#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r58 s VAL 111 N 0.00 2.52 0.19 -0.18 -7.23 -1.26 -4.71 120.40 109.73 1r58 s VAL 111 Ca 0.00 -0.58 0.04 0.00 -1.81 0.00 0.00 61.98 59.62 1r58 s VAL 111 Cb 0.00 -2.93 -0.03 0.00 0.56 0.00 0.00 36.38 33.97 1r58 s VAL 111 CO 0.00 0.00 0.31 -1.58 -0.31 0.00 0.00 175.10 173.52 1r58 s GLN 112 N -4.90 3.40 0.74 4.82 0.74 -1.26 -5.00 119.66 118.20 1r58 s GLN 112 Ca 0.59 -0.69 -0.11 0.00 0.05 0.00 0.00 55.36 55.20 1r58 s GLN 112 Cb -0.10 -2.91 0.04 0.00 1.10 0.00 0.00 33.01 31.14 1r58 s GLN 112 CO 0.40 0.48 1.08 0.95 -0.55 0.00 0.00 175.29 177.65 1r58 s THR 113 N -1.85 3.58 0.00 -0.34 -4.23 -1.26 -5.00 115.64 106.54 1r58 s THR 113 Ca 0.34 0.51 0.00 0.00 -1.18 0.00 0.00 61.69 61.36 1r58 s THR 113 Cb -0.10 -3.26 0.00 0.00 1.34 0.00 0.00 72.50 70.48 1r58 s THR 113 CO 0.28 -0.67 0.88 -0.67 -0.54 0.00 0.00 174.62 173.91 1r58 n ASP 114 N -3.27 0.00 -4.61 3.99 4.64 -1.26 -3.51 116.55 112.53 1r58 n ASP 114 Ca 0.07 0.88 -0.43 0.00 -1.38 0.00 0.00 54.79 53.94 1r58 n ASP 114 Cb 0.55 -0.38 -0.02 0.00 -1.04 0.00 0.00 41.12 40.22 1r58 n ASP 114 CO 0.00 0.00 0.00 -2.84 -0.82 0.00 0.00 177.20 173.54 1r58 s PRO 115 N -2.54 3.69 -0.32 -0.67 0.02 -1.26 -4.88 135.00 129.04 1r58 s PRO 115 Ca 0.00 1.15 -0.44 0.00 0.02 0.00 0.00 61.00 61.73 1r58 s PRO 115 Cb 0.00 -3.99 -0.19 0.00 0.02 0.00 0.00 34.50 30.34 1r58 s PRO 115 CO 0.00 -1.42 1.49 -2.30 -0.33 0.00 0.00 177.00 174.44 1r58 n PRO 116 N 7.82 0.23 0.00 5.54 -0.02 -1.23 -4.79 135.00 142.55 1r58 n PRO 116 Ca 0.17 0.08 0.00 0.00 -2.02 0.00 0.00 63.50 61.73 1r58 n PRO 116 Cb 0.47 -1.62 0.00 0.00 -0.02 0.00 0.00 33.50 32.33 1r58 n PRO 116 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1r58 n SER 117 N 3.55 0.00 -4.65 2.55 3.41 -1.26 -4.89 113.62 112.33 1r58 n SER 117 Ca 0.27 0.00 -0.41 0.00 -0.26 0.00 0.00 58.87 58.47 1r58 n SER 117 Cb 0.01 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 63.92 1r58 n SER 117 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1r58 s VAL 118 N 0.00 4.90 0.33 -3.33 1.01 -1.26 -4.70 120.40 117.35 1r58 s VAL 118 Ca 0.00 1.45 -0.28 0.00 0.00 0.00 0.00 61.98 63.16 1r58 s VAL 118 Cb 0.00 -4.07 -0.13 0.00 0.00 0.00 0.00 36.38 32.19 1r58 s VAL 118 CO 0.00 -0.01 1.16 -2.65 0.00 0.00 0.00 175.10 173.61 1r58 n PRO 119 N 5.64 1.77 0.01 2.72 -0.02 -1.26 -4.66 135.00 139.20 1r58 n PRO 119 Ca 0.03 0.62 0.15 0.00 -2.02 0.00 0.00 63.50 62.28 1r58 n PRO 119 Cb 0.48 -2.12 0.60 0.00 -0.02 0.00 0.00 33.50 32.44 1r58 n PRO 119 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 1r58 h ILE 120 N 2.25 0.85 -0.81 4.25 1.08 -1.33 -0.78 117.51 123.02 1r58 h ILE 120 Ca -0.43 -0.06 0.01 0.00 -0.39 0.00 0.00 64.86 63.99 1r58 h ILE 120 Cb 1.31 0.66 -0.04 0.00 -3.07 0.00 0.00 36.82 35.68 1r58 h ILE 120 CO 0.61 0.03 0.54 0.00 -0.69 0.00 0.00 178.15 178.64 1r58 n ASP 122 N -4.41 0.42 0.11 0.00 8.00 -0.31 -3.18 116.55 117.17 1r58 n ASP 122 Ca 0.09 0.40 0.12 0.00 0.71 0.00 0.00 54.79 56.11 1r58 n ASP 122 Cb 0.03 -0.45 0.23 0.00 -0.02 0.00 0.00 41.12 40.91 1r58 n ASP 122 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1r58 h LEU 123 N 0.00 0.00 -6.37 0.64 3.38 -1.17 -3.39 115.31 108.41 1r58 h LEU 123 Ca 0.00 -0.07 -0.59 0.00 0.09 0.00 0.00 57.88 57.31 1r58 h LEU 123 Cb 0.61 0.00 -0.39 0.00 0.09 0.00 0.00 40.66 40.97 1r58 h LEU 123 CO 0.00 0.04 -0.90 -1.22 0.09 0.00 0.00 178.44 176.45 1r58 n TYR 124 N -2.43 0.52 0.25 1.13 4.02 -1.15 -4.88 117.16 114.62 1r58 n TYR 124 Ca 0.04 -3.66 0.13 0.00 -0.01 0.00 0.00 57.90 54.40 1r58 n TYR 124 Cb 0.47 -0.16 0.70 0.00 -0.02 0.00 0.00 39.34 40.33 1r58 n TYR 124 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 176.86 174.85 1r58 h PRO 125 N 4.95 0.00 -0.00 -0.72 0.13 -1.75 -1.23 132.00 133.38 1r58 h PRO 125 Ca 0.18 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.31 1r58 h PRO 125 Cb 0.84 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.97 1r58 h PRO 125 CO 0.51 0.00 -0.01 0.27 -0.23 0.00 0.00 178.00 178.55 1r58 n ASN 126 N -2.54 0.15 0.00 1.44 0.23 -1.26 -4.89 115.26 108.39 1r58 n ASN 126 Ca -0.02 -0.85 0.00 0.00 -0.53 0.00 0.00 54.58 53.18 1r58 n ASN 126 Cb 0.24 -0.06 0.00 0.00 -2.08 0.00 0.00 39.78 37.88 1r58 n ASN 126 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1r58 n GLY 127 N 1.08 0.24 3.31 4.83 0.00 -0.46 -4.96 105.19 109.23 1r58 n GLY 127 Ca 0.21 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.87 1r58 n GLY 127 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1r58 s VAL 128 N -1.58 3.62 0.10 1.61 1.01 -1.26 -5.03 120.40 118.88 1r58 s VAL 128 Ca 0.00 -0.73 0.02 0.00 0.00 0.00 0.00 61.98 61.28 1r58 s VAL 128 Cb 0.00 -2.83 -0.04 0.00 0.00 0.00 0.00 36.38 33.51 1r58 s VAL 128 CO 0.00 0.17 0.18 -0.36 0.00 0.00 0.00 175.10 175.09 1r58 s PHE 129 N 1.46 3.36 0.30 5.22 0.40 -1.26 -4.93 117.98 122.53 1r58 s PHE 129 Ca 0.03 0.13 -0.29 0.00 -0.60 0.00 0.00 56.93 56.19 1r58 s PHE 129 Cb -0.17 -1.66 -0.13 0.00 0.51 0.00 0.00 43.02 41.58 1r58 s PHE 129 CO -0.00 0.54 1.38 -0.35 0.70 0.00 0.00 175.22 177.49 1r58 n PRO 130 N 0.02 2.17 -1.94 0.24 -0.04 -1.26 -4.94 135.00 129.25 1r58 n PRO 130 Ca -0.07 0.77 -0.31 0.00 -0.04 0.00 0.00 63.50 63.85 1r58 n PRO 130 Cb 0.52 -2.41 0.01 0.00 -0.04 0.00 0.00 33.50 31.59 1r58 n PRO 130 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1r58 s LYS 131 N -1.15 3.57 0.00 0.54 1.02 -1.26 -4.81 119.74 117.65 1r58 s LYS 131 Ca 0.61 0.69 0.00 0.00 0.02 0.00 0.00 55.97 57.29 1r58 s LYS 131 Cb -0.59 -2.11 0.00 0.00 -0.52 0.00 0.00 37.83 34.62 1r58 s LYS 131 CO 0.56 -0.55 0.00 0.41 -0.92 0.00 0.00 175.35 174.85 1r58 n GLY 132 N -2.71 0.26 3.67 -3.33 0.00 -1.26 -4.97 105.19 96.84 1r58 n GLY 132 Ca 0.06 -1.86 -0.42 0.00 0.00 0.00 0.00 46.02 43.80 1r58 n GLY 132 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1r58 s GLN 133 N -1.68 4.18 -0.23 1.61 0.74 -1.10 -4.76 119.66 118.41 1r58 s GLN 133 Ca 0.00 2.35 -0.13 0.00 0.05 0.00 0.00 55.36 57.63 1r58 s GLN 133 Cb 0.00 -3.90 -0.04 0.00 1.10 0.00 0.00 33.01 30.17 1r58 s GLN 133 CO 0.00 -0.84 0.27 -1.21 -0.55 0.00 0.00 175.29 172.96 1r58 s GLU 134 N 3.67 4.09 0.09 1.67 2.02 -1.26 -0.20 118.70 128.78 1r58 s GLU 134 Ca 0.78 -0.08 0.09 0.00 0.02 0.00 0.00 54.97 55.77 1r58 s GLU 134 Cb -0.38 -3.56 -0.03 0.00 0.10 0.00 0.00 34.13 30.25 1r58 s GLU 134 CO 0.34 -0.04 -0.23 0.00 0.02 0.00 0.00 175.26 175.35 1r58 s GLU 136 N -1.76 4.79 0.57 0.00 2.12 -1.26 -0.87 118.70 122.28 1r58 s GLU 136 Ca 0.09 1.51 -0.20 0.00 0.36 0.00 0.00 54.97 56.73 1r58 s GLU 136 Cb -0.10 -3.20 -0.04 0.00 0.26 0.00 0.00 34.13 31.06 1r58 s GLU 136 CO 0.04 0.44 1.28 0.71 -0.54 0.00 0.00 175.26 177.19 1r58 s TYR 137 N -1.24 2.34 0.58 5.30 1.51 -1.26 -4.87 117.35 119.71 1r58 s TYR 137 Ca 0.43 1.45 -0.19 0.00 -1.01 0.00 0.00 57.07 57.75 1r58 s TYR 137 Cb -0.26 -3.65 -0.04 0.00 -0.11 0.00 0.00 41.96 37.91 1r58 s TYR 137 CO 0.32 -2.56 1.23 -1.25 -1.11 0.00 0.00 175.55 172.19 1r58 s PRO 138 N -3.09 3.00 0.85 -1.71 0.04 -1.26 -4.08 135.00 128.75 1r58 s PRO 138 Ca 0.74 1.91 -0.12 0.00 0.04 0.00 0.00 61.00 63.57 1r58 s PRO 138 Cb -0.36 -2.00 0.11 0.00 0.04 0.00 0.00 34.50 32.29 1r58 s PRO 138 CO 0.41 -1.20 1.18 -1.25 0.04 0.00 0.00 177.00 176.17 1r58 s PRO 139 N -3.23 1.43 0.00 0.56 0.04 -1.26 -4.70 135.00 127.83 1r58 s PRO 139 Ca 0.76 1.65 0.00 0.00 0.04 0.00 0.00 61.00 63.46 1r58 s PRO 139 Cb -0.32 -1.76 0.00 0.00 0.04 0.00 0.00 34.50 32.45 1r58 s PRO 139 CO 0.36 -2.35 0.00 2.41 0.04 0.00 0.00 177.00 177.46 1r58 n THR 140 N -3.66 0.00 0.00 1.26 -1.04 -1.26 -4.95 114.28 104.63 1r58 n THR 140 Ca 0.13 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.14 1r58 n THR 140 Cb 0.51 -0.03 0.00 0.00 -1.82 0.00 0.00 70.33 68.99 1r58 n THR 140 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1r58 n GLN 141 N 0.00 0.00 -1.55 -2.82 10.64 -1.26 -4.99 117.38 117.40 1r58 n GLN 141 Ca 0.00 0.00 -0.05 0.00 -1.83 0.00 0.00 57.00 55.12 1r58 n GLN 141 Cb 0.00 0.00 -0.01 0.00 -0.86 0.00 0.00 30.24 29.37 1r58 n GLN 141 CO 0.00 0.00 0.00 -0.40 -1.83 0.00 0.00 177.06 174.83 1r58 n ASP 142 N 0.00 -0.94 -0.75 2.61 5.75 -1.26 -4.96 116.55 117.00 1r58 n ASP 142 Ca 0.00 -2.06 -0.08 0.00 -0.01 0.00 0.00 54.79 52.63 1r58 n ASP 142 Cb 0.00 0.35 -0.03 0.00 -1.03 0.00 0.00 41.12 40.42 1r58 n ASP 142 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1r58 n GLY 143 N -0.42 0.69 2.82 6.12 0.00 -1.26 -4.92 105.19 108.21 1r58 n GLY 143 Ca -0.22 -0.62 -0.38 0.00 0.00 0.00 0.00 46.02 44.80 1r58 n GLY 143 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1r58 n ARG 144 N -2.44 2.83 0.00 1.61 0.00 -1.26 -4.94 116.66 112.47 1r58 n ARG 144 Ca -0.09 -3.62 0.00 0.00 -0.00 0.00 0.00 57.85 54.14 1r58 n ARG 144 Cb 0.38 -2.27 0.00 0.00 0.00 0.00 0.00 32.46 30.57 1r58 n ARG 144 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.63 177.88 1r58 n THR 145 N -0.56 0.00 -1.35 5.15 -2.24 -1.26 -4.04 114.28 109.97 1r58 n THR 145 Ca 0.53 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.31 1r58 n THR 145 Cb 0.32 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.55 1r58 n THR 145 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1r58 n ALA 146 N -3.00 0.00 0.61 6.98 0.00 -1.26 -4.83 120.51 119.00 1r58 n ALA 146 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.49 1r58 n ALA 146 Cb 0.00 0.00 0.27 0.00 0.00 0.00 0.00 19.45 19.72 1r58 n ALA 146 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1r58 n ALA 147 N 0.00 1.86 -0.01 0.00 0.00 -1.26 -0.93 120.51 120.16 1r58 n ALA 147 Ca 0.00 -0.06 0.02 0.00 0.00 0.00 0.00 53.44 53.40 1r58 n ALA 147 Cb 0.21 -1.15 -0.06 0.00 0.00 0.00 0.00 19.45 18.45 1r58 n ALA 147 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 177.50 174.83 1r58 n TRP 148 N -0.97 0.00 0.23 0.00 4.27 -1.26 -4.57 117.44 115.14 1r58 n TRP 148 Ca 0.07 0.00 -0.12 0.00 -3.89 0.00 0.00 57.50 53.56 1r58 n TRP 148 Cb 0.03 -0.24 -0.06 0.00 -1.36 0.00 0.00 31.31 29.68 1r58 n TRP 148 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1r58 h ARG 149 N 0.00 -0.61 0.00 -2.67 3.08 -1.30 0.87 114.38 113.75 1r58 h ARG 149 Ca -0.06 0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.03 1r58 h ARG 149 Cb 0.68 0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.87 1r58 h ARG 149 CO 0.00 -0.33 0.00 2.41 -1.07 0.00 0.00 179.97 180.99 1r58 n THR 150 N -5.22 0.49 -0.05 2.04 -1.04 -0.20 -2.06 114.28 108.25 1r58 n THR 150 Ca -0.09 0.12 -0.06 0.00 -2.04 0.00 0.00 64.05 61.98 1r58 n THR 150 Cb 0.29 -1.12 -0.05 0.00 -1.82 0.00 0.00 70.33 67.64 1r58 n THR 150 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 1r58 n THR 151 N -1.12 0.55 -1.45 12.58 -2.24 -1.02 -5.00 114.28 116.58 1r58 n THR 151 Ca 0.00 -0.23 -0.40 0.00 -2.27 0.00 0.00 64.05 61.15 1r58 n THR 151 Cb 0.00 -0.83 0.02 0.00 -2.10 0.00 0.00 70.33 67.42 1r58 n THR 151 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1r58 n SER 152 N -2.68 -1.06 0.02 3.42 2.88 0.30 -4.90 113.62 111.60 1r58 n SER 152 Ca -0.16 0.84 -0.19 0.00 -1.33 0.00 0.00 58.87 58.02 1r58 n SER 152 Cb 0.70 -1.12 -0.14 0.00 -0.75 0.00 0.00 64.21 62.89 1r58 n SER 152 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 1r58 h GLU 153 N 0.59 0.24 -0.17 -1.46 4.57 -1.89 -2.85 114.58 113.61 1r58 h GLU 153 Ca -0.42 -0.41 -0.07 0.00 -1.18 0.00 0.00 59.36 57.28 1r58 h GLU 153 Cb 1.40 0.15 -0.01 0.00 -0.16 0.00 0.00 28.75 30.13 1r58 h GLU 153 CO 0.49 1.20 -0.22 1.05 -1.18 0.00 0.00 179.01 180.35 1r58 h GLU 154 N -0.47 0.29 -0.13 1.92 4.11 -1.97 -2.08 114.58 116.25 1r58 h GLU 154 Ca -0.15 -0.09 -0.06 0.00 0.07 0.00 0.00 59.36 59.13 1r58 h GLU 154 Cb 1.56 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 30.78 1r58 h GLU 154 CO 0.11 0.50 -0.14 0.87 0.07 0.00 0.00 179.01 180.42 1r58 h LYS 155 N 0.27 0.33 -0.28 1.06 1.79 -1.88 -0.70 116.57 117.15 1r58 h LYS 155 Ca 0.05 -0.18 0.08 0.00 -2.18 0.00 0.00 60.65 58.42 1r58 h LYS 155 Cb 0.54 0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 31.18 1r58 h LYS 155 CO 0.04 0.72 0.21 0.87 -1.08 0.00 0.00 179.45 180.21 1r58 h LYS 156 N -0.05 0.00 0.09 3.15 1.57 -1.29 0.25 116.57 120.28 1r58 h LYS 156 Ca 0.02 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.80 