#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bjx s ALA 120 N 0.00 4.43 0.41 0.00 0.00 -1.26 -4.78 121.76 120.55 1bjx s ALA 120 Ca 0.00 -1.68 0.05 0.00 0.00 0.00 0.00 51.96 50.33 1bjx s ALA 120 Cb 0.00 -1.04 0.00 0.00 0.00 0.00 0.00 23.12 22.08 1bjx s ALA 120 CO 0.00 -0.50 0.57 -0.08 0.00 0.00 0.00 175.76 175.75 1bjx s THR 121 N -2.65 3.61 -0.35 0.00 -1.32 0.29 -4.89 115.64 110.32 1bjx s THR 121 Ca 0.46 -0.86 -0.01 0.00 -1.21 0.00 0.00 61.69 60.07 1bjx s THR 121 Cb -0.04 -3.27 0.08 0.00 -1.51 0.00 0.00 72.50 67.77 1bjx s THR 121 CO 0.28 -0.13 0.10 -0.89 -2.21 0.00 0.00 174.62 171.77 1bjx s THR 122 N -2.36 2.98 -0.06 5.08 2.01 -1.26 -0.28 115.64 121.74 1bjx s THR 122 Ca 0.50 -1.85 -0.30 0.00 0.31 0.00 0.00 61.69 60.35 1bjx s THR 122 Cb -0.10 -2.94 -0.02 0.00 0.01 0.00 0.00 72.50 69.45 1bjx s THR 122 CO 0.34 -0.44 1.09 -0.76 -0.69 0.00 0.00 174.62 174.15 1bjx s LEU 123 N 1.14 4.28 0.11 4.42 1.43 -1.14 -4.93 118.68 123.99 1bjx s LEU 123 Ca 0.03 1.69 -0.13 0.00 -1.03 0.00 0.00 54.13 54.70 1bjx s LEU 123 Cb -0.21 -3.56 -0.12 0.00 0.03 0.00 0.00 46.19 42.33 1bjx s LEU 123 CO -0.04 -0.48 1.35 1.55 0.23 0.00 0.00 176.35 178.97 1bjx h PRO 124 N 7.18 0.83 0.00 1.29 0.13 -1.98 -3.43 132.00 136.02 1bjx h PRO 124 Ca -0.34 -0.59 -0.01 0.00 -0.87 0.00 0.00 66.00 64.19 1bjx h PRO 124 Cb 1.17 0.10 -0.00 0.00 0.13 0.00 0.00 31.00 32.39 1bjx h PRO 124 CO 0.85 1.21 0.00 -0.40 -0.23 0.00 0.00 178.00 179.44 1bjx n ASP 125 N -4.00 -0.11 0.25 1.44 5.68 -1.26 -4.72 116.55 113.83 1bjx n ASP 125 Ca -0.06 -1.11 0.07 0.00 -0.50 0.00 0.00 54.79 53.20 1bjx n ASP 125 Cb 0.68 0.19 0.61 0.00 -1.14 0.00 0.00 41.12 41.45 1bjx n ASP 125 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 1bjx h GLY 126 N 0.12 0.00 0.42 6.12 0.00 -1.93 -1.90 103.07 105.90 1bjx h GLY 126 Ca -0.02 0.00 0.23 0.00 0.00 0.00 0.00 47.33 47.54 1bjx h GLY 126 CO 0.02 0.00 0.57 0.00 0.00 0.00 0.00 176.54 177.13 1bjx h ALA 127 N 1.95 2.71 0.12 3.60 0.00 -1.98 -1.19 119.26 124.46 1bjx h ALA 127 Ca -0.00 -0.02 -0.35 0.00 0.00 0.00 0.00 54.91 54.53 1bjx h ALA 127 Cb 0.09 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 1bjx h ALA 127 CO 0.01 -0.93 -1.94 0.00 0.00 0.00 0.00 179.25 176.39 1bjx h ALA 128 N 1.61 0.45 -0.29 0.00 0.00 -1.75 -3.23 119.26 116.06 1bjx h ALA 128 Ca 0.38 -1.38 0.08 0.00 0.00 0.00 0.00 54.91 53.99 1bjx h ALA 128 Cb 1.47 0.66 -0.01 0.00 0.00 0.00 0.00 17.79 19.91 1bjx h ALA 128 CO -0.02 1.32 0.34 0.00 0.00 0.00 0.00 179.25 180.89 1bjx h ALA 129 N 0.20 1.92 0.00 0.00 0.00 -1.13 0.18 119.26 120.43 1bjx h ALA 129 Ca -0.40 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.42 1bjx h ALA 129 Cb 2.04 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.84 1bjx h ALA 129 CO 0.10 -0.48 -0.62 0.93 0.00 0.00 0.00 179.25 179.18 1bjx h GLU 130 N 0.00 0.00 0.00 0.00 5.08 -1.55 -3.29 114.58 114.82 1bjx h GLU 130 Ca 0.14 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 1bjx h GLU 130 Cb 0.81 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.06 1bjx h GLU 130 CO -0.00 0.55 0.04 0.77 -1.00 0.00 0.00 179.01 179.37 1bjx h SER 131 N -1.00 0.00 0.32 1.42 0.02 -1.47 -2.68 113.55 110.16 1bjx h SER 131 Ca -0.13 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.80 1bjx h SER 131 Cb 0.81 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.36 1bjx h SER 131 CO -0.08 0.00 -0.15 0.25 -1.14 0.00 0.00 176.83 175.71 1bjx h LEU 132 N 0.00 -0.37 -1.28 5.07 6.46 -1.09 -1.94 115.31 122.16 1bjx h LEU 132 Ca 0.00 -0.03 0.17 0.00 -0.12 0.00 0.00 57.88 57.90 1bjx h LEU 132 Cb 0.09 0.09 -0.08 0.00 -0.73 0.00 0.00 40.66 40.03 1bjx h LEU 132 CO 0.00 0.09 0.59 0.58 -0.62 0.00 0.00 178.44 179.08 1bjx h VAL 133 N -1.09 0.77 0.00 1.05 2.07 -1.55 0.22 116.25 117.72 1bjx h VAL 