0.00 57.90 57.84 2r1f n TYR 274 Cb 0.02 -0.64 -0.06 0.00 -0.31 0.00 0.00 39.34 38.35 2r1f n TYR 274 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 2r1f n THR 275 N -2.29 0.65 -3.13 -0.72 -2.24 -0.81 -4.99 114.28 100.75 2r1f n THR 275 Ca -0.00 -0.29 -0.30 0.00 -2.27 0.00 0.00 64.05 61.19 2r1f n THR 275 Cb 0.51 -0.87 -0.04 0.00 -2.10 0.00 0.00 70.33 67.84 2r1f n THR 275 CO 0.00 0.00 0.00 0.27 -0.57 0.00 0.00 175.07 174.77 2r1f s ILE 276 N -2.23 4.89 -0.09 2.28 -4.36 -0.41 -5.08 121.20 116.19 2r1f s ILE 276 Ca -0.12 0.41 -0.08 0.00 -0.26 0.00 0.00 60.65 60.60 2r1f s ILE 276 Cb 0.04 -3.71 -0.04 0.00 1.25 0.00 0.00 42.46 39.99 2r1f s ILE 276 CO 0.30 -0.36 0.19 -0.89 0.24 0.00 0.00 174.94 174.42 2r1f s THR 277 N -2.16 5.42 0.00 8.37 2.01 -1.26 -4.62 115.64 123.40 2r1f s THR 277 Ca 0.48 0.31 0.00 0.00 0.31 0.00 0.00 61.69 62.79 2r1f s THR 277 Cb -0.11 -3.46 0.00 0.00 0.01 0.00 0.00 72.50 68.94 2r1f s THR 277 CO 0.28 0.60 0.00 0.61 -0.69 0.00 0.00 174.62 175.42 2r1f n GLY 278 N 1.90 -1.89 3.79 4.40 0.00 -1.26 -4.93 105.19 107.20 2r1f n GLY 278 Ca -0.18 -1.54 -0.36 0.00 0.00 0.00 0.00 46.02 43.94 2r1f n GLY 278 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2r1f s LEU 279 N 0.00 4.10 1.06 0.99 1.43 -1.26 -4.73 118.68 120.26 2r1f s LEU 279 Ca 0.00 1.98 -0.12 0.00 -1.03 0.00 0.00 54.13 54.97 2r1f s LEU 279 Cb 0.00 -4.25 0.22 0.00 0.03 0.00 0.00 46.19 42.19 2r1f s LEU 279 CO 0.00 -0.50 1.07 -2.16 0.23 0.00 0.00 176.35 175.00 2r1f s PRO 280 N -2.62 -0.09 0.00 1.29 0.04 -1.26 -4.91 135.00 127.44 2r1f s PRO 280 Ca 0.59 1.11 0.19 0.00 0.04 0.00 0.00 61.00 62.92 2r1f s PRO 280 Cb -0.20 -1.63 1.11 0.00 0.04 0.00 0.00 34.50 33.82 2r1f s PRO 280 CO 0.25 -3.25 1.54 -0.35 0.04 0.00 0.00 177.00 175.24 2r1f n PRO 281 N -4.62 0.71 -3.73 0.56 -0.04 -1.26 -4.82 135.00 121.80 2r1f n PRO 281 Ca 0.06 0.00 -0.02 0.00 -0.04 0.00 0.00 63.50 63.51 2r1f n PRO 281 Cb 0.53 -1.41 -0.01 0.00 -0.04 0.00 0.00 33.50 32.58 2r1f n PRO 281 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2r1f s GLY 282 N -1.87 -0.25 0.88 0.55 0.00 -1.26 -4.98 107.32 100.38 2r1f s GLY 282 Ca 0.28 0.25 -0.11 0.00 0.00 0.00 0.00 44.72 45.14 2r1f s GLY 282 CO 0.21 0.36 1.09 0.00 0.00 0.00 0.00 173.10 174.76 2r1f s ALA 283 N -2.90 1.63 -0.41 3.20 0.00 -1.26 -4.86 121.76 117.16 2r1f s ALA 283 Ca 0.14 -0.04 0.07 0.00 0.00 0.00 0.00 51.96 52.13 2r1f s ALA 283 Cb 0.00 -3.20 -0.05 0.00 0.00 0.00 0.00 23.12 19.87 2r1f s ALA 283 CO 0.01 -2.28 0.35 0.44 0.00 0.00 0.00 175.76 174.28 2r1f n ILE 284 N -3.84 0.00 -3.84 0.00 -5.35 -1.26 -4.83 119.36 