1r58 h LYS 156 Cb 0.66 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.98 1r58 h LYS 156 CO 0.03 0.00 -0.04 0.00 -0.57 0.00 0.00 179.45 178.87 1r58 h ALA 157 N 1.85 -0.11 -0.78 3.86 0.00 -1.03 -0.77 119.26 122.29 1r58 h ALA 157 Ca 0.14 -0.27 0.04 0.00 0.00 0.00 0.00 54.91 54.82 1r58 h ALA 157 Cb 0.55 0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.33 1r58 h ALA 157 CO -0.00 -0.25 0.48 -0.07 0.00 0.00 0.00 179.25 179.41 1r58 h LEU 158 N -0.74 0.77 0.43 0.00 3.38 -0.18 -0.93 115.31 118.04 1r58 h LEU 158 Ca -0.01 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 1r58 h LEU 158 Cb 0.57 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.17 1r58 h LEU 158 CO 0.02 0.51 -0.20 -0.78 0.09 0.00 0.00 178.44 178.08 1r58 h ASP 159 N 0.91 -0.48 -0.13 -0.43 3.58 -0.58 -2.84 116.42 116.45 1r58 h ASP 159 Ca 0.32 -0.08 0.04 0.00 0.42 0.00 0.00 57.03 57.73 1r58 h ASP 159 Cb 0.09 0.13 -0.01 0.00 1.72 0.00 0.00 39.33 41.26 1r58 h ASP 159 CO -0.14 -0.19 0.15 -0.61 -2.88 0.00 0.00 179.24 175.57 1r58 h GLN 160 N -0.78 0.00 0.00 0.28 -0.00 -0.96 -0.46 115.11 113.20 1r58 h GLN 160 Ca -0.06 0.00 -0.04 0.00 -0.00 0.00 0.00 58.65 58.55 1r58 h GLN 160 Cb 0.54 0.00 -0.01 0.00 0.00 0.00 0.00 27.48 28.01 1r58 h GLN 160 CO 0.10 0.00 -0.19 0.00 0.00 0.00 0.00 178.83 178.74 1r58 h ALA 161 N 1.81 1.69 -0.43 3.38 0.00 -0.91 -2.30 119.26 122.50 1r58 h ALA 161 Ca 0.06 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1r58 h ALA 161 Cb 0.37 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1r58 h ALA 161 CO -0.00 0.23 0.00 0.43 0.00 0.00 0.00 179.25 179.91 1r58 n SER 162 N -4.31 4.80 -0.31 0.00 7.64 -0.19 -4.67 113.62 116.58 1r58 n SER 162 Ca -0.02 -2.94 0.10 0.00 1.01 0.00 0.00 58.87 57.02 1r58 n SER 162 Cb 0.25 -0.61 0.27 0.00 -1.01 0.00 0.00 64.21 63.11 1r58 n SER 162 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 1r58 h GLU 163 N 2.95 0.59 -0.52 1.43 4.57 -1.34 0.99 114.58 123.26 1r58 h GLU 163 Ca 0.00 -0.04 -0.02 0.00 -1.18 0.00 0.00 59.36 58.12 1r58 h GLU 163 Cb 1.69 -0.13 -0.03 0.00 -0.16 0.00 0.00 28.75 30.12 1r58 h GLU 163 CO 0.35 0.39 0.23 0.93 -1.18 0.00 0.00 179.01 179.73 1r58 h GLU 164 N 0.61 0.74 -0.06 1.92 5.08 -1.83 0.12 114.58 121.15 1r58 h GLU 164 Ca 0.52 -0.10 -0.02 0.00 -1.00 0.00 0.00 59.36 58.76 1r58 h GLU 164 Cb 0.81 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.92 1r58 h GLU 164 CO -0.40 0.59 -0.03 0.82 -1.00 0.00 0.00 179.01 178.98 1r58 h ILE 165 N 0.73 1.34 -0.81 3.13 2.04 -1.20 -1.94 117.51 120.80 1r58 h ILE 165 Ca 0.18 -1.08 0.02 0.00 1.00 0.00 0.00 64.86 64.99 1r58 h ILE 165 Cb 0.11 1.94 -0.04 0.00 -0.74 0.00 0.00 36.82 38.08 1r58 h ILE 165 CO -0.02 0.29 0.54 -0.50 0.00 0.00 0.00 178.15 178.46 1r58 h TRP 166 N -0.28 0.99 -0.66 1.37 -0.00 -1.02 -1.68 115.95 114.68 1r58 h TRP 166 Ca 0.01 0.02 -0.04 0.00 -0.00 0.00 0.00 58.89 58.89 1r58 h TRP 166 Cb 0.49 -0.33 -0.03 0.00 -0.00 0.00 0.00 29.16 29.29 1r58 h TRP 166 CO 0.07 0.60 0.26 -0.97 -0.00 0.00 0.00 178.44 178.40 1r58 h ASN 167 N 1.04 0.89 -0.51 -3.49 -1.24 -0.61 -0.77 115.58 110.89 1r58 h ASN 167 Ca 0.31 -0.13 -0.12 0.00 0.71 0.00 0.00 56.30 57.08 1r58 h ASN 167 Cb -0.03 -0.23 -0.02 0.00 0.73 0.00 0.00 38.32 38.77 1r58 h ASN 167 CO -0.08 0.80 -0.13 0.44 -1.29 0.00 0.00 177.43 177.17 1r58 h ASP 168 N 0.95 1.01 -0.58 1.15 3.32 -0.51 -1.35 116.42 120.40 1r58 h ASP 168 Ca 0.22 -0.34 -0.03 0.00 0.02 0.00 0.00 57.03 56.90 1r58 h ASP 168 Cb 0.19 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.44 1r58 h ASP 168 CO -0.02 1.13 0.25 -0.26 -1.72 0.00 0.00 179.24 178.62 1r58 h PHE 169 N 0.89 0.87 -0.68 4.55 -1.00 -0.99 -2.29 116.94 118.28 1r58 h PHE 169 Ca 0.13 -0.06 -0.04 0.00 2.81 0.00 0.00 57.97 60.82 1r58 h PHE 169 Cb 0.69 -0.26 -0.03 0.00 3.61 0.00 0.00 35.95 39.95 1r58 h PHE 169 CO 0.05 0.69 0.27 0.00 -1.61 0.00 0.00 178.31 177.70 1r58 h ARG 170 N 0.79 1.00 -0.37 1.51 3.08 -0.86 0.15 114.38 119.68 1r58 h ARG 170 Ca 0.20 -0.17 -0.10 0.00 0.07 0.00 0.00 59.98 59.98 1r58 h ARG 170 Cb 0.17 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 30.04 1r58 h ARG 170 CO -0.02 0.82 -0.17 1.49 -1.07 0.00 0.00 179.97 181.02 1r58 h GLU 171 N 0.98 0.69 -0.14 0.04 4.81 -1.03 -1.02 114.58 118.90 1r58 h GLU 171 Ca 0.23 -0.24 -0.17 0.00 -0.13 0.00 0.00 59.36 59.04 1r58 h GLU 171 Cb 0.19 -0.05 -0.00 0.00 0.63 0.00 0.00 28.75 29.52 1r58 h GLU 171 CO -0.02 0.82 -0.63 0.00 -0.73 0.00 0.00 179.01 178.45 1r58 h ALA 172 N 1.20 0.64 -0.51 2.92 0.00 -0.82 -2.75 119.26 119.93 1r58 h ALA 172 Ca 0.10 -0.55 -0.13 0.00 0.00 0.00 0.00 54.91 54.33 1r58 h ALA 172 Cb 0.63 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 1r58 h ALA 172 CO 0.04 0.71 -0.17 0.00 0.00 0.00 0.00 179.25 179.83 1r58 h ALA 173 N 0.93 0.72 -0.37 0.00 0.00 -0.41 -1.46 119.26 118.66 1r58 h ALA 173 Ca -0.01 -0.38 -0.10 0.00 0.00 0.00 0.00 54.91 54.42 1r58 h ALA 173 Cb 1.19 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.78 1r58 h ALA 173 CO 0.11 0.68 -0.19 1.49 0.00 0.00 0.00 179.25 181.34 1r58 h GLU 174 N 0.88 0.71 -0.63 0.00 4.57 -1.20 0.76 114.58 119.67 1r58 h GLU 174 Ca 0.12 -0.26 -0.07 0.00 -1.18 0.00 0.00 59.36 57.96 1r58 h GLU 174 Cb 0.75 -0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 29.27 1r58 h GLU 174 CO 0.06 0.85 0.11 0.00 -1.18 0.00 0.00 179.01 178.85 1r58 h ALA 175 N 1.16 0.84 -0.62 2.92 0.00 -1.32 -1.75 119.26 120.48 1r58 h ALA 175 Ca 0.10 -0.26 -0.04 0.00 0.00 0.00 0.00 54.91 54.70 1r58 h ALA 175 Cb 0.67 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 1r58 h ALA 175 CO 0.05 0.60 0.23 1.25 0.00 0.00 0.00 179.25 181.38 1r58 h HIS 176 N 0.96 0.96 -0.24 0.00 -0.00 -0.57 -0.71 115.15 115.54 1r58 h HIS 176 Ca 0.19 -0.08 -0.02 0.00 -0.00 0.00 0.00 60.37 60.47 1r58 h HIS 176 Cb 0.43 -0.28 -0.01 0.00 -0.00 0.00 0.00 27.41 27.54 1r58 h HIS 176 CO 0.03 0.77 0.08 0.00 -0.00 0.00 0.00 177.93 178.81 1r58 h ARG 177 N 0.87 0.37 -0.32 5.26 3.08 -0.67 -1.85 114.38 121.13 1r58 h ARG 177 Ca 0.20 -0.08 -0.10 0.00 0.07 0.00 0.00 59.98 60.08 1r58 h ARG 177 Cb 0.23 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.21 1r58 h ARG 177 CO -0.01 0.45 -0.21 1.96 -1.07 0.00 0.00 179.97 181.08 1r58 h GLN 178 N 0.23 0.61 -0.16 0.04 4.20 -1.19 -1.98 115.11 116.87 1r58 h GLN 178 Ca 0.08 -0.22 -0.04 0.00 0.06 0.00 0.00 58.65 58.53 1r58 h GLN 178 Cb 0.23 -0.04 -0.00 0.00 0.30 0.00 0.00 27.48 27.96 1r58 h GLN 178 CO -0.00 0.78 -0.05 0.28 -0.67 0.00 0.00 178.83 179.17 1r58 h VAL 179 N 0.54 1.29 -0.21 -0.54 2.07 -1.04 -2.60 116.25 115.76 1r58 h VAL 179 Ca 0.08 -1.02 -0.09 0.00 0.82 0.00 0.00 66.70 66.48 1r58 h VAL 179 Cb 0.66 1.65 -0.01 0.00 -1.52 0.00 0.00 31.29 32.07 1r58 h VAL 179 CO 0.05 0.30 -0.27 0.08 0.02 0.00 0.00 177.57 177.75 1r58 h ARG 180 N 0.00 0.39 -0.60 1.57 0.11 -1.29 0.61 114.38 115.18 1r58 h ARG 180 Ca 0.04 -0.15 -0.04 0.00 0.10 0.00 0.00 59.98 59.93 1r58 h ARG 180 Cb 0.49 -0.02 -0.03 0.00 1.11 0.00 0.00 29.97 31.52 1r58 h ARG 180 CO 0.02 0.63 0.22 -0.22 0.10 0.00 0.00 179.97 180.72 1r58 h LYS 181 N 0.35 0.90 0.04 0.08 3.64 -1.36 -0.30 116.57 119.92 1r58 h LYS 181 Ca 0.05 -0.17 -0.00 0.00 -1.27 0.00 0.00 60.65 59.26 1r58 h LYS 181 Cb 0.66 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.34 1r58 h LYS 181 CO 0.05 0.78 -0.02 -0.92 -2.27 0.00 0.00 179.45 177.07 1r58 h TYR 182 N 0.83 -0.05 -0.73 1.91 3.20 -1.02 -2.86 116.97 118.25 1r58 h TYR 182 Ca 0.20 -0.00 0.06 0.00 3.14 0.00 0.00 58.73 62.13 1r58 h TYR 182 Cb 0.23 0.02 -0.06 0.00 1.54 0.00 0.00 36.73 38.46 1r58 h TYR 182 CO 0.01 0.03 0.42 0.28 -1.64 0.00 0.00 178.16 177.26 1r58 h VAL 183 N -0.11 0.97 0.00 1.81 2.07 -0.59 -1.88 116.25 118.51 1r58 h VAL 183 Ca -0.01 -0.26 -0.01 0.00 0.82 0.00 0.00 66.70 67.24 1r58 h VAL 183 Cb 0.10 0.14 -0.00 0.00 -1.52 0.00 0.00 31.29 30.01 1r58 h VAL 183 CO 0.01 0.14 -0.05 0.24 0.02 0.00 0.00 177.57 177.93 1r58 h MET 184 N 0.76 0.00 0.00 1.57 2.86 -0.87 -0.73 114.93 118.52 1r58 h MET 184 Ca 0.33 0.00 -0.13 0.00 -2.06 0.00 0.00 59.70 57.84 1r58 h MET 184 Cb 0.21 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.85 1r58 h MET 184 CO -0.19 0.05 -0.60 0.66 1.06 0.00 0.00 176.91 177.89 1r58 h SER 185 N 0.00 0.00 0.00 1.22 4.64 -1.12 -3.38 113.55 114.91 1r58 h SER 185 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1r58 h SER 185 Cb 0.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.20 1r58 h SER 185 CO 0.01 0.60 -0.53 -2.67 -0.87 0.00 0.00 176.83 173.36 1r58 n TRP 186 N -3.53 0.00 -1.75 4.77 4.27 -1.00 -5.01 117.44 115.18 1r58 n TRP 186 Ca -0.00 0.00 -0.42 0.00 -3.89 0.00 0.00 57.50 53.19 1r58 n TRP 186 Cb 0.67 -0.01 -0.03 0.00 -1.36 0.00 0.00 31.31 30.58 1r58 n TRP 186 CO 0.00 0.00 0.00 -1.50 -2.29 0.00 0.00 177.69 173.90 1r58 s ILE 187 N -1.57 2.82 0.01 -1.67 2.07 -0.31 -4.95 121.20 117.60 1r58 s ILE 187 Ca 0.00 0.15 -0.10 0.00 -1.41 0.00 0.00 60.65 59.29 1r58 s ILE 187 Cb 0.01 -3.10 0.01 0.00 0.13 0.00 0.00 42.46 39.51 1r58 s ILE 187 CO 0.04 -0.01 0.20 -0.54 -1.91 0.00 0.00 174.94 172.73 1r58 s LYS 188 N 3.33 0.59 0.63 3.50 -0.14 -1.26 -5.00 119.74 121.38 1r58 s LYS 188 Ca 0.82 -0.40 -0.18 0.00 -1.36 0.00 0.00 55.97 54.84 1r58 s LYS 188 Cb -0.43 0.25 -0.02 0.00 -1.68 0.00 0.00 37.83 35.95 1r58 s LYS 188 CO 0.37 -0.15 1.24 -1.25 -0.76 0.00 0.00 175.35 174.79 1r58 s PRO 189 N -1.67 2.71 0.00 -1.68 0.04 -1.26 -2.72 135.00 130.43 1r58 s PRO 189 Ca -0.12 1.91 0.00 0.00 0.04 0.00 0.00 61.00 62.83 1r58 s PRO 189 Cb -0.05 -1.89 0.00 0.00 0.04 0.00 0.00 34.50 32.60 1r58 s PRO 189 CO 0.01 -1.43 0.00 0.41 0.04 0.00 0.00 177.00 176.03 1r58 n GLY 190 N 0.64 1.77 3.80 0.56 0.00 -0.18 -4.98 105.19 106.80 1r58 n GLY 190 Ca 0.14 -0.15 -0.35 0.00 0.00 0.00 0.00 46.02 45.66 1r58 n GLY 190 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1r58 s MET 191 N 0.00 4.31 0.54 1.61 -1.94 -1.10 -4.79 119.30 117.92 1r58 s MET 191 Ca 0.00 1.25 -0.12 0.00 -1.71 0.00 0.00 55.69 55.11 1r58 s MET 191 Cb 0.00 -2.41 -0.06 0.00 2.01 0.00 0.00 34.83 34.37 1r58 s MET 191 CO 0.00 0.03 0.95 0.95 -0.01 0.00 0.00 175.02 176.94 1r58 s THR 192 N -1.93 4.69 0.40 2.05 -4.23 -1.26 -1.30 115.64 114.05 1r58 s THR 192 Ca 0.58 0.87 0.08 0.00 -1.18 0.00 0.00 61.69 62.05 1r58 s THR 192 Cb -0.14 -3.80 0.21 0.00 1.34 0.00 0.00 72.50 70.10 1r58 s THR 192 CO 0.18 -0.88 1.98 0.24 -0.54 0.00 0.00 174.62 175.60 1r58 h MET 193 N 0.36 0.38 -0.14 3.99 0.00 -1.61 -1.99 114.93 115.91 1r58 h MET 193 Ca -0.46 -0.05 -0.02 0.00 0.00 0.00 0.00 59.70 59.17 1r58 h MET 193 Cb 1.19 -0.07 -0.01 0.00 0.00 0.00 0.00 31.60 32.72 1r58 h MET 193 CO 0.62 0.37 0.03 0.82 0.00 0.00 0.00 176.91 178.74 1r58 h ILE 194 N 0.37 1.21 -1.00 -1.22 2.04 -1.84 -1.55 117.51 115.52 1r58 h ILE 194 Ca 0.09 -0.67 0.09 0.00 1.00 0.00 0.00 64.86 65.37 1r58 h ILE 194 Cb 0.18 1.40 -0.07 0.00 -0.74 0.00 0.00 36.82 37.59 1r58 h ILE 194 CO -0.00 0.20 0.64 -0.33 0.00 0.00 0.00 178.15 178.66 1r58 h GLU 195 N 0.01 1.06 -0.10 2.37 5.08 -1.81 0.17 114.58 121.37 1r58 h GLU 195 Ca 0.04 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.33 1r58 h GLU 195 Cb 0.28 -0.24 -0.00 0.00 0.50 0.00 0.00 28.75 29.29 1r58 h GLU 195 CO 0.00 0.70 0.02 0.82 -1.00 0.00 0.00 179.01 179.56 1r58 h ILE 196 N 1.09 1.19 -0.46 3.13 2.04 -1.14 -2.17 117.51 121.20 1r58 h ILE 196 Ca 0.46 -0.59 -0.12 0.00 1.00 0.00 0.00 64.86 65.61 1r58 h ILE 196 Cb 0.32 1.41 -0.02 0.00 -0.74 0.00 0.00 36.82 37.79 1r58 h ILE 196 CO -0.21 0.17 -0.18 0.00 0.00 0.00 0.00 178.15 177.93 1r58 h GLU 198 N 0.79 0.45 -0.51 0.00 4.39 -0.98 0.12 114.58 118.85 1r58 h GLU 198 Ca 0.11 -0.09 -0.10 0.00 0.34 0.00 0.00 59.36 59.63 1r58 h GLU 198 Cb 0.72 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 29.29 1r58 h GLU 198 CO 0.06 0.49 -0.07 -0.22 -1.16 0.00 0.00 179.01 178.10 1r58 h LYS 199 N 0.32 0.92 0.01 2.33 3.64 -1.35 -0.06 116.57 122.39 1r58 h LYS 199 Ca 0.10 -0.30 -0.00 0.00 -1.27 0.00 0.00 60.65 59.17 1r58 h LYS 199 Cb 0.21 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 31.96 1r58 h LYS 199 CO -0.01 0.95 -0.01 1.25 -2.27 0.00 0.00 179.45 179.37 1r58 h LEU 200 N 0.83 -0.01 -1.15 5.20 6.46 -1.16 -3.04 115.31 122.45 1r58 h LEU 200 Ca 0.14 -0.40 -0.04 0.00 -0.12 0.00 