133 Ca -0.04 -0.22 -0.08 0.00 0.82 0.00 0.00 66.70 67.18 1bjx h VAL 133 Cb 0.37 0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.21 1bjx h VAL 133 CO 0.07 0.12 -0.37 -0.33 0.02 0.00 0.00 177.57 177.08 1bjx h GLU 134 N 0.64 0.00 -0.39 1.57 5.08 -1.53 -3.22 114.58 116.72 1bjx h GLU 134 Ca 0.48 0.00 0.07 0.00 -1.00 0.00 0.00 59.36 58.91 1bjx h GLU 134 Cb 0.86 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.05 1bjx h GLU 134 CO -0.23 0.37 0.01 1.03 -1.00 0.00 0.00 179.01 179.18 1bjx h SER 135 N 0.00 -0.15 -4.71 1.42 0.87 0.28 -3.44 113.55 107.82 1bjx h SER 135 Ca -0.00 0.09 -0.41 0.00 -1.23 0.00 0.00 61.79 60.24 1bjx h SER 135 Cb 0.94 0.16 -0.14 0.00 -0.44 0.00 0.00 62.40 62.92 1bjx h SER 135 CO 0.05 -0.04 -0.56 -0.94 -0.53 0.00 0.00 176.83 174.81 1bjx s SER 136 N -5.26 1.48 0.17 6.23 1.04 -1.22 -5.05 113.70 111.09 1bjx s SER 136 Ca -0.13 -1.53 -0.11 0.00 0.48 0.00 0.00 55.95 54.65 1bjx s SER 136 Cb 0.14 0.36 0.05 0.00 0.10 0.00 0.00 66.02 66.66 1bjx s SER 136 CO 0.71 -0.87 1.63 -0.08 0.98 0.00 0.00 173.24 175.61 1bjx h GLU 137 N 2.24 0.97 -6.52 4.02 4.57 -1.87 -3.44 114.58 114.54 1bjx h GLU 137 Ca -0.34 -0.29 -0.65 0.00 -1.18 0.00 0.00 59.36 56.89 1bjx h GLU 137 Cb 1.25 -0.09 -0.15 0.00 -0.16 0.00 0.00 28.75 29.59 1bjx h GLU 137 CO 0.53 0.96 -0.73 0.08 -1.18 0.00 0.00 179.01 178.67 1bjx s VAL 138 N -5.07 3.37 -0.29 0.32 1.01 -1.26 -2.76 120.40 115.71 1bjx s VAL 138 Ca -0.12 -1.34 -0.23 0.00 0.00 0.00 0.00 61.98 60.28 1bjx s VAL 138 Cb 0.13 -2.60 0.17 0.00 0.00 0.00 0.00 36.38 34.07 1bjx s VAL 138 CO 0.84 0.06 1.25 0.00 0.00 0.00 0.00 175.10 177.24 1bjx s ALA 139 N -1.33 -2.21 0.07 5.51 0.00 -0.71 -4.41 121.76 118.69 1bjx s ALA 139 Ca 0.22 1.83 0.08 0.00 0.00 0.00 0.00 51.96 54.10 1bjx s ALA 139 Cb -0.11 -1.70 -0.03 0.00 0.00 0.00 0.00 23.12 21.29 1bjx s ALA 139 CO 0.14 -0.19 -0.23 0.54 0.00 0.00 0.00 175.76 176.03 1bjx s VAL 140 N 0.34 1.84 -0.12 0.00 0.11 -1.25 0.68 120.40 122.01 1bjx s VAL 140 Ca 0.03 -1.41 -0.02 0.00 -2.93 0.00 0.00 61.98 57.64 1bjx s VAL 140 Cb -0.05 -1.62 0.04 0.00 -1.53 0.00 0.00 36.38 33.23 1bjx s VAL 140 CO -0.12 0.13 0.02 -0.63 -3.33 0.00 0.00 175.10 171.18 1bjx s ILE 141 N -0.95 0.36 0.10 7.04 1.01 -1.13 -0.97 121.20 126.66 1bjx s ILE 141 Ca 0.09 -0.12 -0.30 0.00 0.00 0.00 0.00 60.65 60.32 1bjx s ILE 141 Cb -0.10 -0.69 -0.06 0.00 0.01 0.00 0.00 42.46 41.63 1bjx s ILE 141 CO 0.03 0.05 0.97 -0.83 0.00 0.00 0.00 174.94 175.16 1bjx s GLY 142 N 1.96 2.99 -1.01 6.18 0.00 -0.09 -3.79 107.32 113.56 1bjx s GLY 142 Ca 0.03 0.58 -0.03 0.00 0.00 0.00 0.00 44.72 45.30 1bjx s GLY 142 CO -0.06 1.49 1.32 0.69 0.00 0.00 0.00 173.10 176.53 1bjx n PHE 143 N 2.87 2.77 -3.39 1.90 3.01 -0.15 -2.76 117.46 121.72 1bjx n PHE 143 Ca 0.03 -2.98 -0.38 0.00 1.01 0.00 0.00 57.45 55.12 1bjx n PHE 143 Cb 0.49 -1.18 -0.06 0.00 -0.01 0.00 0.00 39.48 38.72 1bjx n PHE 143 CO 0.00 0.00 0.00 -0.06 1.01 0.00 0.00 176.76 177.71 1bjx s PHE 144 N -2.58 3.70 -0.07 1.38 0.08 -1.15 -2.55 117.98 116.78 1bjx s PHE 144 Ca 0.32 1.05 0.09 0.00 0.12 0.00 0.00 56.93 58.52 1bjx s PHE 144 Cb 0.05 -2.42 -0.24 0.00 -0.57 0.00 0.00 43.02 39.84 1bjx s PHE 144 CO 0.07 0.51 0.55 0.36 -0.10 0.00 0.00 175.22 176.60 1bjx n LYS 145 N 2.26 0.66 -0.00 0.44 2.85 -1.26 -3.47 118.16 119.64 1bjx n LYS 145 Ca -0.11 0.26 -0.22 0.00 -1.05 0.00 0.00 58.31 57.20 1bjx n LYS 145 Cb 0.52 -1.75 -0.14 0.00 -0.65 0.00 0.00 35.03 33.01 1bjx n LYS 145 CO 0.00 0.00 0.00 0.22 -0.05 0.00 0.00 177.40 177.57 1bjx h ASP 146 N 0.01 0.38 0.00 -5.58 1.82 -1.95 -3.47 116.42 107.63 1bjx h ASP 146 Ca -0.34 -0.89 0.00 0.00 -0.39 0.00 0.00 57.03 55.41 1bjx h ASP 146 Cb 2.04 -0.13 0.00 0.00 0.68 0.00 0.00 39.33 41.92 1bjx h ASP 146 CO 0.07 1.80 0.00 0.52 -1.61 0.00 0.00 179.24 