100.24 2r1f n ILE 284 Ca 0.07 -0.36 -0.06 0.00 -0.27 0.00 0.00 62.75 62.13 2r1f n ILE 284 Cb 0.55 1.02 0.02 0.00 -1.74 0.00 0.00 39.64 39.49 2r1f n ILE 284 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2r1f s ALA 285 N -1.50 -1.16 -0.29 -1.28 0.00 -1.26 -4.78 121.76 111.48 2r1f s ALA 285 Ca 0.03 -0.53 -0.21 0.00 0.00 0.00 0.00 51.96 51.25 2r1f s ALA 285 Cb 0.05 0.72 -0.01 0.00 0.00 0.00 0.00 23.12 23.88 2r1f s ALA 285 CO 0.25 -1.03 0.67 0.99 0.00 0.00 0.00 175.76 176.65 2r1f s THR 286 N -2.29 4.91 0.49 0.00 2.01 -1.26 -3.83 115.64 115.68 2r1f s THR 286 Ca 0.18 1.02 -0.20 0.00 0.31 0.00 0.00 61.69 63.01 2r1f s THR 286 Cb -0.04 -4.02 -0.08 0.00 0.01 0.00 0.00 72.50 68.37 2r1f s THR 286 CO 0.08 -0.12 1.04 -2.16 -0.69 0.00 0.00 174.62 172.77 2r1f s PRO 287 N 2.67 3.75 0.75 4.92 0.04 -1.26 0.79 135.00 146.67 2r1f s PRO 287 Ca 0.27 1.36 -0.04 0.00 0.04 0.00 0.00 61.00 62.64 2r1f s PRO 287 Cb -0.15 -2.09 0.13 0.00 0.04 0.00 0.00 34.50 32.43 2r1f s PRO 287 CO 0.11 -0.47 1.05 0.20 0.04 0.00 0.00 177.00 177.92 2r1f s GLY 288 N -2.02 1.76 0.49 0.56 0.00 -1.26 -4.70 107.32 102.15 2r1f s GLY 288 Ca 0.67 -1.50 0.19 0.00 0.00 0.00 0.00 44.72 44.09 2r1f s GLY 288 CO 0.21 -0.93 2.06 0.00 0.00 0.00 0.00 173.10 174.44 2r1f h ALA 289 N -0.72 1.62 -0.16 3.20 0.00 -1.97 -1.84 119.26 119.39 2r1f h ALA 289 Ca -0.39 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.39 2r1f h ALA 289 Cb 1.27 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 2r1f h ALA 289 CO 0.43 0.16 0.04 0.38 0.00 0.00 0.00 179.25 180.26 2r1f h ASP 290 N 0.00 0.24 -0.14 0.00 3.04 -2.00 -2.22 116.42 115.35 2r1f h ASP 290 Ca -0.00 -0.22 -0.21 0.00 -3.24 0.00 0.00 57.03 53.36 2r1f h ASP 290 Cb 0.25 -0.06 0.01 0.00 -1.04 0.00 0.00 39.33 38.49 2r1f h ASP 290 CO 0.02 0.40 -0.73 0.28 -2.04 0.00 0.00 179.24 177.17 2r1f h SER 291 N 0.07 0.88 -0.74 4.15 0.02 -1.81 -2.28 113.55 113.84 2r1f h SER 291 Ca 0.05 -0.64 0.03 0.00 -0.84 0.00 0.00 61.79 60.39 2r1f h SER 291 Cb 0.25 -0.26 -0.04 0.00 0.14 0.00 0.00 62.40 62.49 2r1f h SER 291 CO -0.00 1.38 0.49 0.25 -1.14 0.00 0.00 176.83 177.80 2r1f h LEU 292 N 0.45 0.79 -0.18 5.07 5.85 -1.40 0.80 115.31 126.69 2r1f h LEU 292 Ca -0.05 -0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.60 2r1f h LEU 292 Cb 1.36 -0.19 -0.00 0.00 0.37 0.00 0.00 40.66 42.20 2r1f h LEU 292 CO 0.15 0.55 -0.10 0.50 -0.34 0.00 0.00 178.44 179.20 2r1f h LYS 293 N 0.92 0.38 0.00 1.25 3.64 -1.34 -2.94 116.57 118.48 2r1f h LYS 293 Ca 0.29 -0.17 -0.03 0.00 -1.27 0.00 0.00 60.65 59.46 2r1f h LYS 293 Cb 0.02 -0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 31.83 2r1f h LYS 293 CO -0.08 0.70 -0.17 0.00 -2.27 0.00 0.00 179.45 177.63 2r1f h ALA 294 N 0.67 1.56 0.00 5.00 0.00 -1.01 0.53 119.26 126.01 2r1f h ALA 294 Ca 0.04 -0.15 -0.10 0.00 0.00 0.00 0.00 54.91 54.70 2r1f h ALA 294 Cb 0.59 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 2r1f h ALA 294 CO 0.03 0.21 -0.47 0.00 0.00 0.00 0.00 179.25 179.02 2r1f h ALA 295 N 1.83 0.83 0.00 0.00 0.00 -0.83 -2.81 119.26 118.28 2r1f h ALA 295 Ca -0.00 -0.42 -0.22 0.00 0.00 0.00 0.00 54.91 54.26 2r1f h ALA 295 Cb 0.33 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 2r1f h ALA 295 CO 0.02 0.58 -1.94 0.00 0.00 0.00 0.00 179.25 177.91 2r1f n ALA 296 N -2.27 1.90 -3.25 0.00 0.00 -0.67 -4.62 120.51 111.59 2r1f n ALA 296 Ca 0.01 -0.87 -0.25 0.00 0.00 0.00 0.00 53.44 52.33 2r1f n ALA 296 Cb 0.62 -0.60 -0.07 0.00 0.00 0.00 0.00 19.45 19.40 2r1f n ALA 296 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2r1f n HIS 297 N -2.72 0.61 -1.35 0.00 -0.00 0.18 -1.25 115.22 110.68 2r1f n HIS 297 Ca -0.18 -3.70 -0.31 0.00 -0.00 0.00 0.00 57.72 53.52 2r1f n HIS 297 Cb 0.93 -0.39 0.08 0.00 -0.00 0.00 0.00 29.99 30.61 2r1f n HIS 297 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 176.34 175.09 2r1f s PRO 298 N -1.47 2.40 0.42 -0.41 0.04 -1.06 -4.61 135.00 130.31 2r1f s PRO 298 Ca 0.36 1.17 -0.26 0.00 0.04 0.00 0.00 61.00 62.31 2r1f s PRO 298 Cb 0.16 -1.91 -0.09 0.00 0.04 0.00 0.00 34.50 32.70 2r1f s PRO 298 CO -0.09 -1.54 1.35 0.00 0.04 0.00 0.00 177.00 176.77 2r1f s ALA 299 N -2.86 3.25 -0.82 8.56 0.00 -0.95 -4.94 121.76 123.99 2r1f s ALA 299 Ca 0.61 1.32 -0.25 0.00 0.00 0.00 0.00 51.96 53.65 2r1f s ALA 299 Cb -0.17 -3.53 0.05 0.00 0.00 0.00 0.00 23.12 19.47 2r1f s ALA 299 CO 0.54 -0.96 1.27 0.15 0.00 0.00 0.00 175.76 176.76 2r1f s LYS 300 N -2.33 3.32 0.14 0.00 1.02 -1.26 -4.60 119.74 116.03 2r1f s LYS 300 Ca 0.58 -0.68 0.04 0.00 0.02 0.00 0.00 55.97 55.94 2r1f s LYS 300 Cb -0.40 -4.57 -0.04 0.00 -0.52 0.00 0.00 37.83 32.29 2r1f s LYS 300 CO 0.52 -2.09 -0.10 0.95 -0.92 0.00 0.00 175.35 173.71 2r1f s THR 301 N 5.07 1.12 -0.53 2.17 -4.23 -1.26 -5.04 115.64 112.94 2r1f s THR 301 Ca 0.36 -2.05 0.11 0.00 -1.18 0.00 0.00 61.69 58.93 2r1f s THR 301 Cb -0.07 -1.83 0.61 0.00 1.34 0.00 0.00 72.50 72.55 2r1f s THR 301 CO 0.06 -0.76 1.44 -0.81 -0.54 0.00 0.00 174.62 174.00 2r1f n PRO 302 N -0.18 3.84 -2.88 3.99 -0.04 -1.26 -4.99 135.00 133.47 2r1f n PRO 302 Ca -0.10 -2.35 -0.37 0.00 -0.04 0.00 0.00 63.50 60.64 2r1f n PRO 302 Cb 0.61 -2.04 -0.06 0.00 -0.04 0.00 0.00 33.50 31.96 2r1f n PRO 