0.00 57.88 57.46 1r58 h LEU 200 Cb 0.59 0.00 -0.02 0.00 -0.73 0.00 0.00 40.66 40.50 1r58 h LEU 200 CO 0.04 0.40 0.14 -0.33 -0.62 0.00 0.00 178.44 178.06 1r58 h GLU 201 N -0.43 0.73 -0.89 1.25 5.08 -0.68 -0.97 114.58 118.67 1r58 h GLU 201 Ca -0.00 -0.13 0.03 0.00 -1.00 0.00 0.00 59.36 58.26 1r58 h GLU 201 Cb 0.42 -0.12 -0.05 0.00 0.50 0.00 0.00 28.75 29.50 1r58 h GLU 201 CO 0.00 0.65 0.58 -0.44 -1.00 0.00 0.00 179.01 178.81 1r58 h ASP 202 N 0.72 0.97 -0.10 1.42 3.45 -1.02 -0.88 116.42 120.97 1r58 h ASP 202 Ca 0.16 -0.01 -0.23 0.00 0.43 0.00 0.00 57.03 57.38 1r58 h ASP 202 Cb 0.24 -0.22 0.01 0.00 -0.56 0.00 0.00 39.33 38.80 1r58 h ASP 202 CO -0.01 0.67 -0.83 0.00 -1.57 0.00 0.00 179.24 177.51 1r58 h SER 204 N 0.51 0.56 -0.55 0.00 0.87 -0.83 -1.14 113.55 112.96 1r58 h SER 204 Ca -0.07 -0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.41 1r58 h SER 204 Cb 1.46 -0.14 -0.03 0.00 -0.44 0.00 0.00 62.40 63.25 1r58 h SER 204 CO 0.17 0.49 0.36 0.03 -0.53 0.00 0.00 176.83 177.34 1r58 h ARG 205 N 0.58 0.73 0.43 2.24 3.08 -1.23 -1.58 114.38 118.64 1r58 h ARG 205 Ca 0.16 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 60.14 1r58 h ARG 205 Cb 0.05 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 29.94 1r58 h ARG 205 CO -0.03 0.49 -0.21 -0.22 -1.07 0.00 0.00 179.97 178.94 1r58 h LYS 206 N 0.75 -0.56 0.00 0.04 1.63 -1.29 -1.68 116.57 115.46 1r58 h LYS 206 Ca 0.20 0.04 -0.05 0.00 -0.85 0.00 0.00 60.65 59.99 1r58 h LYS 206 Cb -0.08 0.13 -0.01 0.00 -0.60 0.00 0.00 32.23 31.67 1r58 h LYS 206 CO -0.04 -0.26 -0.22 -0.07 -3.45 0.00 0.00 179.45 175.41 1r58 h LEU 207 N -1.01 0.00 -0.37 5.20 3.38 -1.18 -2.04 115.31 119.29 1r58 h LEU 207 Ca -0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1r58 h LEU 207 Cb 0.55 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.30 1r58 h LEU 207 CO 0.10 0.22 -0.32 0.00 0.09 0.00 0.00 178.44 178.53 1r58 n ILE 208 N -3.78 0.00 -3.62 1.22 0.13 -0.60 -0.97 119.36 111.74 1r58 n ILE 208 Ca -0.02 -0.10 -0.25 0.00 -1.10 0.00 0.00 62.75 61.29 1r58 n ILE 208 Cb 0.32 0.36 0.03 0.00 -0.84 0.00 0.00 39.64 39.50 1r58 n ILE 208 CO 0.00 0.00 0.00 1.17 2.80 0.00 0.00 176.55 180.52 1r58 n LYS 209 N -0.86 -1.25 -1.58 9.51 4.81 -0.77 -4.58 118.16 123.45 1r58 n LYS 209 Ca 0.11 0.69 -0.57 0.00 -0.87 0.00 0.00 58.31 57.67 1r58 n LYS 209 Cb 0.34 -3.90 -0.07 0.00 0.02 0.00 0.00 35.03 31.42 1r58 n LYS 209 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 1r58 n GLU 210 N -3.45 0.59 -3.25 1.64 2.13 -0.69 -4.79 120.64 112.82 1r58 n GLU 210 Ca -0.13 0.21 -0.23 0.00 0.66 0.00 0.00 57.16 57.68 1r58 n GLU 210 Cb 0.60 -1.79 -0.07 0.00 0.27 0.00 0.00 31.44 30.44 1r58 n GLU 210 CO 0.00 0.00 0.00 -1.71 -0.41 0.00 0.00 177.13 175.01 1r58 n ASN 211 N 2.45 -0.93 0.00 4.31 4.05 0.12 -4.96 115.26 120.30 1r58 n ASN 211 Ca 0.21 -2.52 0.00 0.00 0.45 0.00 0.00 54.58 52.71 1r58 n ASN 211 Cb 0.12 -0.14 0.00 0.00 1.23 0.00 0.00 39.78 40.99 1r58 n ASN 211 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1r58 n GLY 212 N 2.63 2.98 0.34 8.20 0.00 -1.26 -0.70 105.19 117.38 1r58 n GLY 212 Ca 0.26 -0.15 0.13 0.00 0.00 0.00 0.00 46.02 46.26 1r58 n GLY 212 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1r58 n LEU 213 N 0.00 1.04 0.13 0.99 4.77 -1.26 -3.74 117.00 118.93 1r58 n LEU 213 Ca 0.00 -0.39 0.06 0.00 -0.03 0.00 0.00 56.01 55.65 1r58 n LEU 213 Cb 0.00 -0.03 0.03 0.00 -2.33 0.00 0.00 43.42 41.09 1r58 n LEU 213 CO 0.00 0.19 0.29 0.78 -1.33 0.00 0.00 177.39 177.32 1r58 h ASN 214 N 1.51 0.00 -2.98 -1.43 -0.26 -1.31 -3.40 115.58 107.71 1r58 h ASN 214 Ca 0.00 0.00 0.07 0.00 -0.56 0.00 0.00 56.30 55.81 1r58 h ASN 214 Cb 0.33 0.00 -0.26 0.00 -1.06 0.00 0.00 38.32 37.33 1r58 h ASN 214 CO 0.00 0.29 0.38 0.00 -1.06 0.00 0.00 177.43 177.04 1r58 s ALA 215 N -3.10 -2.06 0.00 -0.83 0.00 -1.14 -0.43 121.76 114.20 1r58 s ALA 215 Ca 0.02 2.05 0.00 0.00 0.00 0.00 0.00 51.96 54.03 1r58 s ALA 215 Cb 0.08 -1.52 0.00 0.00 0.00 0.00 0.00 23.12 21.67 1r58 s ALA 215 CO 0.75 -0.29 0.00 0.41 0.00 0.00 0.00 175.76 176.63 1r58 n GLY 216 N 2.95 -0.55 3.68 0.00 0.00 -1.00 0.14 105.19 110.41 1r58 n GLY 216 Ca -0.15 -0.81 -0.41 0.00 0.00 0.00 0.00 46.02 44.65 1r58 n GLY 216 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1r58 s LEU 217 N 0.00 4.21 0.27 0.99 1.43 -1.26 -1.55 118.68 122.77 1r58 s LEU 217 Ca 0.00 1.13 0.08 0.00 -1.03 0.00 0.00 54.13 54.31 1r58 s LEU 217 Cb 0.00 -3.14 0.36 0.00 0.03 0.00 0.00 46.19 43.43 1r58 s LEU 217 CO 0.00 -0.30 1.62 0.00 0.23 0.00 0.00 176.35 177.90 1r58 h ALA 218 N 7.20 0.98 -2.65 4.21 0.00 -1.50 -3.46 119.26 124.04 1r58 h ALA 218 Ca -0.33 -0.53 0.11 0.00 0.00 0.00 0.00 54.91 54.16 1r58 h ALA 218 Cb 1.15 -0.09 -0.08 0.00 0.00 0.00 0.00 17.79 18.77 1r58 h ALA 218 CO 0.80 0.72 0.36 -0.59 0.00 0.00 0.00 179.25 180.54 1r58 s PHE 219 N -3.75 -0.23 0.90 0.00 -0.71 -1.26 -3.47 117.98 109.46 1r58 s PHE 219 Ca -0.03 -0.10 -0.11 0.00 -1.04 0.00 0.00 56.93 55.66 1r58 s PHE 219 Cb 0.13 0.64 0.12 0.00 -1.21 0.00 0.00 43.02 42.70 1r58 s PHE 219 CO 0.77 -0.94 1.08 -2.30 -1.34 0.00 0.00 175.22 172.49 1r58 n PRO 220 N -0.43 -0.30 -2.60 1.99 -0.02 -1.26 -4.11 135.00 128.27 1r58 n PRO 220 Ca -0.07 -0.02 -0.42 0.00 -2.02 0.00 0.00 63.50 60.97 1r58 n PRO 220 Cb 0.61 -2.33 -0.02 0.00 -0.02 0.00 0.00 33.50 31.73 1r58 n PRO 220 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1r58 s THR 221 N -2.49 4.07 0.16 3.45 2.01 -1.26 -4.60 115.64 116.98 1r58 s THR 221 Ca 0.67 0.94 -0.30 0.00 0.31 0.00 0.00 61.69 63.32 1r58 s THR 221 Cb -0.24 -4.69 -0.07 0.00 0.01 0.00 0.00 72.50 67.50 1r58 s THR 221 CO 0.57 -1.26 0.99 -0.83 -0.69 0.00 0.00 174.62 173.40 1r58 s GLY 222 N 2.85 2.99 -0.27 4.40 0.00 0.16 -4.48 107.32 112.96 1r58 s GLY 222 Ca 0.43 0.65 0.21 0.00 0.00 0.00 0.00 44.72 46.02 1r58 s GLY 222 CO 0.26 1.45 1.19 0.00 0.00 0.00 0.00 173.10 176.01 1r58 n SER 224 N -0.77 1.95 -4.58 0.00 7.64 -1.18 -4.52 113.62 112.15 1r58 n SER 224 Ca 0.02 1.16 -0.34 0.00 1.01 0.00 0.00 58.87 60.72 1r58 n SER 224 Cb 0.82 -1.33 -0.11 0.00 -1.01 0.00 0.00 64.21 62.58 1r58 n SER 224 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1r58 s LEU 225 N 0.28 3.15 0.00 -3.43 1.43 -1.23 -1.23 118.68 117.65 1r58 s LEU 225 Ca 0.67 -0.05 0.00 0.00 -1.03 0.00 0.00 54.13 53.72 1r58 s LEU 225 Cb -0.72 -1.70 0.00 0.00 0.03 0.00 0.00 46.19 43.79 1r58 s LEU 225 CO 0.54 0.35 0.00 0.59 0.23 0.00 0.00 176.35 178.06 1r58 n ASN 226 N 2.12 0.00 0.28 2.29 3.02 -0.39 -0.80 115.26 121.78 1r58 n ASN 226 Ca -0.17 0.00 0.18 0.00 -0.03 0.00 0.00 54.58 54.56 1r58 n ASN 226 Cb 0.53 0.00 0.77 0.00 -0.61 0.00 0.00 39.78 40.47 1r58 n ASN 226 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1r58 h ASN 227 N 0.00 0.00 -3.36 6.41 -1.07 -1.78 -2.04 115.58 113.74 1r58 h ASN 227 Ca 0.00 0.00 -0.57 0.00 0.07 0.00 0.00 56.30 55.80 1r58 h ASN 227 Cb 0.00 0.00 -0.06 0.00 -2.07 0.00 0.00 38.32 36.19 1r58 h ASN 227 CO 0.00 0.00 0.15 0.00 0.07 0.00 0.00 177.43 177.65 1r58 n ALA 229 N 4.14 1.52 -3.68 0.00 0.00 0.08 -3.50 120.51 119.07 1r58 n ALA 229 Ca 0.00 -1.11 -0.07 0.00 0.00 0.00 0.00 53.44 52.25 1r58 n ALA 229 Cb 0.51 -0.44 -0.02 0.00 0.00 0.00 0.00 19.45 19.50 1r58 n ALA 229 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1r58 s ALA 230 N -2.55 -1.49 -1.15 0.00 0.00 -1.16 -4.80 121.76 110.60 1r58 s ALA 230 Ca -0.08 0.16 0.00 0.00 0.00 0.00 0.00 51.96 52.04 1r58 s ALA 230 Cb 0.07 0.75 0.00 0.00 0.00 0.00 0.00 23.12 23.94 1r58 s ALA 230 CO 0.83 -0.93 0.00 0.72 0.00 0.00 0.00 175.76 176.38 1r58 n HIS 231 N -0.42 -0.11 -4.53 0.00 8.25 -1.26 -0.86 115.22 116.30 1r58 n HIS 231 Ca -0.08 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.04 1r58 n HIS 231 Cb 0.61 -2.21 -0.13 0.00 1.12 0.00 0.00 29.99 29.38 1r58 n HIS 231 CO 0.00 0.00 0.00 -0.47 0.64 0.00 0.00 176.34 176.51 1r58 s TYR 232 N -2.45 2.95 -0.10 4.41 6.14 -1.26 -3.66 117.35 123.37 1r58 s TYR 232 Ca 0.00 -0.43 -0.12 0.00 0.64 0.00 0.00 57.07 57.16 1r58 s TYR 232 Cb 0.00 -1.92 0.03 0.00 0.42 0.00 0.00 41.96 40.49 1r58 s TYR 232 CO 0.00 -0.10 0.33 -0.08 0.64 0.00 0.00 175.55 176.34 1r58 s THR 233 N 0.37 0.01 0.46 4.34 -1.32 -1.26 -0.96 115.64 117.28 1r58 s THR 233 Ca -0.07 -0.11 -0.24 0.00 -1.21 0.00 0.00 61.69 60.07 1r58 s THR 233 Cb -0.15 -0.50 -0.07 0.00 -1.51 0.00 0.00 72.50 70.27 1r58 s THR 233 CO 0.04 -0.06 1.23 -2.16 -2.21 0.00 0.00 174.62 171.46 1r58 s PRO 234 N -0.16 3.72 0.48 7.08 0.04 -1.26 -4.74 135.00 140.15 1r58 s PRO 234 Ca -0.03 1.96 0.07 0.00 0.04 0.00 0.00 61.00 63.03 1r58 s PRO 234 Cb -0.03 -2.49 0.03 0.00 0.04 0.00 0.00 34.50 32.05 1r58 s PRO 234 CO 0.01 -0.63 0.66 -0.80 0.04 0.00 0.00 177.00 176.28 1r58 s ASN 235 N -1.12 5.45 0.29 6.66 0.01 -1.26 -4.68 114.94 120.29 1r58 s ASN 235 Ca 0.63 -0.40 -0.29 0.00 -0.71 0.00 0.00 52.86 52.09 1r58 s ASN 235 Cb -0.33 -0.54 -0.13 0.00 0.41 0.00 0.00 41.25 40.65 1r58 s ASN 235 CO 0.41 -0.96 1.26 0.00 -1.51 0.00 0.00 177.10 176.30 1r58 n ALA 236 N -2.04 0.78 -0.20 0.60 0.00 -1.26 -2.16 120.51 116.23 1r58 n ALA 236 Ca 0.09 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.92 1r58 n ALA 236 Cb 0.60 -2.20 0.00 0.00 0.00 0.00 0.00 19.45 17.85 1r58 n ALA 236 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1r58 n GLY 237 N 1.41 1.70 3.62 0.00 0.00 -1.26 -5.00 105.19 105.65 1r58 n GLY 237 Ca 0.09 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.68 1r58 n GLY 237 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1r58 s ASP 238 N -3.26 6.10 -0.00 1.61 -1.08 -0.92 -4.87 116.67 114.25 1r58 s ASP 238 Ca 0.00 1.73 0.12 0.00 -0.52 0.00 0.00 52.55 53.88 1r58 s ASP 238 Cb 0.00 -2.53 0.35 0.00 -1.46 0.00 0.00 42.92 39.28 1r58 s ASP 238 CO 0.00 -1.47 1.28 0.35 0.52 0.00 0.00 175.17 175.86 1r58 n THR 239 N 6.79 0.56 -1.70 1.71 -2.24 -1.26 -4.72 114.28 113.42 1r58 n THR 239 Ca 0.22 -0.53 -0.44 0.00 -2.27 0.00 0.00 64.05 61.03 1r58 n THR 239 Cb 0.45 0.24 -0.03 0.00 -2.10 0.00 0.00 70.33 68.89 1r58 n THR 239 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1r58 n THR 240 N 0.64 0.68 -5.08 4.28 -1.04 -1.26 -4.92 114.28 107.58 1r58 n THR 240 Ca 0.13 -0.17 -0.32 0.00 -2.04 0.00 0.00 64.05 61.65 1r58 n THR 240 Cb 0.35 -1.67 -0.15 0.00 -1.82 0.00 0.00 70.33 67.03 1r58 n THR 240 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1r58 s VAL 241 N 0.28 2.50 0.23 12.58 1.01 -1.26 -1.58 120.40 134.16 1r58 s VAL 241 Ca 0.70 -0.90 -0.30 0.00 0.00 0.00 0.00 61.98 61.48 1r58 s VAL 241 Cb -0.60 -1.96 -0.10 0.00 0.00 0.00 0.00 36.38 33.73 1r58 s VAL 241 CO 0.45 0.57 1.40 -0.22 0.00 0.00 0.00 175.10 177.30 1r58 s LEU 242 N -0.18 4.39 0.28 3.92 2.96 -0.42 -4.89 118.68 124.75 1r58 s LEU 242 Ca -0.02 2.57 0.08 0.00 -0.22 0.00 0.00 54.13 56.54 1r58 s LEU 242 Cb -0.14 -3.62 -0.04 0.00 0.50 0.00 0.00 46.19 42.90 1r58 s LEU 242 CO 0.03 -0.65 0.10 -1.10 -1.32 0.00 0.00 176.35 173.42 1r58 s GLN 243 N -0.18 2.50 0.30 1.98 -1.52 -1.26 -1.01 119.66 120.46 1r58 s GLN 243 Ca 0.59 -1.35 0.00 0.00 -1.95 0.00 0.00 55.36 52.66 1r58 s GLN 243 Cb -0.40 -2.29 0.51 0.00 -0.22 0.00 0.00 33.01 30.61 1r58 s GLN 243 CO 0.41 0.30 1.91 -0.92 -0.25 0.00 0.00 175.29 176.74 1r58 h TYR 244 N 1.67 1.07 -0.20 0.91 3.20 -1.95 -1.93 116.97 119.74 1r58 h TYR 244 Ca -0.45 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.45 1r58 h TYR 244 Cb 1.25 -0.35 0.00 0.00 1.54 0.00 0.00 36.73 39.17 1r58 h TYR 244 CO 0.63 0.56 0.00 -0.25 -1.64 0.00 0.00 178.16 177.46 1r58 n ASP 245 N -4.49 1.63 -4.78 -2.11 8.00 -1.26 -3.67 116.55 109.87 1r58 n ASP 245 Ca 0.14 -1.76 -0.37 0.00 0.71 0.00 0.00 54.79 53.51 1r58 n ASP 245 Cb 0.19 -0.13 -0.04 0.00 -0.02 0.00 0.00 41.12 41.12 1r58 n ASP 245 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1r58 s ASP 246 N -1.44 6.78 -0.35 -2.24 -0.00 -0.73 -4.97 116.67 113.71 1r58 s ASP 246 Ca 0.30 2.06 0.01 0.00 -0.00 0.00 0.00 52.55 54.91 1r58 s ASP 246 Cb 0.16 -2.59 0.09 0.00 -0.00 0.00 0.00 42.92 40.59 1r58 s ASP 246 CO 0.24 -0.48 0.09 -0.51 -0.00 0.00 0.00 175.17 174.51 1r58 s ILE 247 N -1.63 2.75 -0.22 0.77 2.07 -1.26 -4.42 121.20 119.26 1r58 s ILE 247 Ca 0.57 -2.05 -0.09 0.00 -1.41 0.00 0.00 60.65 57.67 1r58 s ILE 247 Cb -0.23 -2.88 -0.04 0.00 0.13 