180.02 1bjx n VAL 147 N -3.64 0.00 0.81 2.25 0.31 -1.26 -4.30 118.33 112.49 1bjx n VAL 147 Ca -0.31 0.00 0.07 0.00 -0.01 0.00 0.00 64.34 64.09 1bjx n VAL 147 Cb 1.00 0.00 0.21 0.00 -0.91 0.00 0.00 33.84 34.14 1bjx n VAL 147 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1bjx n GLU 148 N 0.00 1.90 0.00 5.55 -0.58 -1.26 -4.48 120.64 121.78 1bjx n GLU 148 Ca 0.00 -1.40 0.00 0.00 -0.42 0.00 0.00 57.16 55.34 1bjx n GLU 148 Cb 0.00 -1.33 0.00 0.00 -0.57 0.00 0.00 31.44 29.54 1bjx n GLU 148 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 1bjx n SER 149 N 0.63 -0.45 -0.02 1.62 3.41 -1.26 -4.89 113.62 112.66 1bjx n SER 149 Ca 0.14 -0.24 -0.10 0.00 -0.26 0.00 0.00 58.87 58.41 1bjx n SER 149 Cb 0.34 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 64.15 1bjx n SER 149 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1bjx n ASP 150 N -1.40 1.00 0.23 4.04 2.03 -1.26 -3.50 116.55 117.68 1bjx n ASP 150 Ca 0.00 0.38 0.09 0.00 0.52 0.00 0.00 54.79 55.78 1bjx n ASP 150 Cb 0.00 -0.14 0.52 0.00 -0.72 0.00 0.00 41.12 40.78 1bjx n ASP 150 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 1bjx h SER 151 N 0.01 0.00 0.58 1.67 4.64 -1.93 -2.92 113.55 115.60 1bjx h SER 151 Ca -0.31 0.00 -0.28 0.00 -0.47 0.00 0.00 61.79 60.73 1bjx h SER 151 Cb 2.02 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 64.10 1bjx h SER 151 CO 0.08 0.24 -1.41 0.00 -0.87 0.00 0.00 176.83 174.87 1bjx h ALA 152 N 1.76 0.31 -0.69 5.18 0.00 -1.81 -3.29 119.26 120.72 1bjx h ALA 152 Ca -0.00 -1.07 0.11 0.00 0.00 0.00 0.00 54.91 53.95 1bjx h ALA 152 Cb 0.61 0.18 -0.08 0.00 0.00 0.00 0.00 17.79 18.49 1bjx h ALA 152 CO 0.03 1.18 0.29 0.87 0.00 0.00 0.00 179.25 181.61 1bjx h LYS 153 N 0.05 0.46 -0.39 0.00 1.79 -1.55 -0.87 116.57 116.06 1bjx h LYS 153 Ca -0.19 -0.03 -0.10 0.00 -2.18 0.00 0.00 60.65 58.16 1bjx h LYS 153 Cb 1.96 -0.10 -0.02 0.00 -1.58 0.00 0.00 32.23 32.49 1bjx h LYS 153 CO 0.15 0.30 -0.16 1.96 -1.08 0.00 0.00 179.45 180.63 1bjx h GLN 154 N 0.47 0.72 0.06 3.15 1.08 -1.67 -3.14 115.11 115.79 1bjx h GLN 154 Ca 0.36 -0.26 0.02 0.00 -1.45 0.00 0.00 58.65 57.32 1bjx h GLN 154 Cb 0.46 -0.05 -0.05 0.00 -0.05 0.00 0.00 27.48 27.79 1bjx h GLN 154 CO -0.33 0.84 -0.46 0.35 -0.95 0.00 0.00 178.83 178.29 1bjx h PHE 155 N 0.65 -1.30 -0.25 2.96 3.57 -1.22 -1.75 116.94 119.60 1bjx h PHE 155 Ca 0.10 0.04 0.06 0.00 3.53 0.00 0.00 57.97 61.70 1bjx h PHE 155 Cb 0.63 0.56 -0.07 0.00 2.79 0.00 0.00 35.95 39.86 1bjx h PHE 155 CO 0.03 -0.54 -0.30 -0.07 -2.23 0.00 0.00 178.31 175.21 1bjx h LEU 156 N -0.65 -0.95 -2.00 0.59 3.38 -1.50 0.19 115.31 114.37 1bjx h LEU 156 Ca 0.02 0.16 0.26 0.00 0.09 0.00 0.00 57.88 58.41 1bjx h LEU 156 Cb 0.70 0.43 -0.04 0.00 0.09 0.00 0.00 40.66 41.84 1bjx h LEU 156 CO -0.29 -0.32 0.66 1.56 0.09 0.00 0.00 178.44 180.13 1bjx h GLN 157 N -0.31 0.00 0.14 1.13 4.20 -1.41 0.02 115.11 118.89 1bjx h GLN 157 Ca 0.13 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.83 1bjx h GLN 157 Cb 0.52 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.30 1bjx h GLN 157 CO -0.42 0.00 -0.07 0.00 -0.67 0.00 0.00 178.83 177.67 1bjx h ALA 158 N 1.54 -0.19 -0.69 3.87 0.00 0.22 -3.04 119.26 120.96 1bjx h ALA 158 Ca 0.43 -0.18 0.14 0.00 0.00 0.00 0.00 54.91 55.30 1bjx h ALA 158 Cb 1.74 0.07 -0.04 0.00 0.00 0.00 0.00 17.79 19.56 1bjx h ALA 158 CO -0.00 -0.22 0.47 0.00 0.00 0.00 0.00 179.25 179.49 1bjx h ALA 159 N -0.62 2.14 0.00 0.00 0.00 -0.51 0.16 119.26 120.43 1bjx h ALA 159 Ca -0.02 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 1bjx h ALA 159 Cb 0.42 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1bjx h ALA 159 CO 0.03 -0.32 -0.29 0.93 0.00 0.00 0.00 179.25 179.60 1bjx h GLU 160 N 0.36 0.00 -0.51 0.00 5.08 -1.07 -2.89 114.58 115.56 1bjx