302 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2r1f s TYR 303 N -2.26 3.75 0.00 0.54 2.02 -1.26 -4.49 117.35 115.65 2r1f s TYR 303 Ca 0.41 1.69 0.00 0.00 -0.37 0.00 0.00 57.07 58.79 2r1f s TYR 303 Cb 0.31 -2.83 0.00 0.00 -0.40 0.00 0.00 41.96 39.03 2r1f s TYR 303 CO 0.13 0.32 0.18 1.28 -1.57 0.00 0.00 175.55 175.89 2r1f n LEU 304 N 0.87 0.37 -3.93 -1.29 4.77 0.26 -4.16 117.00 113.88 2r1f n LEU 304 Ca -0.01 -0.44 -0.11 0.00 -0.03 0.00 0.00 56.01 55.43 2r1f n LEU 304 Cb 0.50 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.46 2r1f n LEU 304 CO 0.45 0.09 -0.36 -0.31 -1.33 0.00 0.00 177.39 175.93 2r1f s TYR 305 N -0.15 0.18 -0.01 -1.77 2.02 -0.62 -4.96 117.35 112.05 2r1f s TYR 305 Ca 0.00 -0.27 -0.06 0.00 -0.37 0.00 0.00 57.07 56.37 2r1f s TYR 305 Cb 0.00 -0.12 0.00 0.00 -0.40 0.00 0.00 41.96 41.44 2r1f s TYR 305 CO 0.00 -0.09 0.12 -0.59 -1.57 0.00 0.00 175.55 173.41 2r1f s PHE 306 N -0.75 0.02 0.02 2.71 -0.12 -1.26 -1.06 117.98 117.54 2r1f s PHE 306 Ca -0.08 -0.07 -0.07 0.00 -0.05 0.00 0.00 56.93 56.66 2r1f s PHE 306 Cb -0.05 -0.04 -0.00 0.00 -0.63 0.00 0.00 43.02 42.29 2r1f s PHE 306 CO -0.00 -0.23 0.14 0.54 -0.05 0.00 0.00 175.22 175.61 2r1f s VAL 307 N -1.07 0.10 0.27 -2.49 0.11 -0.83 -4.96 120.40 111.54 2r1f s VAL 307 Ca -0.12 -0.84 -0.31 0.00 -2.93 0.00 0.00 61.98 57.79 2r1f s VAL 307 Cb -0.06 -0.65 -0.12 0.00 -1.53 0.00 0.00 36.38 34.02 2r1f s VAL 307 CO 0.01 -0.46 1.58 0.00 -3.33 0.00 0.00 175.10 172.90 2r1f n ALA 308 N 1.11 2.35 1.26 1.54 0.00 -1.26 0.03 120.51 125.54 2r1f n ALA 308 Ca -0.21 0.38 0.14 0.00 0.00 0.00 0.00 53.44 53.76 2r1f n ALA 308 Cb 0.57 -2.44 0.69 0.00 0.00 0.00 0.00 19.45 18.27 2r1f n ALA 308 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2r1f n ASP 309 N 2.39 0.04 0.00 0.00 5.68 -0.73 -4.65 116.55 119.28 2r1f n ASP 309 Ca 0.10 0.06 0.00 0.00 -0.50 0.00 0.00 54.79 54.45 2r1f n ASP 309 Cb 0.36 -0.34 0.00 0.00 -1.14 0.00 0.00 41.12 40.00 2r1f n ASP 309 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2r1f n GLY 310 N 1.37 3.42 2.69 6.12 0.00 -1.26 -4.72 105.19 112.80 2r1f n GLY 310 Ca 0.11 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.88 2r1f n GLY 310 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2r1f n LYS 311 N -1.98 2.97 0.00 1.61 0.00 -1.26 -4.96 118.16 114.53 2r1f n LYS 311 Ca 0.00 -4.50 0.00 0.00 -0.00 0.00 0.00 58.31 53.81 2r1f n LYS 311 Cb 0.00 -2.13 0.00 0.00 -0.00 0.00 0.00 35.03 32.90 2r1f n LYS 311 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2r1f n GLY 312 N -0.27 2.71 0.00 2.58 0.00 -1.26 -4.97 105.19 