0.00 0.00 42.46 39.44 1r58 s ILE 247 CO 0.28 -0.52 0.12 0.00 -1.91 0.00 0.00 174.94 172.91 1r58 s LYS 249 N 0.86 3.07 -0.47 0.00 3.01 -0.37 0.75 119.74 126.60 1r58 s LYS 249 Ca 0.06 -0.99 -0.23 0.00 -1.01 0.00 0.00 55.97 53.80 1r58 s LYS 249 Cb -0.13 -4.07 0.03 0.00 -1.01 0.00 0.00 37.83 32.65 1r58 s LYS 249 CO 0.03 -1.04 0.79 0.42 0.51 0.00 0.00 175.35 176.06 1r58 s ILE 250 N 2.17 4.63 -0.28 2.17 -1.09 0.07 -3.12 121.20 125.76 1r58 s ILE 250 Ca 0.11 0.36 0.01 0.00 -2.23 0.00 0.00 60.65 58.89 1r58 s ILE 250 Cb -0.20 -4.35 0.08 0.00 -1.58 0.00 0.00 42.46 36.41 1r58 s ILE 250 CO 0.11 -0.77 0.02 -0.62 -1.23 0.00 0.00 174.94 172.45 1r58 s ASP 251 N 2.25 3.99 0.08 3.58 -1.08 -0.28 -1.68 116.67 123.53 1r58 s ASP 251 Ca 0.29 -1.48 0.02 0.00 -0.52 0.00 0.00 52.55 50.86 1r58 s ASP 251 Cb -0.13 -1.10 -0.04 0.00 -1.46 0.00 0.00 42.92 40.19 1r58 s ASP 251 CO 0.22 -0.33 -0.07 0.72 0.52 0.00 0.00 175.17 176.23 1r58 s PHE 252 N 1.42 0.81 0.11 -5.34 -0.12 -1.21 0.35 117.98 113.99 1r58 s PHE 252 Ca 0.03 -0.81 0.04 0.00 -0.05 0.00 0.00 56.93 56.14 1r58 s PHE 252 Cb -0.18 -0.48 -0.04 0.00 -0.63 0.00 0.00 43.02 41.69 1r58 s PHE 252 CO -0.13 -0.14 -0.10 0.20 -0.05 0.00 0.00 175.22 175.00 1r58 s GLY 253 N -2.64 0.88 0.12 1.99 0.00 -1.26 -3.87 107.32 102.54 1r58 s GLY 253 Ca 0.06 -1.25 0.04 0.00 0.00 0.00 0.00 44.72 43.56 1r58 s GLY 253 CO -0.04 -1.33 -0.10 -0.51 0.00 0.00 0.00 173.10 171.12 1r58 s THR 254 N -2.67 1.03 0.04 0.90 -4.23 -1.19 -1.48 115.64 108.04 1r58 s THR 254 Ca 0.08 -1.83 -0.17 0.00 -1.18 0.00 0.00 61.69 58.58 1r58 s THR 254 Cb -0.01 -1.59 0.03 0.00 1.34 0.00 0.00 72.50 72.27 1r58 s THR 254 CO -0.00 -0.65 0.39 -1.38 -0.54 0.00 0.00 174.62 172.44 1r58 s HIS 255 N -2.88 -0.24 -0.13 3.99 -3.43 -0.59 -1.14 115.29 110.87 1r58 s HIS 255 Ca 0.11 0.18 -0.01 0.00 -0.80 0.00 0.00 55.06 54.54 1r58 s HIS 255 Cb -0.00 0.19 0.04 0.00 -1.43 0.00 0.00 32.58 31.38 1r58 s HIS 255 CO -0.00 -0.56 -0.04 0.42 -2.00 0.00 0.00 174.74 172.56 1r58 s ILE 256 N -2.47 0.88 -1.52 -5.38 -1.09 -1.09 -2.38 121.20 108.16 1r58 s ILE 256 Ca -0.05 -0.37 -0.13 0.00 -2.23 0.00 0.00 60.65 57.86 1r58 s ILE 256 Cb -0.01 -1.04 0.08 0.00 -1.58 0.00 0.00 42.46 39.91 1r58 s ILE 256 CO -0.02 0.19 1.00 -1.20 -1.23 0.00 0.00 174.94 173.67 1r58 n SER 257 N 4.97 -4.85 0.00 3.58 7.64 0.42 -1.13 113.62 124.25 1r58 n SER 257 Ca -0.11 -0.76 0.00 0.00 1.01 0.00 0.00 58.87 59.01 1r58 n SER 257 Cb 0.49 -3.97 0.00 0.00 -1.01 0.00 0.00 64.21 59.72 1r58 n SER 257 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1r58 n GLY 258 N -1.72 0.91 3.47 0.23 0.00 -1.26 -4.80 105.19 102.03 1r58 n GLY 258 Ca 0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.63 1r58 n GLY 258 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1r58 s ARG 259 N -0.08 3.17 0.07 1.61 1.81 -0.28 -1.29 118.95 123.97 1r58 s ARG 259 Ca 0.00 -0.80 -0.25 0.00 -1.72 0.00 0.00 55.73 52.96 1r58 s ARG 259 Cb 0.00 -4.30 -0.06 0.00 -0.45 0.00 0.00 34.95 30.14 1r58 s ARG 259 CO 0.00 -1.89 0.75 0.42 -0.68 0.00 0.00 175.30 173.90 1r58 s ILE 260 N 4.30 4.65 -0.33 1.52 1.01 -1.26 -2.66 121.20 128.44 1r58 s ILE 260 Ca 0.26 1.61 -0.06 0.00 0.00 0.00 0.00 60.65 62.46 1r58 s ILE 260 Cb -0.14 -4.10 0.03 0.00 0.01 0.00 0.00 42.46 38.26 1r58 s ILE 260 CO 0.09 0.41 0.09 -0.63 0.00 0.00 0.00 174.94 174.91 1r58 s ILE 261 N -0.38 3.82 -0.41 2.92 -1.09 -0.29 -5.01 121.20 120.75 1r58 s ILE 261 Ca 0.37 -1.01 -0.09 0.00 -2.23 0.00 0.00 60.65 57.69 1r58 s ILE 261 Cb -0.21 -3.10 0.08 0.00 -1.58 0.00 0.00 42.46 37.64 1r58 s ILE 261 CO 0.23 -0.10 0.25 -0.62 -1.23 0.00 0.00 174.94 173.47 1r58 s ASP 262 N 1.43 5.60 -0.02 3.58 3.68 -1.26 -3.15 116.67 126.53 1r58 s ASP 262 Ca -0.00 -1.49 -0.02 0.00 2.13 0.00 0.00 52.55 53.16 1r58 s ASP 262 Cb -0.19 -1.97 0.00 0.00 -1.45 0.00 0.00 42.92 39.31 1r58 s ASP 262 CO 0.03 -0.52 0.05 0.00 0.13 0.00 0.00 175.17 174.86 1r58 s ALA 264 N -0.17 -0.74 0.23 0.00 0.00 -0.80 -3.36 121.76 116.92 1r58 s ALA 264 Ca -0.02 -0.08 -0.05 0.00 0.00 0.00 0.00 51.96 51.81 1r58 s ALA 264 Cb -0.02 0.49 -0.02 0.00 0.00 0.00 0.00 23.12 23.57 1r58 s ALA 264 CO 0.00 -0.52 0.28 -0.59 0.00 0.00 0.00 175.76 174.93 1r58 s PHE 265 N -3.25 0.89 -0.09 0.00 -0.12 -0.68 -1.30 117.98 113.43 1r58 s PHE 265 Ca -0.00 -1.15 0.02 0.00 -0.05 0.00 0.00 56.93 55.74 1r58 s PHE 265 Cb 0.01 -0.27 -0.02 0.00 -0.63 0.00 0.00 43.02 42.11 1r58 s PHE 265 CO -0.08 -0.81 -0.15 0.99 -0.05 0.00 0.00 175.22 175.13 1r58 s THR 266 N -4.01 2.96 -0.12 -4.49 2.01 -1.20 -0.75 115.64 110.04 1r58 s THR 266 Ca 0.33 -0.72 -0.03 0.00 0.31 0.00 0.00 61.69 61.58 1r58 s THR 266 Cb 0.04 -2.20 -0.03 0.00 0.01 0.00 0.00 72.50 70.32 1r58 s THR 266 CO 0.12 0.55 -0.02 -0.69 -0.69 0.00 0.00 174.62 173.89 1r58 s VAL 267 N -0.09 4.05 0.14 3.82 1.01 0.23 -4.97 120.40 124.59 1r58 s VAL 267 Ca -0.02 -0.32 -0.08 0.00 0.00 0.00 0.00 61.98 61.56 1r58 s VAL 267 Cb -0.14 -2.74 -0.01 0.00 0.00 0.00 0.00 36.38 33.50 1r58 s VAL 267 CO 0.04 0.54 0.23 0.42 0.00 0.00 0.00 175.10 176.33 1r58 s THR 268 N -0.22 0.09 0.00 3.92 -4.23 -1.26 -1.03 115.64 112.91 1r58 s THR 268 Ca 0.04 -1.41 0.00 0.00 -1.18 0.00 0.00 61.69 59.14 1r58 s THR 268 Cb -0.13 -1.75 0.00 0.00 1.34 0.00 0.00 72.50 71.96 1r58 s THR 268 CO 0.02 -0.40 0.00 0.49 -0.54 0.00 0.00 174.62 174.19 1r58 n PHE 269 N -0.16 0.00 -3.57 3.99 3.01 -1.26 -5.00 117.46 114.47 1r58 n PHE 269 Ca -0.09 0.00 -0.38 0.00 1.01 0.00 0.00 57.45 57.99 1r58 n PHE 269 Cb 0.63 0.00 -0.11 0.00 -0.01 0.00 0.00 39.48 39.99 1r58 n PHE 269 CO 0.00 0.00 0.00 1.21 1.01 0.00 0.00 176.76 178.98 1r58 s ASN 270 N -1.15 6.07 0.00 4.37 3.84 -1.24 -4.97 114.94 121.86 1r58 s ASN 270 Ca 0.00 0.05 0.00 0.00 0.21 0.00 0.00 52.86 53.12 1r58 s ASN 270 Cb 0.00 -2.13 0.00 0.00 -0.55 0.00 0.00 41.25 38.57 1r58 s ASN 270 CO 0.00 -0.05 0.88 -0.81 -2.79 0.00 0.00 177.10 174.32 1r58 n PRO 271 N 5.00 0.00 0.28 0.43 -0.04 -1.26 -2.76 135.00 136.65 1r58 n PRO 271 Ca -0.13 0.38 0.19 0.00 -0.04 0.00 0.00 63.50 63.89 1r58 n PRO 271 Cb 0.52 -1.51 0.86 0.00 -0.04 0.00 0.00 33.50 33.33 1r58 n PRO 271 CO 0.00 0.00 0.00 1.57 -0.04 0.00 0.00 175.50 177.03 1r58 h LYS 272 N 0.00 0.00 -0.02 0.54 2.10 -1.94 -2.04 116.57 115.22 1r58 h LYS 272 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1r58 h LYS 272 Cb 0.02 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.35 1r58 h LYS 272 CO 0.00 0.00 -0.15 0.66 -2.00 0.00 0.00 179.45 177.96 1r58 n TYR 273 N -2.95 0.00 -0.21 0.07 4.02 -1.11 -4.60 117.16 112.38 1r58 n TYR 273 Ca -0.01 0.00 -0.02 0.00 -0.01 0.00 0.00 57.90 57.86 1r58 n TYR 273 Cb 0.19 -0.03 0.04 0.00 -0.02 0.00 0.00 39.34 39.53 1r58 n TYR 273 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 176.86 175.41 1r58 h ASP 274 N 2.82 -0.81 -0.12 7.72 3.32 -1.59 -0.96 116.42 126.80 1r58 h ASP 274 Ca 0.00 0.20 -0.08 0.00 0.02 0.00 0.00 57.03 57.18 1r58 h ASP 274 Cb 0.70 0.46 -0.02 0.00 0.22 0.00 0.00 39.33 40.69 1r58 h ASP 274 CO 0.00 -0.25 -0.15 0.71 -1.72 0.00 0.00 179.24 177.83 1r58 h THR 275 N -0.07 1.24 -0.54 0.35 1.35 -1.82 -0.89 112.91 112.52 1r58 h THR 275 Ca 0.28 -1.07 -0.02 0.00 -0.55 0.00 0.00 66.41 65.05 1r58 h THR 275 Cb 0.51 1.19 -0.02 0.00 -1.73 0.00 0.00 68.15 68.09 1r58 h THR 275 CO -0.67 0.35 0.25 0.25 -0.25 0.00 0.00 175.52 175.45 1r58 h LEU 276 N 0.45 0.71 -0.57 3.87 5.85 -1.53 0.32 115.31 124.42 1r58 h LEU 276 Ca 0.08 -0.14 -0.12 0.00 0.84 0.00 0.00 57.88 58.55 1r58 h LEU 276 Cb 0.53 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.36 1r58 h LEU 276 CO 0.03 0.65 -0.13 -0.07 -0.34 0.00 0.00 178.44 178.58 1r58 h LEU 277 N 0.72 1.02 -0.76 2.25 4.07 -0.92 -2.58 115.31 119.11 1r58 h LEU 277 Ca 0.18 -0.35 -0.00 0.00 0.08 0.00 0.00 57.88 57.80 1r58 h LEU 277 Cb 0.13 -0.28 -0.04 0.00 1.08 0.00 0.00 40.66 41.56 1r58 h LEU 277 CO -0.02 1.14 0.47 0.50 -1.08 0.00 0.00 178.44 179.45 1r58 h LYS 278 N 0.90 1.03 -0.28 1.13 1.63 -0.80 0.07 116.57 120.25 1r58 h LYS 278 Ca 0.14 -0.09 0.01 0.00 -0.85 0.00 0.00 60.65 59.86 1r58 h LYS 278 Cb 0.69 -0.22 -0.02 0.00 -0.60 0.00 0.00 32.23 32.09 1r58 h LYS 278 CO 0.05 0.72 0.17 0.00 -3.45 0.00 0.00 179.45 176.94 1r58 h ALA 279 N 1.25 0.35 -0.22 5.00 0.00 -0.71 0.10 119.26 125.04 1r58 h ALA 279 Ca 0.28 -0.01 -0.15 0.00 0.00 0.00 0.00 54.91 55.02 1r58 h ALA 279 Cb -0.06 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1r58 h ALA 279 CO -0.05 -0.20 -0.50 0.28 0.00 0.00 0.00 179.25 178.78 1r58 h VAL 280 N 0.36 1.31 -0.48 0.00 2.07 -1.20 -0.83 116.25 117.48 1r58 h VAL 280 Ca 0.11 -1.71 -0.06 0.00 0.82 0.00 0.00 66.70 65.85 1r58 h VAL 280 Cb -0.02 1.68 -0.02 0.00 -1.52 0.00 0.00 31.29 31.41 1r58 h VAL 280 CO -0.04 0.54 0.06 0.50 0.02 0.00 0.00 177.57 178.66 1r58 h LYS 281 N 0.47 0.80 -0.64 1.57 3.64 -0.74 -0.53 116.57 121.13 1r58 h LYS 281 Ca 0.02 -0.22 -0.09 0.00 -1.27 0.00 0.00 60.65 59.09 1r58 h LYS 281 Cb 1.03 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.74 1r58 h LYS 281 CO 0.10 0.81 0.06 0.22 -2.27 0.00 0.00 179.45 178.37 1r58 h ASP 282 N 0.67 1.05 -0.41 4.20 3.58 -0.68 -1.35 116.42 123.47 1r58 h ASP 282 Ca 0.14 -0.27 -0.00 0.00 0.42 0.00 0.00 57.03 57.32 1r58 h ASP 282 Cb 0.41 -0.28 -0.02 0.00 1.72 0.00 0.00 39.33 41.16 1r58 h ASP 282 CO 0.01 1.07 0.24 0.00 -2.88 0.00 0.00 179.24 177.68 1r58 h ALA 283 N 1.04 0.53 -0.39 -0.78 0.00 -0.84 0.13 119.26 118.96 1r58 h ALA 283 Ca 0.19 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 1r58 h ALA 283 Cb 0.49 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 1r58 h ALA 283 CO 0.02 0.04 0.12 1.15 0.00 0.00 0.00 179.25 180.58 1r58 h THR 284 N 0.54 1.21 -0.27 0.00 2.02 -0.91 -0.97 112.91 114.54 1r58 h THR 284 Ca 0.15 -0.69 -0.03 0.00 0.77 0.00 0.00 66.41 66.60 1r58 h THR 284 Cb 0.02 0.93 -0.02 0.00 -1.74 0.00 0.00 68.15 67.35 1r58 h THR 284 CO -0.03 0.24 0.02 0.78 0.37 0.00 0.00 175.52 176.91 1r58 h ASN 285 N 0.48 0.37 -0.51 4.18 2.35 -1.00 -0.33 115.58 121.12 1r58 h ASN 285 Ca 0.13 -0.05 -0.08 0.00 -0.55 0.00 0.00 56.30 55.74 1r58 h ASN 285 Cb 0.25 -0.10 -0.02 0.00 0.05 0.00 0.00 38.32 38.51 1r58 h ASN 285 CO -0.00 0.42 -0.01 0.74 -1.65 0.00 0.00 177.43 176.92 1r58 h THR 286 N 0.39 1.26 -0.67 2.81 2.02 -0.51 -0.99 112.91 117.23 1r58 h THR 286 Ca 0.09 -1.11 -0.04 0.00 0.77 0.00 0.00 66.41 66.12 1r58 h THR 286 Cb 0.23 0.97 -0.03 0.00 -1.74 0.00 0.00 68.15 67.58 1r58 h THR 286 CO 0.00 0.39 0.24 1.23 0.37 0.00 0.00 175.52 177.75 1r58 h GLY 287 N 0.77 1.07 1.06 2.16 0.00 -0.23 -1.47 103.07 106.43 1r58 h GLY 287 Ca 0.14 -0.58 -0.08 0.00 0.00 0.00 0.00 47.33 46.81 1r58 h GLY 287 CO 0.03 0.55 0.09 -2.22 0.00 0.00 0.00 176.54 174.99 1r58 h ILE 288 N 0.97 1.26 -0.18 2.60 2.04 -0.74 -2.26 117.51 121.20 1r58 h ILE 288 Ca 0.22 -1.04 -0.16 0.00 1.00 0.00 0.00 64.86 64.88 1r58 h ILE 288 Cb 0.23 0.68 -0.01 0.00 -0.74 0.00 0.00 36.82 36.98 1r58 h ILE 288 CO -0.01 0.39 -0.56 0.11 0.00 0.00 0.00 178.15 178.08 1r58 h LYS 289 N 0.99 0.56 0.00 2.37 1.57 -0.87 -3.15 116.57 118.05 1r58 h LYS 289 Ca 0.19 -0.36 -0.08 0.00 -1.87 0.00 0.00 60.65 58.54 1r58 h LYS 289 Cb 0.45 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.79 1r58 h LYS 289 CO 0.01 0.97 -0.38 0.00 -0.57 0.00 0.00 179.45 179.48 1r58 s ALA 291 N -3.47 2.60 0.00 0.00 0.00 -0.86 -4.91 121.76 115.12 1r58 s ALA 291 Ca 0.01 1.09 0.00 0.00 0.00 0.00 0.00 51.96 53.06 1r58 s ALA 291 Cb 0.10 -3.48 0.00 0.00 0.00 0.00 0.00 23.12 19.74 1r58 s ALA 291 CO 0.69 -1.21 0.00 0.41 0.00 0.00 0.00 175.76 175.65 1r58 n GLY 292 N 0.60 0.62 3.73 0.00 0.00 -1.26 -4.61 105.19 104.27 1r58 n GLY 292 Ca 0.13 -1.04 -0.42 0.00 0.00 0.00 0.00 46.02 44.69 1r58 n GLY 292 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1r58 s ILE 293 N -2.00 3.12 0.00 -0.61 1.01 -1.26 -2.42 121.20 119.04 1r58 s ILE 293 Ca 0.00 0.86 0.00 0.00 0.00 0.00 0.00 60.65 61.51 1r58 s ILE 293 Cb 0.00 -3.55 0.00 0.00 0.01 0.00 0.00 42.46 38.92 1r58 s ILE 293 CO 0.00 0.10 0.00 0.47 0.00 0.00 0.00 174.94 175.51 1r58 n ASP 294 N 3.29 -1.43 -4.73 3.58 8.00 -0.16 -4.96 116.55 120.14 1r58 n ASP 294 Ca 0.09 0.00 -0.41 0.00 0.71 0.00 0.00 54.79 55.18 1r58 n ASP 294 Cb 0.42 -0.54 -0.05 0.00 -0.02 0.00 0.00 41.12 40.93 1r58 n ASP 294 