h GLU 160 Ca 0.33 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.64 1bjx h GLU 160 Cb 0.79 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.02 1bjx h GLU 160 CO -0.09 0.29 0.12 0.00 -1.00 0.00 0.00 179.01 178.32 1bjx h ALA 161 N 1.71 0.67 -2.07 3.43 0.00 -0.55 -3.44 119.26 119.01 1bjx h ALA 161 Ca -0.00 -0.21 -0.46 0.00 0.00 0.00 0.00 54.91 54.23 1bjx h ALA 161 Cb 0.56 -0.19 0.03 0.00 0.00 0.00 0.00 17.79 18.18 1bjx h ALA 161 CO 0.04 0.37 -0.09 -1.50 0.00 0.00 0.00 179.25 178.07 1bjx s ILE 162 N -5.29 4.00 0.00 0.00 2.07 -1.09 -5.02 121.20 115.87 1bjx s ILE 162 Ca -0.13 -0.48 0.00 0.00 -1.41 0.00 0.00 60.65 58.63 1bjx s ILE 162 Cb 0.12 -3.48 0.00 0.00 0.13 0.00 0.00 42.46 39.22 1bjx s ILE 162 CO 0.80 -0.34 0.83 0.47 -1.91 0.00 0.00 174.94 174.79 1bjx n ASP 163 N -2.09 0.00 0.00 4.50 8.00 -1.26 -4.85 116.55 120.85 1bjx n ASP 163 Ca 0.01 -1.68 0.00 0.00 0.71 0.00 0.00 54.79 53.83 1bjx n ASP 163 Cb 0.58 -0.14 0.00 0.00 -0.02 0.00 0.00 41.12 41.54 1bjx n ASP 163 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 1bjx n ASP 164 N 0.00 1.36 -4.16 -2.24 5.75 -1.26 -5.03 116.55 110.97 1bjx n ASP 164 Ca 0.00 -1.64 -0.26 0.00 -0.01 0.00 0.00 54.79 52.88 1bjx n ASP 164 Cb 0.64 0.00 -0.16 0.00 -1.03 0.00 0.00 41.12 40.57 1bjx n ASP 164 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 1bjx s ILE 165 N -0.64 1.48 -1.21 2.12 -1.09 -1.26 -5.03 121.20 115.57 1bjx s ILE 165 Ca 0.00 -0.77 -0.21 0.00 -2.23 0.00 0.00 60.65 57.45 1bjx s ILE 165 Cb 0.00 -1.25 -0.03 0.00 -1.58 0.00 0.00 42.46 39.59 1bjx s ILE 165 CO 0.00 0.42 1.88 -0.81 -1.23 0.00 0.00 174.94 175.20 1bjx n PRO 166 N 2.92 2.19 -2.26 2.79 -0.04 -1.26 -4.94 135.00 134.40 1bjx n PRO 166 Ca -0.17 -2.71 -0.42 0.00 -0.04 0.00 0.00 63.50 60.16 1bjx n PRO 166 Cb 0.53 -3.58 -0.03 0.00 -0.04 0.00 0.00 33.50 30.38 1bjx n PRO 166 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1bjx s PHE 167 N 8.03 2.94 0.19 0.54 0.40 -1.26 -3.86 117.98 124.96 1bjx s PHE 167 Ca 0.62 0.90 0.10 0.00 -0.60 0.00 0.00 56.93 57.94 1bjx s PHE 167 Cb 0.03 -3.62 -0.04 0.00 0.51 0.00 0.00 43.02 39.89 1bjx s PHE 167 CO 0.11 -2.24 -0.19 0.20 0.70 0.00 0.00 175.22 173.79 1bjx s GLY 168 N 1.75 1.54 -0.10 4.36 0.00 -0.14 0.11 107.32 114.83 1bjx s GLY 168 Ca 0.63 -1.60 -0.14 0.00 0.00 0.00 0.00 44.72 43.61 1bjx s GLY 168 CO 0.26 -1.65 0.36 -1.50 0.00 0.00 0.00 173.10 170.56 1bjx s ILE 169 N -2.12 0.02 0.01 0.90 2.07 0.61 -0.91 121.20 121.77 1bjx s ILE 169 Ca 0.20 -0.13 -0.28 0.00 -1.41 0.00 0.00 60.65 59.03 1bjx s ILE 169 Cb -0.06 -0.55 0.09 0.00 0.13 0.00 0.00 42.46 42.08 1bjx s ILE 169 CO 0.09 -0.07 0.81 0.28 -1.91 0.00 0.00 174.94 174.14 1bjx s THR 170 N -0.25 0.00 0.00 4.00 -1.32 -1.11 -2.90 115.64 114.05 1bjx s THR 170 Ca -0.04 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.44 1bjx s THR 170 Cb -0.03 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 69.96 1bjx s THR 170 CO 0.02 0.00 0.60 -1.54 -2.21 0.00 0.00 174.62 171.49 1bjx n SER 171 N -0.02 1.16 -4.68 8.08 3.41 -1.23 -2.92 113.62 117.43 1bjx n SER 171 Ca -0.12 -1.31 -0.48 0.00 -0.26 0.00 0.00 58.87 56.70 1bjx n SER 171 Cb 0.61 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.52 1bjx n SER 171 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1bjx n ASN 172 N -0.15 3.35 -0.19 4.04 5.15 -1.26 -4.81 115.26 121.39 1bjx n ASN 172 Ca 0.00 1.00 0.25 0.00 -0.60 0.00 0.00 54.58 55.22 1bjx n ASN 172 Cb 0.13 -1.38 0.65 0.00 -0.53 0.00 0.00 39.78 38.65 1bjx n ASN 172 CO 0.00 0.00 0.00 0.77 1.40 0.00 0.00 177.26 179.43 1bjx h SER 173 N 8.53 0.15 -0.73 1.20 4.64 -1.96 0.21 113.55 125.59 1bjx h SER 173 Ca -0.48 0.02 0.15 0.00 -0.47 0.00 0.00 61.79 61.01 1bjx h SER 173 Cb 1.27 -0.01 -0.05 0.00 -0.31 0.00 0.00 62.40 63.30 1bjx h SER 