103.98 2r1f n GLY 312 Ca 0.32 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.34 2r1f n GLY 312 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2r1f n GLY 313 N -0.29 2.43 3.05 -0.02 0.00 -1.26 -4.83 105.19 104.27 2r1f n GLY 313 Ca 0.00 -2.07 -0.15 0.00 0.00 0.00 0.00 46.02 43.79 2r1f n GLY 313 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2r1f s HIS 314 N 1.49 0.73 -0.18 1.61 3.76 -1.26 -1.76 115.29 119.67 2r1f s HIS 314 Ca 0.00 -0.33 -0.05 0.00 -0.15 0.00 0.00 55.06 54.52 2r1f s HIS 314 Cb 0.00 -0.44 -0.03 0.00 1.11 0.00 0.00 32.58 33.22 2r1f s HIS 314 CO 0.00 -0.03 0.01 0.99 -0.85 0.00 0.00 174.74 174.85 2r1f s THR 315 N -0.86 4.15 -0.07 1.30 2.01 0.10 -4.79 115.64 117.48 2r1f s THR 315 Ca -0.04 -0.26 -0.05 0.00 0.31 0.00 0.00 61.69 61.66 2r1f s THR 315 Cb -0.07 -2.86 -0.04 0.00 0.01 0.00 0.00 72.50 69.54 2r1f s THR 315 CO 0.00 0.45 0.15 -0.36 -0.69 0.00 0.00 174.62 174.18 2r1f s PHE 316 N 0.67 3.56 0.04 4.92 0.08 -1.26 -1.96 117.98 124.03 2r1f s PHE 316 Ca 0.00 0.45 -0.01 0.00 0.12 0.00 0.00 56.93 57.49 2r1f s PHE 316 Cb -0.14 -1.89 -0.03 0.00 -0.57 0.00 0.00 43.02 40.39 2r1f s PHE 316 CO 0.02 0.69 -0.03 -0.80 -0.10 0.00 0.00 175.22 175.01 2r1f s ASN 317 N -1.40 0.40 -0.02 1.36 0.02 -0.23 -4.99 114.94 110.08 2r1f s ASN 317 Ca 0.20 -0.82 0.21 0.00 -1.02 0.00 0.00 52.86 51.43 2r1f s ASN 317 Cb -0.12 0.17 -0.27 0.00 0.02 0.00 0.00 41.25 41.04 2r1f s ASN 317 CO 0.10 -0.49 0.51 0.35 0.02 0.00 0.00 177.10 177.58 2r1f n THR 318 N 0.64 0.36 -4.13 1.60 -2.24 -1.26 -0.57 114.28 108.68 2r1f n THR 318 Ca -0.18 -0.57 -0.09 0.00 -2.27 0.00 0.00 64.05 60.95 2r1f n THR 318 Cb 0.59 -0.16 -0.10 0.00 -2.10 0.00 0.00 70.33 68.56 2r1f n THR 318 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2r1f s ASN 319 N -4.85 0.43 0.22 3.42 2.20 -1.26 -4.54 114.94 110.56 2r1f s ASN 319 Ca -0.07 -1.12 0.00 0.00 -0.94 0.00 0.00 52.86 50.74 2r1f s ASN 319 Cb 0.12 0.25 0.19 0.00 -2.00 0.00 0.00 41.25 39.81 2r1f s ASN 319 CO 0.88 -0.66 1.54 0.25 -2.94 0.00 0.00 177.10 176.16 2r1f h LEU 320 N 2.98 0.46 0.29 3.54 5.85 -1.99 -2.29 115.31 124.15 2r1f h LEU 320 Ca -0.35 -0.25 -0.01 0.00 0.84 0.00 0.00 57.88 58.11 2r1f h LEU 320 Cb 1.17 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 42.07 2r1f h LEU 320 CO 0.62 0.92 -0.14 0.00 -0.34 0.00 0.00 178.44 179.51 2r1f h ALA 321 N 1.09 -0.38 -0.62 1.25 0.00 -1.99 0.19 119.26 118.79 2r1f h ALA 321 Ca 0.00 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 2r1f h ALA 321 Cb 1.08 0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.98 2r1f h ALA 321 CO 0.10 -0.71 0.38 0.77 0.00 0.00 0.00 179.25 179.78 2r1f h SER 322 N -0.40 0.73 -0.12 0.00 0.02 -1.99 -1.84 113.55 109.95 2r1f h SER 322 Ca -0.04 -0.04 -0.03 0.00 -0.84 0.00 0.00 61.79 60.84 2r1f h SER 322 Cb 0.30 -0.18 -0.00 0.00 0.14 0.00 0.00 62.40 62.66 2r1f h SER 322 CO 0.06 0.56 -0.06 -0.74 -1.14 0.00 0.00 176.83 175.51 2r1f h HIS 323 N 0.85 0.29 -0.12 3.45 6.17 -1.18 -2.04 115.15 122.58 2r1f h HIS 323 Ca 0.22 -0.07 -0.02 0.00 0.71 0.00 0.00 60.37 61.21 2r1f h HIS 323 Cb -0.04 -0.07 -0.01 0.00 2.52 0.00 0.00 27.41 29.81 2r1f h HIS 323 CO 0.00 0.60 -0.03 -0.91 0.71 0.00 0.00 177.93 178.30 2r1f h ASN 324 N -0.10 0.15 -0.14 3.26 2.35 -0.80 0.28 115.58 120.58 2r1f h ASN 324 Ca 0.03 -0.02 -0.01 0.00 -0.55 0.00 0.00 56.30 55.75 2r1f h ASN 324 Cb 0.52 -0.04 -0.01 0.00 0.05 0.00 0.00 38.32 38.85 2r1f h ASN 324 CO 0.02 0.21 0.06 0.11 -1.65 0.00 0.00 177.43 176.18 2r1f h LYS 325 N 0.16 0.20 -0.27 0.81 1.57 -1.26 -2.51 116.57 115.27 2r1f h LYS 325 Ca 0.04 -0.03 -0.04 0.00 -1.87 0.00 0.00 60.65 58.74 2r1f h LYS 325 Cb 0.16 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.43 2r1f h LYS 325 CO 0.01 0.29 -0.03 0.77 -0.57 0.00 0.00 179.45 179.91 2r1f h SER 326 N 0.08 0.39 -0.14 0.86 0.02 -0.53 -0.56 113.55 113.66 2r1f h SER 326 Ca 0.05 -0.07 -0.01 0.00 -0.84 0.00 0.00 61.79 60.92 2r1f h SER 326 Cb 0.16 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 62.59 2r1f h SER 326 CO -0.00 0.47 0.06 0.58 -1.14 0.00 0.00 176.83 176.80 2r1f h VAL 327 N 0.40 1.15 -0.96 2.27 2.07 -0.98 -1.50 116.25 118.70 2r1f h VAL 327 Ca 0.09 -0.43 0.03 0.00 0.82 0.00 0.00 66.70 67.20 2r1f h VAL 327 Cb 0.31 1.17 -0.05 0.00 -1.52 0.00 0.00 31.29 31.20 2r1f h VAL 327 CO 0.01 0.13 0.63 1.56 0.02 0.00 0.00 177.57 179.93 2r1f h GLN 328 N 0.08 1.21 -0.74 1.57 1.08 -0.96 -0.64 115.11 116.71 2r1f h GLN 328 Ca 0.05 -0.07 -0.03 0.00 -1.45 0.00 0.00 58.65 57.14 2r1f h GLN 328 Cb 0.16 -0.27 -0.03 0.00 -0.05 0.00 0.00 27.48 27.28 2r1f h GLN 328 CO -0.00 0.80 0.34 -0.44 -0.95 0.00 0.00 178.83 178.58 2r1f h ASP 329 N 1.25 0.97 -0.33 1.46 3.32 -0.95 -2.46 116.42 119.68 2r1f h ASP 329 Ca 0.37 -0.12 -0.16 0.00 0.02 0.00 0.00 57.03 57.14 2r1f h ASP 329 Cb -0.06 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.24 2r1f h ASP 329 CO -0.10 0.83 -0.41 0.22 -1.72 0.00 0.00 179.24 178.07 2r1f h TYR 330 N 1.06 1.07 0.00 4.55 3.20 -0.65 -3.00 116.97 123.20 2r1f h TYR 330 Ca 0.25 -0.33 -0.07 0.00 3.14 0.00 0.00 58.73 61.73 2r1f h TYR 330 Cb 0.13 -0.22 -0.01 0.00 1.54 0.00 0.00 36.73 38.17 2r1f h TYR 330 CO 0.01 1.14 -0.31 -0.07 -1.64 0.00 0.00 178.16 