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1r58 s VAL 295 N -2.89 4.43 -0.01 2.53 1.01 -1.01 -4.74 120.40 119.71 1r58 s VAL 295 Ca 0.00 2.05 -0.30 0.00 0.00 0.00 0.00 61.98 63.73 1r58 s VAL 295 Cb 0.00 -4.31 -0.03 0.00 0.00 0.00 0.00 36.38 32.03 1r58 s VAL 295 CO 0.00 0.35 1.06 -0.13 0.00 0.00 0.00 175.10 176.39 1r58 s ARG 296 N -0.23 4.48 0.42 2.72 0.52 -1.26 -1.07 118.95 124.53 1r58 s ARG 296 Ca 0.45 1.53 0.13 0.00 -0.52 0.00 0.00 55.73 57.32 1r58 s ARG 296 Cb -0.24 -3.46 0.99 0.00 0.52 0.00 0.00 34.95 32.76 1r58 s ARG 296 CO 0.30 -0.20 1.98 -0.07 0.02 0.00 0.00 175.30 177.33 1r58 h LEU 297 N 7.23 0.41 -1.60 2.53 -0.00 -1.08 -0.68 115.31 122.11 1r58 h LEU 297 Ca -0.38 0.01 -0.04 0.00 -0.00 0.00 0.00 57.88 57.47 1r58 h LEU 297 Cb 1.20 -0.08 -0.01 0.00 -0.00 0.00 0.00 40.66 41.77 1r58 h LEU 297 CO 0.80 0.25 -0.19 0.00 -0.00 0.00 0.00 178.44 179.30 1r58 h ASP 299 N 0.00 0.25 -0.41 0.00 3.32 -1.42 -2.38 116.42 115.77 1r58 h ASP 299 Ca -0.00 -0.21 -0.08 0.00 0.02 0.00 0.00 57.03 56.75 1r58 h ASP 299 Cb 0.49 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.95 1r58 h ASP 299 CO 0.02 1.05 -0.07 0.58 -1.72 0.00 0.00 179.24 179.11 1r58 h VAL 300 N 0.09 1.27 -0.68 -1.35 2.07 -1.31 -1.54 116.25 114.80 1r58 h VAL 300 Ca -0.05 -1.14 -0.07 0.00 0.82 0.00 0.00 66.70 66.26 1r58 h VAL 300 Cb 1.59 1.17 -0.03 0.00 -1.52 0.00 0.00 31.29 32.50 1r58 h VAL 300 CO 0.14 0.39 0.15 1.23 0.02 0.00 0.00 177.57 179.49 1r58 h GLY 301 N 0.60 1.18 1.02 2.17 0.00 -1.47 -0.16 103.07 106.41 1r58 h GLY 301 Ca 0.11 -0.75 -0.05 0.00 0.00 0.00 0.00 47.33 46.64 1r58 h GLY 301 CO 0.03 0.70 0.19 -2.09 0.00 0.00 0.00 176.54 175.37 1r58 h GLU 302 N 1.04 0.99 -0.42 4.80 4.81 -0.78 -1.32 114.58 123.70 1r58 h GLU 302 Ca 0.21 -0.22 -0.03 0.00 -0.13 0.00 0.00 59.36 59.19 1r58 h GLU 302 Cb 0.39 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.61 1r58 h GLU 302 CO 0.01 0.88 0.15 0.00 -0.73 0.00 0.00 179.01 179.31 1r58 h ALA 303 N 1.07 0.55 -0.30 2.92 0.00 -0.90 -2.02 119.26 120.58 1r58 h ALA 303 Ca 0.20 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 1r58 h ALA 303 Cb 0.30 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1r58 h ALA 303 CO -0.01 0.18 0.18 0.82 0.00 0.00 0.00 179.25 180.42 1r58 h ILE 304 N 0.53 1.10 -0.80 0.00 2.04 -0.78 -2.83 117.51 116.77 1r58 h ILE 304 Ca 0.14 -0.24 -0.03 0.00 1.00 0.00 0.00 64.86 65.73 1r58 h ILE 304 Cb 0.23 0.73 -0.04 0.00 -0.74 0.00 0.00 36.82 37.00 1r58 h ILE 304 CO -0.01 0.10 0.38 -0.61 0.00 0.00 0.00 178.15 178.02 1r58 h GLN 305 N 0.38 1.15 -0.35 2.37 4.15 -1.14 -1.14 115.11 120.53 1r58 h GLN 305 Ca 0.11 -0.17 0.01 0.00 0.77 0.00 0.00 58.65 59.37 1r58 h GLN 305 Cb 0.01 -0.21 -0.02 0.00 0.21 0.00 0.00 27.48 27.47 1r58 h GLN 305 CO -0.02 0.89 0.21 1.49 -1.93 0.00 0.00 178.83 179.47 1r58 h GLU 306 N 1.13 0.42 -0.10 1.69 4.81 -1.21 -0.03 114.58 121.28 1r58 h GLU 306 Ca 0.27 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.46 1r58 h GLU 306 Cb 0.12 -0.09 -0.00 0.00 0.63 0.00 0.00 28.75 29.40 1r58 h GLU 306 CO -0.03 0.28 -0.01 0.28 -0.73 0.00 0.00 179.01 178.79 1r58 h VAL 307 N 0.43 1.27 -0.39 0.32 2.07 -1.37 -2.79 116.25 115.80 1r58 h VAL 307 Ca 0.13 -0.85 0.07 0.00 0.82 0.00 0.00 66.70 66.87 1r58 h VAL 307 Cb -0.01 1.63 -0.06 0.00 -1.52 0.00 0.00 31.29 31.32 1r58 h VAL 307 CO -0.05 0.24 0.01 -0.03 0.02 0.00 0.00 177.57 177.76 1r58 h MET 308 N -0.10 0.11 0.00 1.57 1.85 -0.98 -1.72 114.93 115.65 1r58 h MET 308 Ca 0.03 -0.01 0.00 0.00 -0.61 0.00 0.00 59.70 59.11 1r58 h MET 308 Cb 0.38 -0.02 0.00 0.00 0.43 0.00 0.00 31.60 32.39 1r58 h MET 308 CO 0.01 0.07 0.00 0.39 -0.40 0.00 0.00 176.91 176.98 1r58 n GLU 309 N -5.18 0.23 0.00 0.39 1.02 -0.05 -2.62 120.64 114.43 1r58 n GLU 309 Ca 0.02 0.08 0.14 0.00 -0.02 0.00 0.00 57.16 57.38 1r58 n GLU 309 Cb 0.20 -1.50 0.74 0.00 -0.02 0.00 0.00 31.44 30.86 1r58 n GLU 309 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 1r58 n SER 310 N -1.35 0.00 -4.67 1.62 3.41 -0.65 -4.73 113.62 107.25 1r58 n SER 310 Ca 0.09 -0.24 -0.35 0.00 -0.26 0.00 0.00 58.87 58.12 1r58 n SER 310 Cb 0.21 -0.24 -0.09 0.00 -0.26 0.00 0.00 64.21 63.83 1r58 n SER 310 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 1r58 s TYR 311 N -2.48 3.30 -0.03 7.33 1.51 -1.08 -5.07 117.35 120.83 1r58 s TYR 311 Ca 0.29 0.16 0.07 0.00 -1.01 0.00 0.00 57.07 56.59 1r58 s TYR 311 Cb 0.19 -2.05 -0.02 0.00 -0.11 0.00 0.00 41.96 39.97 1r58 s TYR 311 CO 0.42 0.25 -0.25 -1.83 -1.11 0.00 0.00 175.55 173.04 1r58 s GLU 312 N 0.13 2.20 0.13 -0.62 -1.05 -1.26 -1.45 118.70 116.77 1r58 s GLU 312 Ca 0.06 -0.90 0.04 0.00 -0.15 0.00 0.00 54.97 54.01 1r58 s GLU 312 Cb -0.12 -2.09 -0.04 0.00 -0.44 0.00 0.00 34.13 31.44 1r58 s GLU 312 CO 0.00 0.55 -0.10 0.14 0.95 0.00 0.00 175.26 176.81 1r58 s VAL 313 N -0.58 1.04 -0.13 1.83 -7.23 0.12 -4.95 120.40 110.51 1r58 s VAL 313 Ca 0.09 -1.93 0.01 0.00 -1.81 0.00 0.00 61.98 58.34 1r58 s VAL 313 Cb -0.10 -1.70 0.02 0.00 0.56 0.00 0.00 36.38 35.16 1r58 s VAL 313 CO -0.00 -0.71 -0.13 -0.70 -0.31 0.00 0.00 175.10 173.24 1r58 s GLU 314 N -3.50 2.13 -0.09 4.82 2.12 -1.26 0.21 118.70 123.13 1r58 s GLU 314 Ca 0.13 -0.51 -0.01 0.00 0.36 0.00 0.00 54.97 54.95 1r58 s GLU 314 Cb 0.01 -1.93 0.03 0.00 0.26 0.00 0.00 34.13 32.50 1r58 s GLU 314 CO -0.00 -0.18 -0.04 0.42 -0.54 0.00 0.00 175.26 174.92 1r58 s ILE 315 N 1.34 0.68 -1.40 -3.70 1.01 0.74 -4.84 121.20 115.03 1r58 s ILE 315 Ca 0.01 -0.09 -0.04 0.00 0.00 0.00 0.00 60.65 60.53 1r58 s ILE 315 Cb -0.14 -0.76 0.03 0.00 0.01 0.00 0.00 42.46 41.60 1r58 s ILE 315 CO -0.07 0.30 0.70 0.47 0.00 0.00 0.00 174.94 176.35 1r58 n ASP 316 N 4.92 -1.87 0.00 3.58 8.00 -1.26 -1.70 116.55 128.23 1r58 n ASP 316 Ca -0.11 -0.86 0.00 0.00 0.71 0.00 0.00 54.79 54.53 1r58 n ASP 316 Cb 0.50 -3.74 0.00 0.00 -0.02 0.00 0.00 41.12 37.86 1r58 n ASP 316 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1r58 n GLY 317 N -1.68 1.22 3.47 0.44 0.00 -1.26 -5.02 105.19 102.35 1r58 n GLY 317 Ca -0.21 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.48 1r58 n GLY 317 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1r58 s LYS 318 N -0.03 2.53 0.07 1.61 2.20 -0.69 -5.13 119.74 120.31 1r58 s LYS 318 Ca 0.00 -0.70 0.02 0.00 -0.36 0.00 0.00 55.97 54.94 1r58 s LYS 318 Cb 0.00 -2.38 -0.04 0.00 -1.51 0.00 0.00 37.83 33.90 1r58 s LYS 318 CO 0.00 0.60 0.08 0.95 -0.36 0.00 0.00 175.35 176.63 1r58 s THR 319 N -0.68 4.58 0.00 3.43 -4.23 -1.26 -0.18 115.64 117.30 1r58 s THR 319 Ca 0.10 -0.71 -0.11 0.00 -1.18 0.00 0.00 61.69 59.80 1r58 s THR 319 Cb -0.11 -3.19 0.01 0.00 1.34 0.00 0.00 72.50 70.55 1r58 s THR 319 CO 0.01 0.16 0.21 -0.31 -0.54 0.00 0.00 174.62 174.15 1r58 s TYR 320 N -1.36 -0.04 -0.28 3.99 1.51 0.13 -4.96 117.35 116.34 1r58 s TYR 320 Ca 0.29 -0.00 -0.11 0.00 -1.01 0.00 0.00 57.07 56.23 1r58 s TYR 320 Cb -0.12 0.01 -0.05 0.00 -0.11 0.00 0.00 41.96 41.69 1r58 s TYR 320 CO 0.21 -0.35 0.21 -1.14 -1.11 0.00 0.00 175.55 173.37 1r58 s GLN 321 N -1.53 3.97 0.18 -0.62 0.74 -1.26 0.13 119.66 121.27 1r58 s GLN 321 Ca -0.13 -0.28 -0.33 0.00 0.05 0.00 0.00 55.36 54.67 1r58 s GLN 321 Cb -0.06 -3.65 -0.14 0.00 1.10 0.00 0.00 33.01 30.27 1r58 s GLN 321 CO 0.02 -0.17 1.54 0.28 -0.55 0.00 0.00 175.29 176.41 1r58 n VAL 322 N 5.00 0.25 -4.62 1.34 0.31 -0.53 -4.93 118.33 115.15 1r58 n VAL 322 Ca -0.13 -0.06 -0.33 0.00 -0.01 0.00 0.00 64.34 63.80 1r58 n VAL 322 Cb 0.52 -1.55 -0.13 0.00 -0.91 0.00 0.00 33.84 31.78 1r58 n VAL 322 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1r58 s LYS 323 N 0.57 3.20 0.47 5.55 1.02 -0.83 -3.97 119.74 125.76 1r58 s LYS 323 Ca 0.76 -0.59 -0.21 0.00 0.02 0.00 0.00 55.97 55.95 1r58 s LYS 323 Cb -0.66 -2.69 -0.08 0.00 -0.52 0.00 0.00 37.83 33.88 1r58 s LYS 323 CO 0.41 0.40 1.06 -2.14 -0.92 0.00 0.00 175.35 174.16 1r58 s PRO 324 N -0.11 3.83 -0.65 -1.68 0.02 -1.26 -0.22 135.00 134.92 1r58 s PRO 324 Ca 0.01 1.46 -0.26 0.00 0.02 0.00 0.00 61.00 62.22 1r58 s PRO 324 Cb -0.13 -2.21 0.04 0.00 0.02 0.00 0.00 34.50 32.22 1r58 s PRO 324 CO 0.03 -0.42 1.15 0.42 -0.33 0.00 0.00 177.00 177.85 1r58 s ILE 325 N -1.85 4.01 0.34 2.83 1.01 -0.57 -4.71 121.20 122.26 1r58 s ILE 325 Ca 0.65 0.39 0.10 0.00 0.00 0.00 0.00 60.65 61.79 1r58 s ILE 325 Cb -0.19 -4.77 0.33 0.00 0.01 0.00 0.00 42.46 37.84 1r58 s ILE 325 CO 0.24 -1.53 1.80 0.08 0.00 0.00 0.00 174.94 175.52 1r58 h ARG 326 N 9.70 0.63 -0.85 2.79 0.11 -1.44 -2.35 114.38 122.98 1r58 h ARG 326 Ca -0.27 -0.04 -0.23 0.00 0.10 0.00 0.00 59.98 59.54 1r58 h ARG 326 Cb 1.06 -0.14 -0.14 0.00 1.11 0.00 0.00 29.97 31.86 1r58 h ARG 326 CO 1.21 0.42 0.29 0.27 0.10 0.00 0.00 179.97 182.26 1r58 n ASN 327 N -4.69 4.17 -4.33 0.08 2.04 -1.26 -4.85 115.26 106.42 1r58 n ASN 327 Ca 0.22 -3.05 -0.21 0.00 -0.44 0.00 0.00 54.58 51.10 1r58 n ASN 327 Cb 0.62 -0.72 -0.11 0.00 -2.53 0.00 0.00 39.78 37.04 1r58 n ASN 327 CO 0.00 0.00 0.00 -0.76 -0.44 0.00 0.00 177.26 176.06 1r58 s LEU 328 N -2.47 2.44 0.16 -4.53 1.43 -0.88 -4.93 118.68 109.89 1r58 s LEU 328 Ca 0.45 -0.86 -0.24 0.00 -1.03 0.00 0.00 54.13 52.45 1r58 s LEU 328 Cb 0.36 -0.81 0.08 0.00 0.03 0.00 0.00 46.19 45.85 1r58 s LEU 328 CO 0.11 -0.04 1.05 0.54 0.23 0.00 0.00 176.35 178.23 1r58 s ASN 329 N -2.67 -0.04 0.85 2.29 2.20 -1.26 -4.65 114.94 111.66 1r58 s ASN 329 Ca 0.15 -0.56 -0.05 0.00 -0.94 0.00 0.00 52.86 51.46 1r58 s ASN 329 Cb -0.06 0.46 0.09 0.00 -2.00 0.00 0.00 41.25 39.75 1r58 s ASN 329 CO 0.06 -0.89 0.58 0.61 -2.94 0.00 0.00 177.10 174.52 1r58 n GLY 330 N -0.65 -0.65 3.58 0.45 0.00 0.15 -4.76 105.19 103.31 1r58 n GLY 330 Ca -0.04 -1.79 -0.07 0.00 0.00 0.00 0.00 46.02 44.13 1r58 n GLY 330 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1r58 s HIS 331 N -2.05 -0.22 0.60 1.61 -3.43 -0.70 -1.48 115.29 109.62 1r58 s HIS 331 Ca 0.34 0.27 -0.14 0.00 -0.80 0.00 0.00 55.06 54.74 1r58 s HIS 331 Cb -0.01 0.49 -0.04 0.00 -1.43 0.00 0.00 32.58 31.59 1r58 s HIS 331 CO 0.24 -0.27 1.03 -1.54 -2.00 0.00 0.00 174.74 172.20 1r58 s SER 332 N -1.66 5.99 0.04 7.38 1.04 -0.77 0.37 113.70 126.09 1r58 s SER 332 Ca 0.05 1.64 0.09 0.00 0.48 0.00 0.00 55.95 58.21 1r58 s SER 332 Cb -0.01 -2.51 -0.03 0.00 0.10 0.00 0.00 66.02 63.57 1r58 s SER 332 CO -0.04 -1.03 -0.25 -0.63 0.98 0.00 0.00 173.24 172.27 1r58 s ILE 333 N -2.74 2.22 0.35 -1.02 1.01 0.16 -1.69 121.20 119.50 1r58 s ILE 333 Ca 0.60 -1.35 0.05 0.00 0.00 0.00 0.00 60.65 59.94 1r58 s ILE 333 Cb -0.13 -1.87 -0.07 0.00 0.01 0.00 0.00 42.46 40.40 1r58 s ILE 333 CO 0.42 0.37 0.04 -0.83 0.00 0.00 0.00 174.94 174.95 1r58 s GLY 334 N -1.24 2.21 -0.00 6.18 0.00 0.83 -4.37 107.32 110.93 1r58 s GLY 334 Ca 0.12 -2.14 -0.30 0.00 0.00 0.00 0.00 44.72 42.40 1r58 s GLY 334 CO 0.02 -1.91 1.78 1.62 0.00 0.00 0.00 173.10 174.62 1r58 s GLN 335 N -3.83 4.17 -1.80 2.90 0.74 -1.26 -0.99 119.66 119.58 1r58 s GLN 335 Ca 0.36 2.38 0.00 0.00 0.05 0.00 0.00 55.36 58.15 1r58 s GLN 335 Cb 0.09 -4.00 0.00 0.00 1.10 0.00 0.00 33.01 30.20 1r58 s GLN 335 CO 0.16 -0.88 0.00 0.66 -0.55 0.00 0.00 175.29 174.69 1r58 n TYR 336 N 7.09 0.00 -3.63 1.67 4.01 -0.41 -4.92 117.16 120.97 1r58 n TYR 336 Ca 0.18 0.00 -0.29 0.00 -0.16 0.00 0.00 57.90 57.63 1r58 n TYR 336 Cb 0.42 -3.21 -0.13 0.00 -0.31 0.00 0.00 39.34 36.11 1r58 n TYR 336 CO 0.00 0.00 0.00 0.50 -0.46 0.00 0.00 176.86 176.90 1r58 s ARG 337 N -3.44 0.96 0.47 -0.72 3.52 -0.16 -4.28 118.95 115.29 1r58 s ARG 337 Ca 0.00 -1.64 0.26 0.00 -0.13 0.00 0.00 55.73 54.22 1r58 s ARG 337 Cb 0.00 -1.94 1.31 0.00 -1.56 0.00 0.00 34.95 32.76 1r58 s ARG 337 CO 0.00 -1.15 1.80 0.97 -0.81 0.00 0.00 175.30 176.11 1r58 h ILE 338 N 5.35 0.49 -3.55 4.11 6.09 -1.88 0.24 117.51 128.35 1r58 h ILE 338 Ca -0.01 -0.07 -0.63 0.00 -1.37 0.00 0.00 64.86 62.79 1r58 h ILE 338 Cb 0.95 0.26 -0.39 0.00 0.47 0.00 0.00 36.82 38.11 1r58 h ILE 338 CO 0.41 0.04 -0.75 -1.00 -3.07 0.00 0.00 178.15 173.77 1r58 s HIS 339 N -5.23 2.79 -0.35 2.19 3.76 -1.26 -4.46 115.29 112.73 1r58 s HIS 339 Ca -0.07 -2.25 0.24 0.00 -0.15 0.00 0.00 55.06 52.82 1r58 s HIS 339 Cb 0.24 -2.14 0.45 0.00 1.11 0.00 0.00 32.58 32.24 1r58 s HIS 339 CO 0.80 -0.87 1.65 0.00 -0.85 0.00 0.00 174.74 175.46 1r58 h ALA 340 N 7.85 0.98 0.00 -1.40 0.00 -1.40 -3.46 119.26 121.82 