173 CO 0.94 0.05 0.49 -0.78 -0.87 0.00 0.00 176.83 176.67 1bjx h ASP 174 N 0.15 0.35 1.54 4.97 3.58 -1.91 0.35 116.42 125.44 1bjx h ASP 174 Ca 0.43 0.02 -0.09 0.00 0.42 0.00 0.00 57.03 57.81 1bjx h ASP 174 Cb 1.48 -0.05 -0.01 0.00 1.72 0.00 0.00 39.33 42.47 1bjx h ASP 174 CO -0.07 0.18 -0.44 0.58 -2.88 0.00 0.00 179.24 176.61 1bjx h VAL 175 N 0.37 0.76 0.01 2.25 2.07 -0.92 -2.76 116.25 118.05 1bjx h VAL 175 Ca 0.36 -2.06 -0.00 0.00 0.82 0.00 0.00 66.70 65.82 1bjx h VAL 175 Cb 0.87 2.36 0.00 0.00 -1.52 0.00 0.00 31.29 33.01 1bjx h VAL 175 CO -0.11 0.43 -0.01 -0.26 0.02 0.00 0.00 177.57 177.65 1bjx h PHE 176 N 0.00 -0.02 0.00 1.57 -1.00 -0.35 -3.05 116.94 114.10 1bjx h PHE 176 Ca -0.00 -0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 1bjx h PHE 176 Cb 1.33 0.01 0.00 0.00 3.61 0.00 0.00 35.95 40.89 1bjx h PHE 176 CO 0.00 0.48 0.00 0.45 -1.61 0.00 0.00 178.31 177.63 1bjx n SER 177 N -4.71 0.57 0.02 2.17 2.88 0.29 -1.79 113.62 113.06 1bjx n SER 177 Ca -0.05 0.68 -0.20 0.00 -1.33 0.00 0.00 58.87 57.97 1bjx n SER 177 Cb 0.24 -0.79 -0.14 0.00 -0.75 0.00 0.00 64.21 62.77 1bjx n SER 177 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 1bjx h LYS 178 N 0.00 0.25 -0.33 -1.46 3.64 -1.55 -3.31 116.57 113.81 1bjx h LYS 178 Ca 0.00 -0.43 0.00 0.00 -1.27 0.00 0.00 60.65 58.95 1bjx h LYS 178 Cb 0.23 0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.21 1bjx h LYS 178 CO 0.00 1.20 0.00 0.66 -2.27 0.00 0.00 179.45 179.04 1bjx n TYR 179 N -4.12 0.43 -3.46 1.91 4.02 -1.10 -4.96 117.16 109.88 1bjx n TYR 179 Ca -0.17 -0.22 -0.16 0.00 -0.01 0.00 0.00 57.90 57.34 1bjx n TYR 179 Cb 0.81 0.00 0.01 0.00 -0.02 0.00 0.00 39.34 40.14 1bjx n TYR 179 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 1bjx n GLN 180 N 0.59 -1.40 -4.08 -0.72 3.00 -0.74 -4.96 117.38 109.07 1bjx n GLN 180 Ca 0.14 1.00 -0.35 0.00 -0.01 0.00 0.00 57.00 57.79 1bjx n GLN 180 Cb 0.34 -4.14 -0.13 0.00 0.00 0.00 0.00 30.24 26.31 1bjx n GLN 180 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 1bjx s LEU 181 N -4.88 3.20 0.38 1.08 1.43 -1.13 -4.96 118.68 113.79 1bjx s LEU 181 Ca 0.10 -0.22 0.26 0.00 -1.03 0.00 0.00 54.13 53.24 1bjx s LEU 181 Cb -0.04 -1.81 1.35 0.00 0.03 0.00 0.00 46.19 45.73 1bjx s LEU 181 CO 0.83 0.06 1.80 -0.78 0.23 0.00 0.00 176.35 178.49 1bjx h ASP 182 N 7.52 0.00 0.00 2.29 3.58 -1.93 -3.46 116.42 124.42 1bjx h ASP 182 Ca -0.36 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.09 1bjx h ASP 182 Cb 1.18 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.23 1bjx h ASP 182 CO 0.61 0.00 0.00 2.29 -2.88 0.00 0.00 179.24 179.26 1bjx n LYS 183 N -2.42 0.00 -1.36 0.28 2.85 -1.26 -5.15 118.16 111.10 1bjx n LYS 183 Ca -0.01 0.00 -0.31 0.00 -1.05 0.00 0.00 58.31 56.94 1bjx n LYS 183 Cb 0.08 0.00 0.08 0.00 -0.65 0.00 0.00 35.03 34.54 1bjx n LYS 183 CO 0.00 0.00 0.00 0.16 -0.05 0.00 0.00 177.40 177.51 1bjx s ASP 184 N 2.00 4.71 -0.04 -5.58 -4.77 -1.26 -4.99 116.67 106.74 1bjx s ASP 184 Ca 0.00 1.72 -0.31 0.00 -3.30 0.00 0.00 52.55 50.67 1bjx s ASP 184 Cb 0.00 -2.48 0.12 0.00 -1.09 0.00 0.00 42.92 39.47 1bjx s ASP 184 CO 0.00 -1.89 1.34 -0.83 0.70 0.00 0.00 175.17 174.49 1bjx s GLY 185 N -3.54 -0.36 -0.25 2.12 0.00 -1.06 -5.01 107.32 99.23 1bjx s GLY 185 Ca 0.60 0.58 0.01 0.00 0.00 0.00 0.00 44.72 45.91 1bjx s GLY 185 CO 0.56 1.93 -0.02 0.14 0.00 0.00 0.00 173.10 175.71 1bjx s VAL 186 N -2.18 1.46 0.07 1.40 1.01 -1.26 -0.97 120.40 119.92 1bjx s VAL 186 Ca 0.19 -1.33 0.06 0.00 0.00 0.00 0.00 61.98 60.90 1bjx s VAL 186 Cb 0.04 -1.83 -0.04 0.00 0.00 0.00 0.00 36.38 34.56 1bjx s VAL 186 CO -0.04 -0.24 -0.07 -0.69 0.00 0.00 0.00 175.10 174.06 1bjx s VAL 187 N 1.40 3.57 -0.02 2.92 1.01 -1.25 -1.50 120.40 126.54 1bjx s VAL 187 Ca -0.02 -1.07 0.01 0.00 