177.29 2r1f h LEU 331 N 0.72 0.00 -0.21 2.82 3.38 -0.96 -2.27 115.31 118.79 2r1f h LEU 331 Ca 0.05 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.84 2r1f h LEU 331 Cb 0.99 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.75 2r1f h LEU 331 CO 0.10 0.31 -0.59 0.11 0.09 0.00 0.00 178.44 178.46 2r1f h LYS 332 N 0.00 0.77 -0.57 1.13 1.57 -1.42 -1.76 116.57 116.30 2r1f h LYS 332 Ca -0.00 -0.55 0.02 0.00 -1.87 0.00 0.00 60.65 58.25 2r1f h LYS 332 Cb 0.71 0.09 -0.04 0.00 0.08 0.00 0.00 32.23 33.07 2r1f h LYS 332 CO 0.04 1.17 0.35 0.28 -0.57 0.00 0.00 179.45 180.72 2r1f h VAL 333 N 0.50 1.07 0.00 0.50 2.07 -1.36 -0.77 116.25 118.26 2r1f h VAL 333 Ca -0.01 -0.24 -0.08 0.00 0.82 0.00 0.00 66.70 67.19 2r1f h VAL 333 Cb 1.21 0.32 -0.01 0.00 -1.52 0.00 0.00 31.29 31.29 2r1f h VAL 333 CO 0.13 0.13 -0.37 -0.07 0.02 0.00 0.00 177.57 177.41 2r1f h LEU 334 N 0.69 0.00 -0.09 2.57 3.38 -1.41 -1.86 115.31 118.58 2r1f h LEU 334 Ca 0.23 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.15 2r1f h LEU 334 Cb 0.01 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.76 2r1f h LEU 334 CO -0.09 0.37 -0.11 0.50 0.09 0.00 0.00 178.44 179.19 2r1f h LYS 335 N 0.00 0.23 -0.39 1.13 3.64 -0.78 -2.02 116.57 118.39 2r1f h LYS 335 Ca -0.00 -0.13 -0.03 0.00 -1.27 0.00 0.00 60.65 59.21 2r1f h LYS 335 Cb 0.75 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.56 2r1f h LYS 335 CO 0.05 0.68 0.09 0.93 -2.27 0.00 0.00 179.45 178.93 2r1f h GLU 336 N -0.20 0.58 -0.00 1.90 3.07 -1.08 -1.62 114.58 117.22 2r1f h GLU 336 Ca 0.01 -0.10 -0.11 0.00 -0.50 0.00 0.00 59.36 58.67 2r1f h GLU 336 Cb 0.65 -0.10 0.01 0.00 -0.84 0.00 0.00 28.75 28.47 2r1f h GLU 336 CO 0.03 0.53 -0.42 -0.22 -1.40 0.00 0.00 179.01 177.52 2r1f h LYS 337 N 0.56 0.29 0.10 2.33 3.64 -1.37 -3.40 116.57 118.73 2r1f h LYS 337 Ca 0.13 -0.31 -0.33 0.00 -1.27 0.00 0.00 60.65 58.87 2r1f h LYS 337 Cb 0.22 0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.11 2r1f h LYS 337 CO -0.00 1.01 -1.80 -0.91 -2.27 0.00 0.00 179.45 175.48 2r1f h ASN 338 N -0.30 0.34 -3.52 4.20 2.35 -1.36 -3.46 115.58 113.83 2r1f h ASN 338 Ca -0.05 -0.65 -0.53 0.00 -0.55 0.00 0.00 56.30 54.52 2r1f h ASN 338 Cb 1.16 -0.11 -0.03 0.00 0.05 0.00 0.00 38.32 39.38 2r1f h ASN 338 CO 0.08 1.57 0.06 0.00 -1.65 0.00 0.00 177.43 177.50 2r1f s ALA 339 N -2.58 3.45 0.00 -0.83 0.00 -0.61 -5.09 121.76 116.09 2r1f s ALA 339 Ca -0.15 0.09 0.00 0.00 0.00 0.00 0.00 51.96 51.90 2r1f s ALA 339 Cb 0.07 -2.75 0.00 0.00 0.00 0.00 0.00 23.12 20.44 2r1f s ALA 339 CO 0.81 0.36 0.45 1.04 0.00 0.00 0.00 175.76 178.42