1r58 h ALA 340 Ca -0.12 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1r58 h ALA 340 Cb 1.04 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1r58 h ALA 340 CO 0.47 0.05 0.00 0.41 0.00 0.00 0.00 179.25 180.18 1r58 n GLY 341 N 0.97 3.69 3.85 0.00 0.00 -1.26 -4.99 105.19 107.45 1r58 n GLY 341 Ca 0.03 -0.53 -0.35 0.00 0.00 0.00 0.00 46.02 45.17 1r58 n GLY 341 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1r58 s LYS 342 N 0.00 3.95 -0.02 1.61 1.02 -1.26 -4.99 119.74 120.05 1r58 s LYS 342 Ca 0.00 0.45 0.08 0.00 0.02 0.00 0.00 55.97 56.52 1r58 s LYS 342 Cb 0.00 -2.89 -0.02 0.00 -0.52 0.00 0.00 37.83 34.40 1r58 s LYS 342 CO 0.00 0.46 -0.24 0.95 -0.92 0.00 0.00 175.35 175.59 1r58 s THR 343 N -1.52 2.19 -0.60 2.17 -4.23 -1.26 -1.84 115.64 110.55 1r58 s THR 343 Ca 0.39 -1.08 -0.12 0.00 -1.18 0.00 0.00 61.69 59.70 1r58 s THR 343 Cb -0.14 -1.78 0.15 0.00 1.34 0.00 0.00 72.50 72.07 1r58 s THR 343 CO 0.19 0.56 0.52 -0.69 -0.54 0.00 0.00 174.62 174.66 1r58 s VAL 344 N -0.65 4.84 0.00 2.29 1.01 -0.55 -4.89 120.40 122.45 1r58 s VAL 344 Ca 0.10 -2.01 0.00 0.00 0.00 0.00 0.00 61.98 60.07 1r58 s VAL 344 Cb -0.10 -4.10 0.00 0.00 0.00 0.00 0.00 36.38 32.18 1r58 s VAL 344 CO -0.00 -0.88 0.00 -0.81 0.00 0.00 0.00 175.10 173.40 1r58 n PRO 345 N 4.61 0.00 0.00 2.72 -0.04 -1.26 0.32 135.00 141.34 1r58 n PRO 345 Ca -0.02 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.44 1r58 n PRO 345 Cb 0.42 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.88 1r58 n PRO 345 CO 0.00 0.00 0.00 1.51 -0.04 0.00 0.00 175.50 176.97 1r58 n ILE 346 N 0.00 0.00 0.00 0.52 0.13 -1.26 -3.91 119.36 114.84 1r58 n ILE 346 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 62.75 61.65 1r58 n ILE 346 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 39.64 38.80 1r58 n ILE 346 CO 0.00 0.00 0.00 2.30 2.80 0.00 0.00 176.55 181.65 1r58 n ILE 347 N 0.00 0.00 0.00 9.51 -5.35 -1.20 -3.62 119.36 118.71 1r58 n ILE 347 Ca 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.48 1r58 n ILE 347 Cb 0.00 0.00 0.00 0.00 -1.74 0.00 0.00 39.64 37.90 1r58 n ILE 347 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 1r58 n LYS 348 N 0.00 0.00 -1.20 6.28 5.02 -1.26 -1.72 118.16 125.28 1r58 n LYS 348 Ca 0.00 0.00 -0.10 0.00 -2.02 0.00 0.00 58.31 56.19 1r58 n LYS 348 Cb 0.00 0.00 -0.06 0.00 -0.02 0.00 0.00 35.03 34.95 1r58 n LYS 348 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1r58 n GLY 349 N 1.04 -0.16 2.71 0.72 0.00 -1.26 -4.51 105.19 103.73 1r58 n GLY 349 Ca 0.00 -0.05 -0.24 0.00 0.00 0.00 0.00 46.02 45.73 1r58 n GLY 349 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1r58 n GLY 350 N 5.15 5.04 0.93 -0.02 0.00 -1.26 -5.06 105.19 109.96 1r58 n GLY 350 Ca 0.21 -2.47 0.00 0.00 0.00 0.00 0.00 46.02 43.76 1r58 n GLY 350 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1r58 n GLU 351 N -0.13 -2.45 -0.44 1.61 1.02 -1.26 -4.12 120.64 114.88 1r58 n GLU 351 Ca 0.29 1.81 0.04 0.00 -0.02 0.00 0.00 57.16 59.28 1r58 n GLU 351 Cb 0.49 -1.93 0.21 0.00 -0.02 0.00 0.00 31.44 30.18 1r58 n GLU 351 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1r58 n ALA 352 N 0.13 3.15 -1.73 0.62 0.00 -1.26 -1.56 120.51 119.86 1r58 n ALA 352 Ca 0.00 -0.96 -0.38 0.00 0.00 0.00 0.00 53.44 52.10 1r58 n ALA 352 Cb 0.00 -1.06 0.05 0.00 0.00 0.00 0.00 19.45 18.44 1r58 n ALA 352 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1r58 n THR 353 N 0.35 3.95 -3.80 0.00 -2.24 -1.26 -4.54 114.28 106.74 1r58 n THR 353 Ca 0.14 -0.50 -0.26 0.00 -2.27 0.00 0.00 64.05 61.16 1r58 n THR 353 Cb 0.71 -1.61 -0.03 0.00 -2.10 0.00 0.00 70.33 67.30 1r58 n THR 353 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1r58 s ARG 354 N -2.92 3.48 0.34 -0.78 3.00 -1.26 -0.71 118.95 120.09 1r58 s ARG 354 Ca 0.73 -0.49 -0.22 0.00 0.00 0.00 0.00 55.73 55.76 1r58 s ARG 354 Cb -0.42 -2.88 -0.10 0.00 0.00 0.00 0.00 34.95 31.56 1r58 s ARG 354 CO 0.48 0.43 0.88 -1.64 0.00 0.00 0.00 175.30 175.45 1r58 s MET 355 N -3.45 4.32 0.19 3.54 -1.94 -0.23 -4.90 119.30 116.82 1r58 s MET 355 Ca 0.37 1.08 0.11 0.00 -1.71 0.00 0.00 55.69 55.53 1r58 s MET 355 Cb -0.11 -2.55 -0.04 0.00 2.01 0.00 0.00 34.83 34.14 1r58 s MET 355 CO 0.29 0.18 -0.24 -1.21 -0.01 0.00 0.00 175.02 174.03 1r58 s GLU 356 N -2.56 1.49 0.36 2.03 2.02 -1.26 -0.99 118.70 119.79 1r58 s GLU 356 Ca 0.54 -1.51 -0.28 0.00 0.02 0.00 0.00 54.97 53.74 1r58 s GLU 356 Cb -0.14 -1.80 -0.12 0.00 0.10 0.00 0.00 34.13 32.18 1r58 s GLU 356 CO 0.19 0.39 1.31 -1.91 0.02 0.00 0.00 175.26 175.25 1r58 n GLU 357 N 0.30 2.16 -0.19 1.61 2.13 -1.26 -1.96 120.64 123.42 1r58 n GLU 357 Ca -0.13 0.76 0.00 0.00 0.66 0.00 0.00 57.16 58.45 1r58 n GLU 357 Cb 0.56 -2.38 0.00 0.00 0.27 0.00 0.00 31.44 29.89 1r58 n GLU 357 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1r58 n GLY 358 N 0.74 1.88 3.85 8.31 0.00 0.14 -5.03 105.19 115.07 1r58 n GLY 358 Ca 0.05 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.75 1r58 n GLY 358 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1r58 s GLU 359 N -0.25 3.89 -0.07 1.61 2.02 -0.83 -4.79 118.70 120.28 1r58 s GLU 359 Ca 0.00 0.88 0.05 0.00 0.02 0.00 0.00 54.97 55.92 1r58 s GLU 359 Cb 0.00 -2.15 -0.01 0.00 0.10 0.00 0.00 34.13 32.07 1r58 s GLU 359 CO 0.00 -0.29 -0.24 0.08 0.02 0.00 0.00 175.26 174.84 1r58 s VAL 360 N -2.67 2.16 0.09 2.63 1.01 -1.26 -0.72 120.40 121.63 1r58 s VAL 360 Ca 0.58 -1.02 0.06 0.00 0.00 0.00 0.00 61.98 61.59 1r58 s VAL 360 Cb -0.10 -1.80 -0.03 0.00 0.00 0.00 0.00 36.38 34.45 1r58 s VAL 360 CO 0.34 0.57 -0.15 -0.31 0.00 0.00 0.00 175.10 175.55 1r58 s TYR 361 N -0.05 1.31 -0.39 5.22 1.51 -0.28 0.40 117.35 125.07 1r58 s TYR 361 Ca -0.07 -0.48 -0.10 0.00 -1.01 0.00 0.00 57.07 55.41 1r58 s TYR 361 Cb -0.15 -0.72 0.05 0.00 -0.11 0.00 0.00 41.96 41.03 1r58 s TYR 361 CO 0.05 0.09 0.22 0.00 -1.11 0.00 0.00 175.55 174.80 1r58 s ALA 362 N -1.50 3.27 -0.51 3.71 0.00 0.16 -0.00 121.76 126.89 1r58 s ALA 362 Ca 0.02 -1.89 -0.20 0.00 0.00 0.00 0.00 51.96 49.88 1r58 s ALA 362 Cb -0.09 -2.61 0.05 0.00 0.00 0.00 0.00 23.12 20.48 1r58 s ALA 362 CO 0.03 -1.50 0.70 0.42 0.00 0.00 0.00 175.76 175.41 1r58 s ILE 363 N 1.50 4.76 -0.02 0.00 -1.09 0.44 -1.72 121.20 125.08 1r58 s ILE 363 Ca 0.02 -0.28 0.03 0.00 -2.23 0.00 0.00 60.65 58.19 1r58 s ILE 363 Cb -0.21 -4.34 0.00 0.00 -1.58 0.00 0.00 42.46 36.33 1r58 s ILE 363 CO 0.05 -0.86 -0.09 -1.83 -1.23 0.00 0.00 174.94 170.98 1r58 s GLU 364 N 2.93 0.91 0.14 2.79 -1.05 -1.26 -1.76 118.70 121.39 1r58 s GLU 364 Ca 0.19 -0.31 0.06 0.00 -0.15 0.00 0.00 54.97 54.76 1r58 s GLU 364 Cb -0.17 -0.85 -0.04 0.00 -0.44 0.00 0.00 34.13 32.62 1r58 s GLU 364 CO 0.14 0.13 -0.14 0.95 0.95 0.00 0.00 175.26 177.29 1r58 s THR 365 N 0.09 1.41 -0.02 1.83 -4.23 -1.01 -3.72 115.64 109.99 1r58 s THR 365 Ca -0.01 -1.81 0.03 0.00 -1.18 0.00 0.00 61.69 58.71 1r58 s THR 365 Cb -0.07 -1.64 0.00 0.00 1.34 0.00 0.00 72.50 72.13 1r58 s THR 365 CO 0.00 -0.44 -0.09 -0.36 -0.54 0.00 0.00 174.62 173.19 1r58 s PHE 366 N -2.29 0.95 0.08 3.99 0.08 -1.26 -3.01 117.98 116.52 1r58 s PHE 366 Ca 0.11 -0.23 0.09 0.00 0.12 0.00 0.00 56.93 57.03 1r58 s PHE 366 Cb -0.04 -0.67 -0.03 0.00 -0.57 0.00 0.00 43.02 41.71 1r58 s PHE 366 CO 0.04 -0.09 -0.24 0.20 -0.10 0.00 0.00 175.22 175.03 1r58 s GLY 367 N 0.14 1.53 0.03 4.36 0.00 -0.53 -1.52 107.32 111.32 1r58 s GLY 367 Ca -0.02 -1.33 -0.08 0.00 0.00 0.00 0.00 44.72 43.29 1r58 s GLY 367 CO 0.00 -1.26 0.15 -0.45 0.00 0.00 0.00 173.10 171.55 1r58 s SER 368 N -1.64 0.06 0.00 1.64 0.15 0.69 -1.30 113.70 113.30 1r58 s SER 368 Ca 0.14 -0.34 0.23 0.00 0.70 0.00 0.00 55.95 56.67 1r58 s SER 368 Cb -0.10 0.25 0.29 0.00 -1.71 0.00 0.00 66.02 64.74 1r58 s SER 368 CO 0.05 -0.48 1.30 0.35 1.20 0.00 0.00 173.24 175.66 1r58 n THR 369 N 0.97 0.23 0.00 6.45 -2.24 -0.60 -1.96 114.28 117.14 1r58 n THR 369 Ca -0.20 -0.61 0.00 0.00 -2.27 0.00 0.00 64.05 60.96 1r58 n THR 369 Cb 0.58 1.26 0.00 0.00 -2.10 0.00 0.00 70.33 70.06 1r58 n THR 369 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1r58 n GLY 370 N 1.37 1.06 0.15 3.38 0.00 -1.26 -4.81 105.19 105.08 1r58 n GLY 370 Ca 0.16 -0.71 0.12 0.00 0.00 0.00 0.00 46.02 45.59 1r58 n GLY 370 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1r58 h LYS 371 N 0.00 0.00 0.00 1.61 1.57 -1.94 -3.48 116.57 114.33 1r58 h LYS 371 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1r58 h LYS 371 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1r58 h LYS 371 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.29 1r58 n GLY 372 N 1.21 0.38 3.13 3.86 0.00 -1.26 -4.97 105.19 107.54 1r58 n GLY 372 Ca 0.04 -0.89 -0.12 0.00 0.00 0.00 0.00 46.02 45.05 1r58 n GLY 372 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1r58 s VAL 373 N -2.00 -0.02 0.18 1.61 1.01 -1.26 -1.04 120.40 118.88 1r58 s VAL 373 Ca 0.00 0.06 0.06 0.00 0.00 0.00 0.00 61.98 62.10 1r58 s VAL 373 Cb 0.00 -0.40 -0.04 0.00 0.00 0.00 0.00 36.38 35.94 1r58 s VAL 373 CO 0.00 0.03 0.10 0.68 0.00 0.00 0.00 175.10 175.91 1r58 s VAL 374 N 0.68 4.24 0.04 2.92 -7.23 -1.26 -4.27 120.40 115.51 1r58 s VAL 374 Ca -0.04 -1.24 -0.03 0.00 -1.81 0.00 0.00 61.98 58.85 1r58 s VAL 374 Cb -0.06 -3.17 -0.02 0.00 0.56 0.00 0.00 36.38 33.69 1r58 s VAL 374 CO -0.04 -0.15 0.03 -1.38 -0.31 0.00 0.00 175.10 173.25 1r58 s HIS 375 N -1.81 0.31 0.33 2.82 -3.43 -0.54 -4.86 115.29 108.10 1r58 s HIS 375 Ca 0.30 -0.67 -0.29 0.00 -0.80 0.00 0.00 55.06 53.60 1r58 s HIS 375 Cb -0.09 -0.22 -0.11 0.00 -1.43 0.00 0.00 32.58 30.73 1r58 s HIS 375 CO 0.22 -0.33 1.43 -0.51 -2.00 0.00 0.00 174.74 173.56 1r58 s ASP 376 N -2.21 6.54 -0.05 7.38 1.01 -1.26 -1.44 116.67 126.65 1r58 s ASP 376 Ca -0.04 2.85 -0.30 0.00 0.71 0.00 0.00 52.55 55.76 1r58 s ASP 376 Cb -0.01 -2.65 0.08 0.00 1.01 0.00 0.00 42.92 41.35 1r58 s ASP 376 CO -0.05 -0.74 0.71 -0.62 0.21 0.00 0.00 175.17 174.68 1r58 s ASP 377 N -0.07 -0.62 0.14 0.27 2.15 -0.58 -4.89 116.67 113.07 1r58 s ASP 377 Ca 0.54 0.64 0.00 0.00 0.43 0.00 0.00 52.55 54.17 1r58 s ASP 377 Cb -0.44 0.52 0.00 0.00 -0.30 0.00 0.00 42.92 42.70 1r58 s ASP 377 CO 0.54 -0.60 0.00 0.23 -0.17 0.00 0.00 175.17 175.17 1r58 n MET 378 N 0.82 -1.00 -2.08 4.34 2.81 -1.26 -3.65 117.12 117.10 1r58 n MET 378 Ca -0.18 0.72 -0.41 0.00 -1.81 0.00 0.00 57.70 56.02 1r58 n MET 378 Cb 0.58 -1.20 -0.02 0.00 -0.71 0.00 0.00 33.22 31.86 1r58 n MET 378 CO 0.00 0.00 0.00 -2.00 1.51 0.00 0.00 175.97 175.48 1r58 s GLU 379 N -2.12 4.31 0.34 0.03 2.12 -1.26 -4.67 118.70 117.45 1r58 s GLU 379 Ca 0.00 2.22 -0.27 0.00 0.36 0.00 0.00 54.97 57.29 1r58 s GLU 379 Cb 0.00 -3.13 -0.09 0.00 0.26 0.00 0.00 34.13 31.17 1r58 s GLU 379 CO 0.00 -0.34 1.07 0.00 -0.54 0.00 0.00 175.26 175.45 1r58 n SER 381 N 0.54 2.21 -4.79 0.00 3.41 -1.26 -4.96 113.62 108.75 1r58 n SER 381 Ca 0.02 0.00 -0.38 0.00 -0.26 0.00 0.00 58.87 58.25 1r58 n SER 381 Cb 0.47 0.25 -0.06 0.00 -0.26 0.00 0.00 64.21 64.62 1r58 n SER 381 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 1r58 s HIS 382 N -1.36 3.72 0.01 7.33 3.76 -1.26 -2.56 115.29 124.95 1r58 s HIS 382 Ca 0.00 1.14 -0.11 0.00 -0.15 0.00 0.00 55.06 55.94 1r58 s HIS 382 Cb 0.00 -2.48 0.01 0.00 1.11 0.00 0.00 32.58 31.22 1r58 s HIS 382 CO 0.00 0.49 0.23 0.71 -0.85 0.00 0.00 174.74 175.32 1r58 s TYR 383 N -0.65 -0.04 -0.27 1.40 2.02 -0.33 -1.23 117.35 118.25 1r58 s TYR 383 Ca 0.28 -0.04 -0.17 0.00 -0.37 0.00 0.00 57.07 56.76 1r58 s TYR 383 Cb -0.18 0.02 0.08 0.00 -0.40 0.00 0.00 41.96 41.48 1r58 s TYR 383 CO 0.16 -0.39 0.68 1.41 -1.57 0.00 0.00 175.55 175.84 1r58 s MET 384 N -1.89 0.72 0.44 -0.62 1.75 -0.79 -0.64 119.30 118.26 1r58 s MET 384 Ca -0.10 1.17 -0.26 0.00 -1.25 0.00 0.00 55.69 55.25 1r58 s MET 384 Cb -0.04 0.18 -0.09 0.00 2.84 0.00 0.00 34.83 37.72 1r58 s MET 384 CO 0.00 -0.14 1.41 1.17 -0.65 0.00 0.00 175.02 176.81 1r58 n LYS 385 N 4.05 2.26 -2.10 4.11 4.81 -1.26 -1.11 118.16 128.91 1r58 n LYS 385 Ca -0.19 0.80 -0.42 0.00 -0.87 0.00 0.00 58.31 57.63 1r58 n LYS 385 Cb 0.58 -2.60 -0.03 0.00 0.02 0.00 0.00 35.03 33.01 1r58 n LYS 385 CO 0.00 0.00 0.00 1.21 1.17 0.00 0.00 177.40 179.78 1r58 s ASN 386 N -0.43 6.75 0.43 3.14 3.04 -0.27 -4.83 114.94 122.77 1r58 s ASN 386 Ca 0.60 