0.00 0.00 0.00 61.98 60.91 1bjx s VAL 187 Cb -0.19 -2.64 -0.03 0.00 0.00 0.00 0.00 36.38 33.52 1bjx s VAL 187 CO -0.09 0.20 -0.01 -0.22 0.00 0.00 0.00 175.10 174.98 1bjx s LEU 188 N -1.99 3.47 -0.21 3.92 0.20 -1.26 -2.86 118.68 119.94 1bjx s LEU 188 Ca 0.21 -0.00 -0.02 0.00 0.69 0.00 0.00 54.13 55.01 1bjx s LEU 188 Cb -0.11 -1.95 0.01 0.00 -0.43 0.00 0.00 46.19 43.71 1bjx s LEU 188 CO 0.13 0.30 -0.10 -0.36 -0.29 0.00 0.00 176.35 176.03 1bjx s PHE 189 N -1.03 2.93 0.22 5.38 0.40 0.22 -3.20 117.98 122.89 1bjx s PHE 189 Ca 0.18 -1.36 0.04 0.00 -0.60 0.00 0.00 56.93 55.19 1bjx s PHE 189 Cb -0.11 -2.03 -0.05 0.00 0.51 0.00 0.00 43.02 41.34 1bjx s PHE 189 CO 0.08 -0.69 -0.04 -1.59 0.70 0.00 0.00 175.22 173.69 1bjx s LYS 190 N 1.37 1.29 0.11 0.44 0.00 -1.02 -1.73 119.74 120.20 1bjx s LYS 190 Ca 0.04 -1.63 0.17 0.00 0.00 0.00 0.00 55.97 54.55 1bjx s LYS 190 Cb -0.15 -0.69 -0.09 0.00 0.00 0.00 0.00 37.83 36.91 1bjx s LYS 190 CO -0.07 -0.03 0.93 0.87 0.00 0.00 0.00 175.35 177.05 1bjx h LYS 191 N 2.53 0.00 0.00 1.78 1.57 -1.84 -3.39 116.57 117.21 1bjx h LYS 191 Ca -0.38 0.00 -0.29 0.00 -1.87 0.00 0.00 60.65 58.11 1bjx h LYS 191 Cb 1.22 0.00 0.06 0.00 0.08 0.00 0.00 32.23 33.59 1bjx h LYS 191 CO 0.64 0.27 0.10 1.97 -0.57 0.00 0.00 179.45 181.86 1bjx n PHE 192 N -2.90 -3.20 -1.56 -1.35 1.16 -1.26 -4.87 117.46 103.48 1bjx n PHE 192 Ca -0.07 -1.08 0.00 0.00 -1.87 0.00 0.00 57.45 54.43 1bjx n PHE 192 Cb 0.79 -0.49 0.00 0.00 -1.61 0.00 0.00 39.48 38.17 1bjx n PHE 192 CO 0.00 0.00 0.00 -0.25 -1.87 0.00 0.00 176.76 174.64 1bjx n ASP 193 N -3.01 -0.85 0.01 5.98 8.00 -1.26 -3.17 116.55 122.25 1bjx n ASP 193 Ca 0.10 0.00 -0.12 0.00 0.71 0.00 0.00 54.79 55.49 1bjx n ASP 193 Cb 0.37 0.00 -0.05 0.00 -0.02 0.00 0.00 41.12 41.42 1bjx n ASP 193 CO 0.00 0.00 0.00 -0.08 -0.39 0.00 0.00 177.20 176.73 1bjx h GLU 194 N 0.00 -0.46 0.00 -1.24 4.57 -1.94 -3.47 114.58 112.05 1bjx h GLU 194 Ca 0.00 0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.21 1bjx h GLU 194 Cb 0.00 0.10 0.00 0.00 -0.16 0.00 0.00 28.75 28.69 1bjx h GLU 194 CO 0.00 -0.30 0.00 0.41 -1.18 0.00 0.00 179.01 177.94 1bjx n GLY 195 N -1.43 1.70 3.13 1.92 0.00 -1.19 -5.04 105.19 104.28 1bjx n GLY 195 Ca -0.04 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.89 1bjx n GLY 195 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1bjx s ARG 196 N 0.00 0.64 0.00 1.61 0.52 -1.26 -2.43 118.95 118.04 1bjx s ARG 196 Ca 0.00 -0.89 0.00 0.00 -0.52 0.00 0.00 55.73 54.32 1bjx s ARG 196 Cb 0.00 0.25 0.00 0.00 0.52 0.00 0.00 34.95 35.72 1bjx s ARG 196 CO 0.00 -0.16 0.00 0.09 0.02 0.00 0.00 175.30 175.25 1bjx n ASN 197 N 0.47 0.85 -2.89 0.23 3.02 -1.19 -4.93 115.26 110.83 1bjx n ASN 197 Ca -0.17 -0.74 -0.07 0.00 -0.03 0.00 0.00 54.58 53.57 1bjx n ASN 197 Cb 0.60 0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 39.76 1bjx n ASN 197 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1bjx s ASN 198 N -0.47 -0.99 -0.14 6.41 0.02 -1.26 -4.57 114.94 113.94 1bjx s ASN 198 Ca 0.00 -1.89 -0.37 0.00 -1.02 0.00 0.00 52.86 49.58 1bjx s ASN 198 Cb 0.00 1.53 -0.14 0.00 0.02 0.00 0.00 41.25 42.66 1bjx s ASN 198 CO 0.00 -0.08 1.75 0.33 0.02 0.00 0.00 177.10 179.12 1bjx n PHE 199 N 3.02 2.12 -3.84 2.20 7.35 -0.56 -4.92 117.46 122.84 1bjx n PHE 199 Ca 0.19 0.32 -0.30 0.00 -0.76 0.00 0.00 57.45 56.90 1bjx n PHE 199 Cb 0.55 -2.53 -0.14 0.00 0.35 0.00 0.00 39.48 37.71 1bjx n PHE 199 CO 0.00 0.00 0.00 -1.21 -0.76 0.00 0.00 176.76 174.79 1bjx s GLU 200 N 3.24 1.54 0.00 -4.13 2.02 -1.26 -4.39 118.70 115.72 1bjx s GLU 200 Ca 0.93 -2.17 0.00 0.00 0.02 0.00 0.00 54.97 53.75 1bjx s GLU 200 Cb -0.88 -2.79 0.00 0.00 0.10 0.00 0.00 34.13 30.56 1bjx s GLU 200 CO 0.56 -1.10 0.00 0.41 0.02 0.00 0.00 175.26 175.15 1bjx