2.35 0.14 0.00 0.04 0.00 0.00 52.86 55.99 1r58 s ASN 386 Cb -0.46 -2.58 0.95 0.00 -1.54 0.00 0.00 41.25 37.62 1r58 s ASN 386 CO 0.58 -0.74 1.97 0.15 -3.04 0.00 0.00 177.10 176.02 1r58 h PHE 387 N 7.35 0.02 -0.01 0.43 3.57 -1.90 -2.83 116.94 123.56 1r58 h PHE 387 Ca -0.41 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.08 1r58 h PHE 387 Cb 1.20 -0.01 0.00 0.00 2.79 0.00 0.00 35.95 39.93 1r58 h PHE 387 CO 0.70 0.22 -0.15 -0.25 -2.23 0.00 0.00 178.31 176.61 1r58 n ASP 388 N -4.29 1.32 -4.71 0.41 10.43 -1.26 -4.86 116.55 113.59 1r58 n ASP 388 Ca -0.02 -1.20 -0.40 0.00 2.57 0.00 0.00 54.79 55.74 1r58 n ASP 388 Cb 0.27 0.08 -0.05 0.00 1.84 0.00 0.00 41.12 43.26 1r58 n ASP 388 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 1r58 s VAL 389 N -2.27 5.04 0.00 2.53 0.11 -1.07 -5.06 120.40 119.68 1r58 s VAL 389 Ca 0.30 1.44 0.00 0.00 -2.93 0.00 0.00 61.98 60.79 1r58 s VAL 389 Cb 0.20 -4.04 0.00 0.00 -1.53 0.00 0.00 36.38 31.01 1r58 s VAL 389 CO 0.44 0.23 0.00 0.61 -3.33 0.00 0.00 175.10 173.05 1r58 n GLY 390 N 3.17 0.71 3.72 6.54 0.00 -1.26 -4.92 105.19 113.14 1r58 n GLY 390 Ca -0.01 -1.93 -0.43 0.00 0.00 0.00 0.00 46.02 43.65 1r58 n GLY 390 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1r58 n HIS 391 N -1.12 2.64 -3.89 1.61 -0.00 -1.26 -4.99 115.22 108.21 1r58 n HIS 391 Ca 0.00 0.24 -0.28 0.00 0.46 0.00 0.00 57.72 58.14 1r58 n HIS 391 Cb 0.00 -2.58 -0.16 0.00 -0.12 0.00 0.00 29.99 27.12 1r58 n HIS 391 CO 0.00 0.00 0.00 0.08 0.46 0.00 0.00 176.34 176.88 1r58 s VAL 392 N 0.36 1.08 0.26 3.57 1.01 -1.26 -5.11 120.40 120.31 1r58 s VAL 392 Ca 0.69 -0.61 -0.30 0.00 0.00 0.00 0.00 61.98 61.76 1r58 s VAL 392 Cb -0.55 -1.26 -0.10 0.00 0.00 0.00 0.00 36.38 34.47 1r58 s VAL 392 CO 0.44 0.13 1.45 -2.84 0.00 0.00 0.00 175.10 174.27 1r58 s PRO 393 N 1.65 4.26 -0.04 2.72 0.02 -1.26 -5.01 135.00 137.33 1r58 s PRO 393 Ca 0.01 2.33 0.00 0.00 0.02 0.00 0.00 61.00 63.36 1r58 s PRO 393 Cb -0.15 -3.10 0.02 0.00 0.02 0.00 0.00 34.50 31.30 1r58 s PRO 393 CO -0.08 -0.43 -0.02 0.42 -0.33 0.00 0.00 177.00 176.57 1r58 s ILE 394 N -0.10 0.35 -0.18 2.83 1.01 -1.26 -5.03 121.20 118.82 1r58 s ILE 394 Ca 0.59 0.01 0.08 0.00 0.00 0.00 0.00 60.65 61.33 1r58 s ILE 394 Cb -0.42 -0.43 -0.22 0.00 0.01 0.00 0.00 42.46 41.40 1r58 s ILE 394 CO 0.45 0.19 0.11 0.54 0.00 0.00 0.00 174.94 176.23 1r58 n ARG 395 N 4.26 0.68 -1.60 2.79 3.00 -1.26 -4.74 116.66 119.78 1r58 n ARG 395 Ca -0.23 0.13 -0.57 0.00 -0.01 0.00 0.00 57.85 57.18 1r58 n ARG 395 Cb 0.50 -1.59 -0.08 0.00 0.00 0.00 0.00 32.46 31.30 1r58 n ARG 395 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 1r58 n LEU 396 N -3.07 2.12 -0.10 0.55 4.77 -1.26 -4.84 117.00 115.17 1r58 n LEU 396 Ca -0.34 0.88 -0.10 0.00 -0.03 0.00 0.00 56.01 56.41 1r58 n LEU 396 Cb 1.07 -1.14 -0.07 0.00 -2.33 0.00 0.00 43.42 40.95 1r58 n LEU 396 CO 0.38 -0.55 0.50 -0.65 -1.33 0.00 0.00 177.39 175.74 1r58 h PRO 397 N 8.61 -0.28 -0.56 3.23 0.11 -1.99 0.14 132.00 141.26 1r58 h PRO 397 Ca -0.38 0.02 -0.08 0.00 0.11 0.00 0.00 66.00 65.67 1r58 h PRO 397 Cb 1.33 0.06 -0.02 0.00 0.11 0.00 0.00 31.00 32.48 1r58 h PRO 397 CO 0.99 -0.18 0.04 0.00 -0.21 0.00 0.00 178.00 178.64 1r58 h ARG 398 N -0.29 0.93 -0.41 1.05 3.08 -2.00 -1.83 114.38 114.92 1r58 h ARG 398 Ca 0.05 -0.26 -0.14 0.00 0.07 0.00 0.00 59.98 59.70 1r58 h ARG 398 Cb 0.43 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.36 1r58 h ARG 398 CO -0.43 0.90 -0.31 1.15 -1.07 0.00 0.00 179.97 180.21 1r58 h THR 399 N 0.87 1.27 -0.01 2.04 2.02 -1.85 -2.17 112.91 115.08 1r58 h THR 399 Ca 0.17 -1.48 -0.00 0.00 0.77 0.00 0.00 66.41 65.87 1r58 h THR 399 Cb 0.46 1.29 -0.00 0.00 -1.74 0.00 0.00 68.15 68.15 1r58 h THR 399 CO 0.02 0.50 0.01 0.50 0.37 0.00 0.00 175.52 176.91 1r58 h LYS 400 N 0.77 0.02 -0.65 6.66 3.64 -0.55 -2.03 116.57 124.43 1r58 h LYS 400 Ca 0.08 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.45 1r58 h LYS 400 Cb 0.89 -0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.67 1r58 h LYS 400 CO 0.08 0.13 0.39 1.25 -2.27 0.00 0.00 179.45 179.03 1r58 h HIS 401 N -0.10 0.86 -0.44 1.91 2.76 -1.31 -2.00 115.15 116.84 1r58 h HIS 401 Ca 0.00 -0.01 -0.03 0.00 -2.20 0.00 0.00 60.37 58.14 1r58 h HIS 401 Cb 0.12 -0.28 -0.02 0.00 1.55 0.00 0.00 27.41 28.77 1r58 h HIS 401 CO -0.04 0.59 0.16 1.25 -1.30 0.00 0.00 177.93 178.59 1r58 h LEU 402 N 0.88 0.62 -0.97 0.26 5.85 -1.31 -0.39 115.31 120.25 1r58 h LEU 402 Ca 0.23 -0.18 0.02 0.00 0.84 0.00 0.00 57.88 58.79 1r58 h LEU 402 Cb -0.01 -0.16 -0.05 0.00 0.37 0.00 0.00 40.66 40.80 1r58 h LEU 402 CO -0.04 0.64 0.64 0.25 -0.34 0.00 0.00 178.44 179.58 1r58 h LEU 403 N 0.57 1.08 -0.66 2.25 5.85 -1.17 0.84 115.31 124.07 1r58 h LEU 403 Ca 0.14 -0.02 -0.07 0.00 0.84 0.00 0.00 57.88 58.78 1r58 h LEU 403 Cb 0.22 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 40.97 1r58 h LEU 403 CO -0.01 0.77 0.16 0.78 -0.34 0.00 0.00 178.44 179.80 1r58 h ASN 404 N 1.27 1.00 -0.68 1.25 2.35 -0.92 0.64 115.58 120.49 1r58 h ASN 404 Ca 0.37 -0.24 -0.02 0.00 -0.55 0.00 0.00 56.30 55.86 1r58 h ASN 404 Cb -0.09 -0.26 -0.03 0.00 0.05 0.00 0.00 38.32 37.99 1r58 h ASN 404 CO -0.10 0.98 0.36 0.58 -1.65 0.00 0.00 177.43 177.60 1r58 h VAL 405 N 0.98 1.22 -0.38 2.81 2.07 -0.21 -0.70 116.25 122.04 1r58 h VAL 405 Ca 0.21 -0.57 -0.04 0.00 0.82 0.00 0.00 66.70 67.11 1r58 h VAL 405 Cb 0.37 0.35 -0.01 0.00 -1.52 0.00 0.00 31.29 30.47 1r58 h VAL 405 CO 0.00 0.25 0.06 0.40 0.02 0.00 0.00 177.57 178.30 1r58 h ILE 406 N 0.94 1.24 -0.63 4.57 2.04 -0.43 -1.15 117.51 124.08 1r58 h ILE 406 Ca 0.24 -0.84 -0.07 0.00 1.00 0.00 0.00 64.86 65.19 1r58 h ILE 406 Cb 0.07 1.06 -0.03 0.00 -0.74 0.00 0.00 36.82 37.19 1r58 h ILE 406 CO -0.04 0.29 0.13 0.78 0.00 0.00 0.00 178.15 179.31 1r58 h ASN 407 N 0.46 0.95 -0.34 1.72 2.35 -0.64 0.18 115.58 120.27 1r58 h ASN 407 Ca 0.11 -0.20 -0.16 0.00 -0.55 0.00 0.00 56.30 55.50 1r58 h ASN 407 Cb 0.36 -0.25 -0.00 0.00 0.05 0.00 0.00 38.32 38.47 1r58 h ASN 407 CO 0.01 0.93 -0.42 -0.33 -1.65 0.00 0.00 177.43 175.97 1r58 h GLU 408 N 0.96 0.87 0.01 0.81 5.08 -1.02 -3.17 114.58 118.12 1r58 h GLU 408 Ca 0.20 -0.49 -0.34 0.00 -1.00 0.00 0.00 59.36 57.73 1r58 h GLU 408 Cb 0.37 0.03 -0.06 0.00 0.50 0.00 0.00 28.75 29.59 1r58 h GLU 408 CO 0.00 1.14 -2.10 0.09 -1.00 0.00 0.00 179.01 177.14 1r58 n ASN 409 N -4.09 0.68 0.00 1.42 3.02 -0.45 -4.76 115.26 111.09 1r58 n ASN 409 Ca -0.03 0.17 0.00 0.00 -0.03 0.00 0.00 54.58 54.68 1r58 n ASN 409 Cb 0.56 0.31 0.00 0.00 -0.61 0.00 0.00 39.78 40.04 1r58 n ASN 409 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1r58 n PHE 410 N -2.97 0.00 0.00 3.10 0.99 0.49 -4.76 117.46 114.30 1r58 n PHE 410 Ca -0.28 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.17 1r58 n PHE 410 Cb 1.09 0.00 0.00 0.00 -1.00 0.00 0.00 39.48 39.57 1r58 n PHE 410 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1r58 n GLY 411 N 2.99 3.50 0.84 1.37 0.00 -0.36 -0.98 105.19 112.56 1r58 n GLY 411 Ca 0.00 -0.11 0.09 0.00 0.00 0.00 0.00 46.02 46.00 1r58 n GLY 411 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1r58 n THR 412 N 0.00 0.51 -2.87 2.61 -2.24 -1.26 -4.54 114.28 106.49 1r58 n THR 412 Ca 0.00 -0.58 -0.33 0.00 -2.27 0.00 0.00 64.05 60.87 1r58 n THR 412 Cb 0.00 0.42 -0.06 0.00 -2.10 0.00 0.00 70.33 68.59 1r58 n THR 412 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1r58 s LEU 413 N -1.21 3.93 0.59 3.22 1.43 -0.15 -4.64 118.68 121.86 1r58 s LEU 413 Ca 0.33 1.52 -0.17 0.00 -1.03 0.00 0.00 54.13 54.78 1r58 s LEU 413 Cb 0.18 -4.36 -0.04 0.00 0.03 0.00 0.00 46.19 42.00 1r58 s LEU 413 CO 0.24 -0.34 1.08 0.00 0.23 0.00 0.00 176.35 177.56 1r58 s ALA 414 N -2.18 2.67 0.30 4.21 0.00 -1.23 -4.60 121.76 120.94 1r58 s ALA 414 Ca 0.59 0.54 -0.00 0.00 0.00 0.00 0.00 51.96 53.08 1r58 s ALA 414 Cb -0.10 -3.28 -0.02 0.00 0.00 0.00 0.00 23.12 19.73 1r58 s ALA 414 CO 0.18 -0.87 0.35 -0.59 0.00 0.00 0.00 175.76 174.83 1r58 s PHE 415 N -2.24 1.23 0.22 0.00 -0.12 0.19 -4.36 117.98 112.91 1r58 s PHE 415 Ca 0.67 -1.37 0.01 0.00 -0.05 0.00 0.00 56.93 56.18 1r58 s PHE 415 Cb -0.19 -0.34 -0.05 0.00 -0.63 0.00 0.00 43.02 41.82 1r58 s PHE 415 CO 0.34 -0.95 0.09 0.00 -0.05 0.00 0.00 175.22 174.65 1r58 h ARG 417 N 2.51 1.10 -0.59 0.00 3.08 -1.85 -2.08 114.38 116.55 1r58 h ARG 417 Ca -0.37 -0.07 0.06 0.00 0.07 0.00 0.00 59.98 59.67 1r58 h ARG 417 Cb 1.24 -0.25 -0.04 0.00 0.08 0.00 0.00 29.97 31.00 1r58 h ARG 417 CO 0.59 0.73 0.39 0.00 -1.07 0.00 0.00 179.97 180.62 1r58 h ARG 418 N 1.14 0.56 0.00 0.04 3.08 -1.88 0.19 114.38 117.50 1r58 h ARG 418 Ca 0.32 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.34 1r58 h ARG 418 Cb -0.09 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 29.83 1r58 h ARG 418 CO -0.08 0.37 0.00 -1.49 -1.07 0.00 0.00 179.97 177.70 1r58 h TRP 419 N 0.57 0.00 0.20 3.04 6.55 -1.79 -1.69 115.95 122.84 1r58 h TRP 419 Ca 0.26 0.00 -0.34 0.00 0.95 0.00 0.00 58.89 59.75 1r58 h TRP 419 Cb 0.28 0.00 0.02 0.00 -0.86 0.00 0.00 29.16 28.59 1r58 h TRP 419 CO -0.00 0.00 -1.65 -0.07 -1.05 0.00 0.00 178.44 175.67 1r58 h LEU 420 N 0.00 0.66 -0.26 -4.49 3.38 -0.93 -3.27 115.31 110.39 1r58 h LEU 420 Ca 0.00 -0.88 0.01 0.00 0.09 0.00 0.00 57.88 57.10 1r58 h LEU 420 Cb 0.64 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.16 1r58 h LEU 420 CO 0.00 1.73 0.16 0.44 0.09 0.00 0.00 178.44 180.86 1r58 h ASP 421 N 0.12 0.27 0.36 -0.43 3.32 -0.90 -2.11 116.42 117.05 1r58 h ASP 421 Ca -0.31 -0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.74 1r58 h ASP 421 Cb 2.11 -0.06 -0.00 0.00 0.22 0.00 0.00 39.33 41.60 1r58 h ASP 421 CO 0.21 0.20 -0.00 0.08 -1.72 0.00 0.00 179.24 178.00 1r58 h ARG 422 N 0.33 0.00 -0.08 3.56 0.11 -1.44 0.27 114.38 117.13 1r58 h ARG 422 Ca 0.10 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.18 1r58 h ARG 422 Cb -0.02 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.06 1r58 h ARG 422 CO -0.04 0.00 0.00 1.28 0.10 0.00 0.00 179.97 181.31 1r58 n LEU 423 N -3.10 1.12 0.00 0.08 4.77 -0.83 -4.90 117.00 114.14 1r58 n LEU 423 Ca -0.02 -0.44 0.00 0.00 -0.03 0.00 0.00 56.01 55.52 1r58 n LEU 423 Cb 0.15 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.20 1r58 n LEU 423 CO 0.23 0.22 0.00 0.61 -1.33 0.00 0.00 177.39 177.12 1r58 n GLY 424 N 1.06 0.74 3.76 -0.72 0.00 0.08 -5.05 105.19 105.05 1r58 n GLY 424 Ca 0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.80 1r58 n GLY 424 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1r58 s GLU 425 N -0.44 4.80 -0.00 1.61 0.41 -0.96 -5.02 118.70 119.09 1r58 s GLU 425 Ca 0.00 1.46 -0.06 0.00 -0.41 0.00 0.00 54.97 55.96 1r58 s GLU 425 Cb 0.00 -3.17 0.00 0.00 -1.78 0.00 0.00 34.13 29.18 1r58 s GLU 425 CO 0.00 0.46 0.12 -1.54 -0.49 0.00 0.00 175.26 173.81 1r58 s SER 426 N -1.27 0.02 -1.23 -0.19 1.04 -1.26 -4.33 113.70 106.48 1r58 s SER 426 Ca 0.43 -0.17 -0.04 0.00 0.48 0.00 0.00 55.95 56.65 1r58 s SER 426 Cb -0.25 0.21 -0.01 0.00 0.10 0.00 0.00 66.02 66.07 1r58 s SER 426 CO 0.30 -0.32 0.78 0.29 0.98 0.00 0.00 173.24 175.27 1r58 n LYS 427 N 1.67 -4.20 0.00 4.02 4.76 -1.26 -4.90 118.16 118.24 1r58 n LYS 427 Ca -0.22 0.66 0.05 0.00 -2.87 0.00 0.00 58.31 55.93 1r58 n LYS 427 Cb 0.56 -5.21 0.00 0.00 -1.84 0.00 0.00 35.03 28.55 1r58 n LYS 427 CO 0.00 0.00 0.00 2.48 -1.37 0.00 0.00 177.40 178.51 1r58 n TYR 428 N -4.09 0.00 -0.18 2.13 0.18 -1.26 -4.73 117.16 109.21 1r58 n TYR 428 Ca -0.24 0.00 -0.01 0.00 1.88 0.00 0.00 57.90 59.54 1r58 n TYR 428 Cb 0.66 0.00 0.09 0.00 -0.38 0.00 0.00 39.34 39.70 1r58 n TYR 428 CO 0.00 0.00 0.00 -0.07 -2.08 0.00 0.00 176.86 174.71 1r58 h LEU 429 N 1.14 -0.01 -0.50 -3.48 4.07 -1.99 0.30 115.31 114.85 1r58 h LEU 429 Ca 0.00 0.10 -0.10 0.00 0.08 0.00 0.00 57.88 57.96 1r58 h LEU 429 Cb 0.33 0.14 -0.02 0.00 1.08 0.00 0.00 40.66 42.19 1r58 h LEU 429 CO 0.00 0.01 -0.07 -0.03 -1.08 0.00 0.00 178.44 177.27 1r58 h MET 430 N 0.24 0.93 -0.75 1.13 4.05 -1.99 -0.26 114.93 118.29 1r58 h MET 430 Ca 0.28 -0.34 -0.02 0.00 -0.28 0.00 0.00 59.70 59.35 1r58 h MET 430 Cb 0.41 -0.06 -0.04 0.00 -0.80 0.00 0.00 31.60 31.11 1r58 h MET 430 CO -0.37 0.99 0.38 0.00 0.23 0.00 0.00 176.91 178.14 1r58 h ALA 431 N 0.91 1.26 -0.49 0.39 0.00 -1.67 0.66 119.26 120.32 1r58 h ALA 431 Ca 0.13 -0.13 -0.12 0.00 0.00 0.00 0.00 54.91 54.79 1r58 h ALA 431 Cb 0.62 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1r58 h ALA 431 CO 0.04 0.58 -0.17 1.25 0.00 0.00 0.00 179.25 180.95 1r58 h LEU 432 N 1.05 0.99 -0.81 0.00 5.85 -0.10 -2.18 115.31 120.12 1r58 h LEU 432 Ca 0.26 -0.35 -0.08 0.00 0.84 0.00 0.00 57.88 58.55 1r58 h LEU 432 Cb 0.08 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 40.81 1r58 h LEU 432 CO -0.04 1.14 0.05 0.50 -0.34 0.00 0.00 178.44 179.75 1r58 h LYS 433 N 0.85 0.95 0.06 1.25 3.64 -0.32 -2.00 116.57 121.01 1r58 h LYS 433 Ca 0.12 -0.26 0.00 0.00 -1.27 0.00 0.00 60.65 59.25 1r58 h LYS 433 Cb 0.74 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.44 1r58 h LYS 433 CO 0.06 0.91 -0.06 -0.91 -2.27 0.00 0.00 179.45 177.18 1r58 h ASN 434 N 0.89 -0.15 -0.87 4.20 2.35 -0.62 0.18 115.58 121.56 1r58 h ASN 434 Ca 0.17 0.01 0.07 0.00 -0.55 0.00 0.00 56.30 56.00 1r58 h ASN 434 Cb 0.45 0.05 -0.06 0.00 0.05 0.00 0.00 38.32 38.81 1r58 h ASN 434 CO 0.02 -0.09 0.57 -0.07 -1.65 0.00 0.00 177.43 176.21 1r58 h LEU 435 N -0.13 0.86 -0.17 1.61 3.38 -1.23 0.27 115.31 119.89 1r58 h LEU 435 Ca 0.00 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 1r58 h LEU 435 Cb 0.12 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1r58 h LEU 435 CO -0.01 0.55 -0.02 0.00 0.09 0.00 0.00 178.44 179.04 1r58 h ASP 437 N 0.05 0.09 0.97 0.00 3.32 0.25 0.27 116.42 121.37 1r58 h ASP 437 Ca 0.05 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.08 1r58 h ASP 437 Cb 0.44 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.97 1r58 h ASP 437 CO 0.01 0.21 0.00 0.18 -1.72 0.00 0.00 179.24 177.93 1r58 n LEU 438 N -4.36 0.05 -0.04 1.55 4.77 0.85 -4.90 117.00 114.92 1r58 n LEU 438 Ca -0.02 0.51 -0.01 0.00 -0.03 0.00 0.00 56.01 56.46 1r58 n LEU 438 Cb 0.21 -0.49 -0.00 0.00 -2.33 0.00 0.00 43.42 40.81 1r58 n LEU 438 CO 0.36 -0.04 -0.01 0.61 -1.33 0.00 0.00 177.39 176.98 1r58 n GLY 439 N 1.30 0.48 0.13 -0.72 0.00 0.08 -4.90 105.19 101.57 1r58 n GLY 439 Ca 0.06 -0.29 -0.21 0.00 0.00 0.00 0.00 46.02 45.58 1r58 n GLY 439 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1r58 h ILE 440 N 0.00 1.36 -4.06 -0.61 2.04 -1.35 -3.43 117.51 111.45 1r58 h ILE 440 Ca -0.01 -2.86 -0.63 0.00 1.00 0.00 0.00 64.86 62.36 1r58 h ILE 440 Cb 0.10 2.98 -0.24 0.00 -0.74 0.00 0.00 36.82 38.93 1r58 h ILE 440 CO 0.02 0.85 -0.85 -0.69 0.00 0.00 0.00 178.15 177.47 1r58 s VAL 441 N -2.62 1.93 -0.08 1.67 1.01 -0.93 -1.12 120.40 120.27 1r58 s VAL 441 Ca -0.07 -1.48 0.03 0.00 0.00 0.00 0.00 61.98 60.47 1r58 s VAL 441 Cb 0.05 -1.70 -0.02 0.00 0.00 0.00 0.00 36.38 34.72 1r58 s VAL 441 CO 0.91 0.14 -0.18 -1.81 0.00 0.00 0.00 175.10 174.16 1r58 s ASP 442 N -1.62 3.69 0.18 3.32 1.01 -0.27 -3.89 116.67 119.10 1r58 s ASP 442 Ca 0.10 -0.34 -0.18 0.00 0.71 0.00 0.00 52.55 52.83 1r58 s ASP 442 Cb -0.10 -1.07 -0.08 0.00 1.01 0.00 0.00 42.92 42.68 1r58 s ASP 442 CO 0.04 0.26 0.66 -2.16 0.21 0.00 0.00 175.17 174.17 1r58 s PRO 443 N -0.21 4.18 -0.56 8.23 0.04 -1.26 -1.89 135.00 143.52 1r58 s PRO 443 Ca -0.00 0.76 0.05 0.00 0.04 0.00 0.00 61.00 61.84 1r58 s PRO 443 Cb -0.13 -2.95 0.18 0.00 0.04 0.00 0.00 34.50 31.64 1r58 s PRO 443 CO 0.03 0.45 0.45 0.66 0.04 0.00 0.00 177.00 178.63 1r58 n TYR 444 N 0.88 1.33 -0.89 0.56 4.01 -0.36 -4.98 117.16 117.70 1r58 n TYR 444 Ca -0.04 -3.84 -0.30 0.00 -0.16 0.00 0.00 57.90 53.56 1r58 n TYR 444 Cb 0.51 -0.23 0.17 0.00 -0.31 0.00 0.00 39.34 39.48 1r58 n TYR 444 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 1r58 s PRO 445 N -0.86 0.76 0.48 -0.72 0.04 -1.26 -4.04 135.00 129.38 1r58 s PRO 445 Ca 0.30 1.10 -0.24 0.00 0.04 0.00 0.00 61.00 62.19 1r58 s PRO 445 Cb 0.01 -1.73 -0.07 0.00 0.04 0.00 0.00 34.50 32.75 1r58 s PRO 445 CO -0.17 -2.66 1.36 -2.30 0.04 0.00 0.00 177.00 173.27 1r58 n PRO 446 N -4.21 1.98 -3.83 0.56 -0.02 -1.24 -4.78 135.00 123.45 1r58 n PRO 446 Ca 0.08 0.71 -0.36 0.00 -2.02 0.00 0.00 63.50 61.91 1r58 n PRO 446 Cb 0.54 -2.55 -0.13 0.00 -0.02 0.00 0.00 33.50 31.34 1r58 n PRO 446 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1r58 s LEU 447 N -2.68 3.47 0.08 2.45 1.43 -0.03 -1.53 118.68 121.87 1r58 s LEU 447 Ca 0.65 -0.62 0.06 0.00 -1.03 0.00 0.00 54.13 53.19 1r58 s LEU 447 Cb -0.45 -1.81 -0.03 0.00 0.03 0.00 0.00 46.19 43.93 1r58 s LEU 447 CO 0.55 -0.13 -0.16 0.00 0.23 0.00 0.00 176.35 176.84 1r58 n ASP 449 N 1.26 0.43 -4.58 0.00 -0.08 0.57 -1.47 116.55 112.68 1r58 n ASP 449 Ca -0.20 -1.38 -0.38 0.00 -1.51 0.00 0.00 54.79 51.32 1r58 n ASP 449 Cb 0.54 -0.24 0.05 0.00 2.34 0.00 0.00 41.12 43.81 1r58 n ASP 449 CO 0.00 0.00 0.00 -0.38 0.12 0.00 0.00 177.20 176.94 1r58 n ILE 450 N -1.98 3.39 -1.74 5.18 -0.00 -1.26 -4.78 119.36 118.17 1r58 n ILE 450 Ca 0.06 -0.50 -0.42 0.00 -0.00 0.00 0.00 62.75 61.89 1r58 n ILE 450 Cb 0.21 -1.04 -0.02 0.00 -0.00 0.00 0.00 39.64 38.79 1r58 n ILE 450 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 176.55 177.72 1r58 n LYS 451 N -0.80 2.66 0.00 0.38 4.81 -1.26 -1.78 118.16 122.16 1r58 n LYS 451 Ca 0.13 0.95 0.00 0.00 -0.87 0.00 0.00 58.31 58.52 1r58 n LYS 451 Cb 0.47 -2.73 0.00 0.00 0.02 0.00 0.00 35.03 32.80 1r58 n LYS 451 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1r58 n GLY 452 N 2.35 1.80 3.89 3.14 0.00 -1.26 -5.05 105.19 110.06 1r58 n GLY 452 Ca 0.10 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.83 1r58 n GLY 452 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1r58 s SER 453 N -2.36 5.74 -0.05 1.61 1.04 -0.74 -4.98 113.70 113.97 1r58 s SER 453 Ca 0.00 1.03 0.05 0.00 0.48 0.00 0.00 55.95 57.51 1r58 s SER 453 Cb 0.00 -2.00 -0.01 0.00 0.10 0.00 0.00 66.02 64.11 1r58 s SER 453 CO 0.00 -1.07 -0.22 -0.31 0.98 0.00 0.00 173.24 172.63 1r58 s TYR 454 N -3.13 2.14 0.06 5.02 1.51 -1.26 -2.35 117.35 119.33 1r58 s TYR 454 Ca 0.55 -0.64 0.06 0.00 -1.01 0.00 0.00 57.07 56.03 1r58 s TYR 454 Cb -0.11 -1.42 -0.03 0.00 -0.11 0.00 0.00 41.96 40.30 1r58 s TYR 454 CO 0.49 -0.21 -0.18 0.95 -1.11 0.00 0.00 175.55 175.50 1r58 s THR 455 N -0.05 1.41 0.10 -0.71 -4.23 -0.77 -1.56 115.64 109.84 1r58 s THR 455 Ca -0.05 -1.22 0.03 0.00 -1.18 0.00 0.00 61.69 59.28 1r58 s THR 455 Cb -0.13 -1.27 -0.04 0.00 1.34 0.00 0.00 72.50 72.40 1r58 s THR 455 CO 0.03 0.02 -0.10 0.00 -0.54 0.00 0.00 174.62 174.04 1r58 s ALA 456 N -0.96 1.12 -0.00 3.99 0.00 -0.42 -4.78 121.76 120.71 1r58 s ALA 456 Ca 0.04 -1.23 -0.10 0.00 0.00 0.00 0.00 51.96 50.66 1r58 s ALA 456 Cb -0.09 0.05 0.01 0.00 0.00 0.00 0.00 23.12 23.09 1r58 s ALA 456 CO 0.02 -0.07 0.21 -1.14 0.00 0.00 0.00 175.76 174.78 1r58 s GLN 457 N -3.01 0.55 -0.11 0.00 0.74 -1.26 -1.45 119.66 115.12 1r58 s GLN 457 Ca 0.07 -0.31 -0.08 0.00 0.05 0.00 0.00 55.36 55.09 1r58 s GLN 457 Cb -0.01 0.24 0.04 0.00 1.10 0.00 0.00 33.01 34.37 1r58 s GLN 457 CO -0.01 -0.14 0.28 -0.06 -0.55 0.00 0.00 175.29 174.82 1r58 s PHE 458 N -1.34 -0.36 -0.07 1.67 0.08 -1.16 -3.23 117.98 113.57 1r58 s PHE 458 Ca -0.14 0.84 -0.09 0.00 0.12 0.00 0.00 56.93 57.67 1r58 s PHE 458 Cb -0.07 0.10 0.02 0.00 -0.57 0.00 0.00 43.02 42.51 1r58 s PHE 458 CO 0.03 -0.21 0.23 -2.00 -0.10 0.00 0.00 175.22 173.16 1r58 s GLU 459 N 0.82 0.33 0.03 0.44 2.12 -0.42 -2.41 118.70 119.61 1r58 s GLU 459 Ca -0.05 0.19 -0.00 0.00 0.36 0.00 0.00 54.97 55.46 1r58 s GLU 459 Cb -0.07 0.15 -0.03 0.00 0.26 0.00 0.00 34.13 34.45 1r58 s GLU 459 CO -0.05 -0.06 -0.03 -1.01 -0.54 0.00 0.00 175.26 173.57 1r58 s HIS 460 N -0.19 0.39 -0.14 5.30 3.76 -0.72 -1.91 115.29 121.77 1r58 s HIS 460 Ca -0.03 -0.77 -0.05 0.00 -0.15 0.00 0.00 55.06 54.06 1r58 s HIS 460 Cb -0.03 -0.29 -0.04 0.00 1.11 0.00 0.00 32.58 33.34 1r58 s HIS 460 CO 0.01 -0.27 0.04 0.99 -0.85 0.00 0.00 174.74 174.66 1r58 s THR 461 N -2.55 4.62 0.09 1.30 2.01 -1.23 -0.42 115.64 119.46 1r58 s THR 461 Ca -0.05 -0.11 0.08 0.00 0.31 0.00 0.00 61.69 61.91 1r58 s THR 461 Cb -0.02 -3.02 -0.03 0.00 0.01 0.00 0.00 72.50 69.43 1r58 s THR 461 CO -0.05 0.53 -0.20 0.27 -0.69 0.00 0.00 174.62 174.48 1r58 s ILE 462 N -0.19 1.62 -0.20 1.82 -4.36 1.00 -2.90 121.20 117.99 1r58 s ILE 462 Ca 0.07 -1.46 -0.03 0.00 -0.26 0.00 0.00 60.65 58.97 1r58 s ILE 462 Cb -0.12 -1.47 -0.01 0.00 1.25 0.00 0.00 42.46 42.11 1r58 s ILE 462 CO 0.02 -0.05 -0.06 -0.76 0.24 0.00 0.00 174.94 174.33 1r58 s LEU 463 N -1.78 2.90 -1.26 0.37 1.43 0.20 -1.13 118.68 119.42 1r58 s LEU 463 Ca 0.05 -0.35 -0.10 0.00 -1.03 0.00 0.00 54.13 52.71 1r58 s LEU 463 Cb -0.10 -1.72 0.18 0.00 0.03 0.00 0.00 46.19 44.58 1r58 s LEU 463 CO 0.04 0.04 1.77 0.18 0.23 0.00 0.00 176.35 178.60 1r58 n LEU 464 N 4.40 6.39 -4.75 1.79 4.77 0.10 -1.35 117.00 128.34 1r58 n LEU 464 Ca -0.18 -4.65 -0.31 0.00 -0.03 0.00 0.00 56.01 50.84 1r58 n LEU 464 Cb 0.51 -1.49 0.11 0.00 -2.33 0.00 0.00 43.42 40.22 1r58 n LEU 464 CO 0.30 1.29 0.69 -0.13 -1.33 0.00 0.00 177.39 178.20 1r58 s ARG 465 N 0.37 1.98 0.19 3.23 0.52 -0.45 0.23 118.95 125.03 1r58 s ARG 465 Ca 0.39 1.10 -0.12 0.00 -0.52 0.00 0.00 55.73 56.59 1r58 s ARG 465 Cb 0.07 -1.87 0.12 0.00 0.52 0.00 0.00 34.95 33.79 1r58 s ARG 465 CO 0.01 -1.82 1.86 -1.35 0.02 0.00 0.00 175.30 174.02 1r58 h PRO 466 N -1.26 0.87 0.00 3.54 0.11 -1.93 -3.14 132.00 130.19 1r58 h PRO 466 Ca -0.45 -0.06 -0.04 0.00 0.11 0.00 0.00 66.00 65.56 1r58 h PRO 466 Cb 1.24 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 32.15 1r58 h PRO 466 CO 0.52 0.58 -0.90 1.79 -0.21 0.00 0.00 178.00 179.78 1r58 h THR 467 N 0.89 0.17 -2.35 -1.15 1.35 -1.80 -3.43 112.91 106.58 1r58 h THR 467 Ca 0.24 -1.30 0.09 0.00 -0.55 0.00 0.00 66.41 64.89 1r58 h THR 467 Cb -0.09 1.76 -0.01 0.00 -1.73 0.00 0.00 68.15 68.07 1r58 h THR 467 CO -0.05 0.10 0.37 0.00 -0.25 0.00 0.00 175.52 175.69 1r58 s LYS 469 N -2.04 3.50 -0.23 0.00 2.20 -0.05 -1.33 119.74 121.79 1r58 s LYS 469 Ca 0.15 -0.58 -0.02 0.00 -0.36 0.00 0.00 55.97 55.16 1r58 s LYS 469 Cb -0.02 -3.00 0.01 0.00 -1.51 0.00 0.00 37.83 33.31 1r58 s LYS 469 CO 0.05 -0.04 -0.08 -2.00 -0.36 0.00 0.00 175.35 172.92 1r58 s GLU 470 N 1.09 3.08 -1.31 4.03 2.12 -0.46 0.44 118.70 127.69 1r58 s GLU 470 Ca 0.02 -0.81 -0.13 0.00 0.36 0.00 0.00 54.97 54.40 1r58 s GLU 470 Cb -0.15 -2.93 0.12 0.00 0.26 0.00 0.00 34.13 31.44 1r58 s GLU 470 CO 0.00 -0.29 1.84 0.28 -0.54 0.00 0.00 175.26 176.55 1r58 n VAL 471 N 4.71 4.03 -0.21 3.70 0.31 0.72 -0.63 118.33 130.95 1r58 n VAL 471 Ca -0.18 -4.07 0.24 0.00 -0.01 0.00 0.00 64.34 60.32 1r58 n VAL 471 Cb 0.49 -2.44 0.62 0.00 -0.91 0.00 0.00 33.84 31.60 1r58 n VAL 471 CO 0.00 0.00 0.00 1.62 -1.32 0.00 0.00 176.83 177.13 1r58 h VAL 472 N 4.37 0.60 -0.27 2.52 3.04 -1.78 -0.85 116.25 123.88 1r58 h VAL 472 Ca 0.43 -0.07 0.00 0.00 -1.01 0.00 0.00 66.70 66.06 1r58 h VAL 472 Cb 0.73 0.39 0.00 0.00 -2.01 0.00 0.00 31.29 30.41 1r58 h VAL 472 CO 1.57 0.03 0.00 -1.54 -1.01 0.00 0.00 177.57 176.63 1r58 n SER 473 N -4.39 2.16 -4.77 3.17 3.41 -1.23 -4.31 113.62 107.66 1r58 n SER 473 Ca 0.19 -1.83 -0.40 0.00 -0.26 0.00 0.00 58.87 56.57 1r58 n SER 473 Cb 0.85 -0.18 0.01 0.00 -0.26 0.00 0.00 64.21 64.64 1r58 n SER 473 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 1r58 s ARG 474 N -1.65 3.71 0.18 4.33 6.06 -0.34 -4.92 118.95 126.33 1r58 s ARG 474 Ca 0.33 2.34 0.03 0.00 -2.50 0.00 0.00 55.73 55.92 1r58 s ARG 474 Cb 0.18 -2.64 -0.01 0.00 0.06 0.00 0.00 34.95 32.53 1r58 s ARG 474 CO 0.26 -0.77 0.11 0.41 -2.50 0.00 0.00 175.30 172.81 1r58 n GLY 475 N 0.61 3.55 0.12 8.12 0.00 -1.26 -4.78 105.19 111.55 1r58 n GLY 475 Ca 0.05 -1.88 0.13 0.00 0.00 0.00 0.00 46.02 44.32 1r58 n GLY 475 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1r58 h ASP 476 N 0.94 0.00 0.04 1.61 3.45 -1.99 -3.31 116.42 117.16 1r58 h ASP 476 Ca -0.14 0.00 -0.16 0.00 0.43 0.00 0.00 57.03 57.16 1r58 h ASP 476 Cb 0.61 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 39.36 1r58 h ASP 476 CO 0.21 0.00 -0.85 -2.24 -1.57 0.00 0.00 179.24 174.79 1r58 h ASP 477 N 0.00 0.13 0.00 6.45 3.04 -1.99 -3.56 116.42 120.49 1r58 h ASP 477 Ca 0.00 -0.79 0.00 0.00 -3.24 0.00 0.00 57.03 53.00 1r58 h ASP 477 Cb 0.74 -0.04 0.00 0.00 -1.04 0.00 0.00 39.33 38.99 1r58 h ASP 477 CO 0.00 1.35 0.00 0.00 -2.04 0.00 0.00 179.24 178.55