n GLY 201 N 3.54 -0.32 3.53 -1.39 0.00 -1.26 -5.07 105.19 104.22 1bjx n GLY 201 Ca 0.06 -1.19 -0.44 0.00 0.00 0.00 0.00 46.02 44.45 1bjx n GLY 201 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1bjx n GLU 202 N -0.73 1.38 -1.86 1.61 1.02 -1.26 -4.85 120.64 115.94 1bjx n GLU 202 Ca 0.00 0.32 -0.43 0.00 -0.02 0.00 0.00 57.16 57.03 1bjx n GLU 202 Cb 0.00 -2.94 -0.03 0.00 -0.02 0.00 0.00 31.44 28.45 1bjx n GLU 202 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1bjx s VAL 203 N 8.83 3.33 0.07 2.62 1.01 -1.26 -4.81 120.40 130.20 1bjx s VAL 203 Ca 1.05 0.37 -0.13 0.00 0.00 0.00 0.00 61.98 63.26 1bjx s VAL 203 Cb -0.52 -3.36 0.02 0.00 0.00 0.00 0.00 36.38 32.51 1bjx s VAL 203 CO 0.39 -0.17 0.31 0.42 0.00 0.00 0.00 175.10 176.04 1bjx s THR 204 N 6.24 0.09 0.17 3.92 -4.23 -1.26 -4.79 115.64 115.78 1bjx s THR 204 Ca 0.84 -0.76 -0.20 0.00 -1.18 0.00 0.00 61.69 60.40 1bjx s THR 204 Cb -0.30 -1.09 0.09 0.00 1.34 0.00 0.00 72.50 72.53 1bjx s THR 204 CO 0.34 -0.42 1.63 0.50 -0.54 0.00 0.00 174.62 176.13 1bjx h LYS 205 N 2.88 -0.15 -1.00 3.99 3.64 -1.93 1.24 116.57 125.24 1bjx h LYS 205 Ca -0.33 0.01 0.09 0.00 -1.27 0.00 0.00 60.65 59.16 1bjx h LYS 205 Cb 1.21 0.03 -0.08 0.00 -0.41 0.00 0.00 32.23 32.99 1bjx h LYS 205 CO 0.48 -0.10 0.64 1.05 -2.27 0.00 0.00 179.45 179.26 1bjx h GLU 206 N -0.16 1.05 0.03 1.90 4.11 -1.96 -0.77 114.58 118.78 1bjx h GLU 206 Ca 0.19 -0.06 -0.06 0.00 0.07 0.00 0.00 59.36 59.49 1bjx h GLU 206 Cb 0.45 -0.24 0.01 0.00 0.50 0.00 0.00 28.75 29.46 1bjx h GLU 206 CO -0.47 0.70 -0.26 -0.91 0.07 0.00 0.00 179.01 178.14 1bjx h ASN 207 N 1.09 0.18 0.23 3.06 2.35 -1.36 -3.18 115.58 117.94 1bjx h ASN 207 Ca 0.47 -0.89 0.01 0.00 -0.55 0.00 0.00 56.30 55.33 1bjx h ASN 207 Cb 0.33 -0.06 -0.04 0.00 0.05 0.00 0.00 38.32 38.61 1bjx h ASN 207 CO -0.22 1.05 -0.43 -0.07 -1.65 0.00 0.00 177.43 176.11 1bjx h LEU 208 N -0.67 -1.25 -2.02 1.61 3.38 0.17 0.87 115.31 117.40 1bjx h LEU 208 Ca -0.04 0.13 0.05 0.00 0.09 0.00 0.00 57.88 58.11 1bjx h LEU 208 Cb 1.12 0.45 -0.01 0.00 0.09 0.00 0.00 40.66 42.31 1bjx h LEU 208 CO 0.05 -0.53 0.36 -0.07 0.09 0.00 0.00 178.44 178.34 1bjx h LEU 209 N -0.74 0.00 0.01 1.67 3.38 -1.29 -1.53 115.31 116.81 1bjx h LEU 209 Ca -0.00 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.91 1bjx h LEU 209 Cb 0.72 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.47 1bjx h LEU 209 CO -0.19 0.00 -0.28 -0.78 0.09 0.00 0.00 178.44 177.29 1bjx h ASP 210 N 0.00 0.03 0.62 -0.43 3.58 -0.89 -2.94 116.42 116.39 1bjx h ASP 210 Ca 0.09 -0.91 -0.03 0.00 0.42 0.00 0.00 57.03 56.60 1bjx h ASP 210 Cb 0.81 -0.01 -0.00 0.00 1.72 0.00 0.00 39.33 41.85 1bjx h ASP 210 CO -0.00 1.11 -0.35 0.15 -2.88 0.00 0.00 179.24 177.28 1bjx h PHE 211 N -0.96 -0.91 -0.31 0.28 3.57 -0.12 -2.80 116.94 115.70 1bjx h PHE 211 Ca -0.07 -0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.47 1bjx h PHE 211 Cb 1.10 0.32 -0.05 0.00 2.79 0.00 0.00 35.95 40.10 1bjx h PHE 211 CO 0.24 -0.54 0.01 0.82 -2.23 0.00 0.00 178.31 176.61 1bjx h ILE 212 N -0.90 0.78 -0.71 1.41 2.04 -1.53 -0.36 117.51 118.24 1bjx h ILE 212 Ca -0.08 -0.03 0.21 0.00 1.00 0.00 0.00 64.86 65.95 1bjx h ILE 212 Cb 0.72 0.67 -0.03 0.00 -0.74 0.00 0.00 36.82 37.44 1bjx h ILE 212 CO 0.10 0.02 0.64 0.11 0.00 0.00 0.00 178.15 179.02 1bjx h LYS 213 N 0.10 0.00 0.00 2.37 1.57 -1.39 0.53 116.57 119.75 1bjx h LYS 213 Ca 0.15 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.80 1bjx h LYS 213 Cb 0.20 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.49 1bjx h LYS 213 CO -0.25 0.00 -1.15 1.25 -0.57 0.00 0.00 179.45 178.73 1bjx h HIS 214 N 0.00 0.00 0.05 -1.35 2.76 -0.82 -3.31 115.15 112.49 1bjx h HIS 214 Ca 0.34 0.00 -0.31 0.00 -2.20 0.00 0.00 60.37 58.19 1bjx h HIS 214 Cb 1.61 0.00 -0.04 0.00 1.55 0.00 0.00 27.41 30.54 1bjx h HIS 214 CO 0.00 0.47 -1.77 -0.91 -1.30 0.00 0.00 177.93 174.41 1bjx h ASN 215 N 0.00 0.16 -0.29 3.26 2.35 0.46 -3.34 115.58 118.19 1bjx h ASN 215 Ca -0.11 -0.34 0.00 0.00 -0.55 0.00 0.00 56.30 55.30 1bjx h ASN 215 Cb 1.45 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 39.77 1bjx h ASN 215 CO 0.04 1.31 0.00 0.00 -1.65 0.00 0.00 177.43 177.13 1bjx n GLN 216 N -3.22 2.93 -3.27 0.81 10.64 0.11 -4.45 117.38 120.93 1bjx n GLN 216 Ca -0.21 -1.56 -0.25 0.00 -1.83 0.00 0.00 57.00 53.14 1bjx n GLN 216 Cb 1.05 -1.87 -0.08 0.00 -0.86 0.00 0.00 30.24 28.47 1bjx n GLN 216 CO 0.00 0.00 0.00 1.28 -1.83 0.00 0.00 177.06 176.51 1bjx n LEU 217 N 0.32 -0.19 -4.66 2.61 4.77 -1.24 -5.01 117.00 113.58 1bjx n LEU 217 Ca 0.14 -4.52 -0.30 0.00 -0.03 0.00 0.00 56.01 51.30 1bjx n LEU 217 Cb 0.71 0.60 0.24 0.00 -2.33 0.00 0.00 43.42 42.65 1bjx n LEU 217 CO 0.16 1.98 0.68 -2.16 -1.33 0.00 0.00 177.39 176.72 1bjx s PRO 218 N -0.59 -1.11 -0.24 3.23 0.04 -1.26 -4.92 135.00 130.14 1bjx s PRO 218 Ca 0.34 -0.27 -0.04 0.00 0.04 0.00 0.00 61.00 61.07 1bjx s PRO 218 Cb 0.11 -1.63 -0.00 0.00 0.04 0.00 0.00 34.50 33.02 1bjx s PRO 218 CO -0.15 -3.60 -0.02 -0.51 0.04 0.00 0.00 177.00 172.76 1bjx s LEU 219 N -6.78 3.14 0.02 -3.56 1.02 -1.26 -5.10 118.68 106.16 1bjx s LEU 219 Ca 0.73 -0.52 -0.01 0.00 0.02 0.00 0.00 54.13 54.34 1bjx s LEU 219 Cb -0.06 -1.76 -0.04 0.00 0.02 0.00 0.00 46.19 44.35 1bjx s LEU 219 CO 0.55 -0.07 0.20 0.54 0.02 0.00 0.00 176.35 177.59 1bjx s VAL 220 N 1.46 5.41 -0.31 -1.59 0.11 -1.26 -4.72 120.40 119.51 1bjx s VAL 220 Ca 0.04 -0.26 -0.12 0.00 -2.93 0.00 0.00 61.98 58.71 1bjx s VAL 220 Cb -0.15 -3.58 0.02 0.00 -1.53 0.00 0.00 36.38 31.13 1bjx s VAL 220 CO -0.02 0.24 0.30 -0.38 -3.33 0.00 0.00 175.10 171.91 1bjx n ILE 221 N 0.64 -8.44 -3.15 7.04 2.08 -1.26 -5.02 119.36 111.25 1bjx n ILE 221 Ca -0.08 1.00 0.04 0.00 0.56 0.00 0.00 62.75 64.27 1bjx n ILE 221 Cb 0.52 -5.71 -0.00 0.00 -0.75 0.00 0.00 39.64 33.70 1bjx n ILE 221 CO 0.00 0.00 0.00 -0.70 0.56 0.00 0.00 176.55 176.41 1bjx s GLU 222 N -1.96 0.49 0.15 0.38 -6.30 -1.26 -5.13 118.70 105.07 1bjx s GLU 222 Ca 0.15 0.65 -0.31 0.00 -2.50 0.00 0.00 54.97 52.96 1bjx s GLU 222 Cb -0.03 0.34 -0.08 0.00 0.00 0.00 0.00 34.13 34.35 1bjx s GLU 222 CO 0.65 -0.76 1.37 -0.06 0.02 0.00 0.00 175.26 176.48 1bjx s PHE 223 N 2.86 3.23 -0.35 5.30 0.08 -1.26 -4.99 117.98 122.86 1bjx s PHE 223 Ca 0.15 1.05 0.02 0.00 0.12 0.00 0.00 56.93 58.26 1bjx s PHE 223 Cb -0.11 -3.66 0.10 0.00 -0.57 0.00 0.00 43.02 38.78 1bjx s PHE 223 CO -0.23 -2.24 0.10 0.95 -0.10 0.00 0.00 175.22 173.71 1bjx s THR 224 N 0.70 1.65 -0.00 0.64 -4.23 -1.26 -4.99 115.64 108.15 1bjx s THR 224 Ca 0.62 -2.04 -0.00 0.00 -1.18 0.00 0.00 61.69 59.08 1bjx s THR 224 Cb -0.37 -2.22 -0.00 0.00 1.34 0.00 0.00 72.50 71.25 1bjx s THR 224 CO 0.34 -0.67 -0.00 -0.62 -0.54 0.00 0.00 174.62 173.13 1bjx n GLU 225 N 4.36 0.00 -4.31 3.99 -0.58 -1.26 -5.03 120.64 117.82 1bjx n GLU 225 Ca 0.02 0.03 -0.29 0.00 -0.42 0.00 0.00 57.16 56.49 1bjx n GLU 225 Cb 0.41 -0.53 -0.11 0.00 -0.57 0.00 0.00 31.44 30.64 1bjx n GLU 225 CO 0.00 0.00 0.00 -0.65 -0.48 0.00 0.00 177.13 176.00 1bjx s GLN 226 N -1.00 1.77 0.05 3.49 -0.21 -1.26 -5.03 119.66 117.47 1bjx s GLN 226 Ca -0.00 -1.19 0.07 0.00 0.02 0.00 0.00 55.36 54.26 1bjx s GLN 226 Cb 0.00 -2.10 -0.23 0.00 1.00 0.00 0.00 33.01 31.68 1bjx s GLN 226 CO 0.00 0.48 1.01 1.15 -2.12 0.00 0.00 175.29 175.81 1bjx h THR 227 N 3.54 1.35 0.00 -0.19 2.02 -2.03 -3.55 112.91 114.05 1bjx h THR 227 Ca -0.50 -3.09 0.00 0.00 0.77 0.00 0.00 66.41 63.59 1bjx h THR 227 Cb 1.17 2.70 0.00 0.00 -1.74 0.00 0.00 68.15 70.28 1bjx h THR 227 CO 0.46 0.79 0.00 0.00 0.37 0.00 0.00 175.52 177.14