#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 2.34 -0.23 0.00 0.00 -1.26 -4.76 121.76 117.85 1bjx s ALA 120 Ca 0.00 -1.39 -0.09 0.00 0.00 0.00 0.00 51.96 50.48 1bjx s ALA 120 Cb 0.00 -2.64 -0.05 0.00 0.00 0.00 0.00 23.12 20.44 1bjx s ALA 120 CO 0.00 -2.48 0.13 0.99 0.00 0.00 0.00 175.76 174.40 1bjx s THR 121 N -3.86 5.11 -0.04 0.00 2.01 0.42 -4.85 115.64 114.43 1bjx s THR 121 Ca 0.76 0.09 -0.30 0.00 0.31 0.00 0.00 61.69 62.55 1bjx s THR 121 Cb -0.02 -3.37 -0.03 0.00 0.01 0.00 0.00 72.50 69.09 1bjx s THR 121 CO 0.53 0.37 1.13 -0.89 -0.69 0.00 0.00 174.62 175.06 1bjx s THR 122 N 0.97 4.42 -0.12 -0.82 2.01 -1.26 0.09 115.64 120.93 1bjx s THR 122 Ca 0.06 1.73 -0.05 0.00 0.31 0.00 0.00 61.69 63.74 1bjx s THR 122 Cb -0.13 -4.11 -0.04 0.00 0.01 0.00 0.00 72.50 68.23 1bjx s THR 122 CO 0.03 0.05 0.07 -0.76 -0.69 0.00 0.00 174.62 173.32 1bjx s LEU 123 N 1.77 3.96 0.36 4.42 1.43 -1.01 -4.92 118.68 124.68 1bjx s LEU 123 Ca 0.54 0.26 0.18 0.00 -1.03 0.00 0.00 54.13 54.09 1bjx s LEU 123 Cb -0.24 -1.95 0.59 0.00 0.03 0.00 0.00 46.19 44.63 1bjx s LEU 123 CO 0.23 0.35 1.69 1.55 0.23 0.00 0.00 176.35 180.41 1bjx h PRO 124 N 5.39 0.00 0.00 1.29 0.13 -1.95 -3.44 132.00 133.42 1bjx h PRO 124 Ca -0.50 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.64 1bjx h PRO 124 Cb 1.20 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.33 1bjx h PRO 124 CO 0.59 0.41 0.02 -0.40 -0.23 0.00 0.00 178.00 178.39 1bjx n ASP 125 N -3.51 -0.05 0.01 1.44 5.68 -1.26 -4.83 116.55 114.03 1bjx n ASP 125 Ca -0.00 -1.02 0.02 0.00 -0.50 0.00 0.00 54.79 53.29 1bjx n ASP 125 Cb 0.54 0.08 0.37 0.00 -1.14 0.00 0.00 41.12 40.97 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 0.07 0.55 0.45 6.12 0.00 -1.91 -1.92 103.07 106.43 1bjx h GLY 126 Ca -0.01 -0.26 0.20 0.00 0.00 0.00 0.00 47.33 47.27 1bjx h GLY 126 CO 0.01 0.24 0.58 0.00 0.00 0.00 0.00 176.54 177.38 1bjx h ALA 127 N 1.65 2.56 0.13 3.60 0.00 -1.94 0.19 119.26 125.44 1bjx h ALA 127 Ca 0.13 -0.02 -0.33 0.00 0.00 0.00 0.00 54.91 54.68 1bjx h ALA 127 Cb 0.11 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1bjx h ALA 127 CO -0.01 -0.94 -1.69 0.00 0.00 0.00 0.00 179.25 176.61 1bjx h ALA 128 N 1.50 0.30 -0.59 0.00 0.00 -1.75 -3.22 119.26 115.50 1bjx h ALA 128 Ca 0.33 -1.19 0.17 0.00 0.00 0.00 0.00 54.91 54.22 1bjx h ALA 128 Cb 1.49 0.42 -0.02 0.00 0.00 0.00 0.00 17.79 19.67 1bjx h ALA 128 CO -0.00 1.17 0.42 0.00 0.00 0.00 0.00 179.25 180.84 1bjx h ALA 129 N 0.35 2.54 0.08 0.00 0.00 -0.91 -1.20 119.26 120.12 1bjx h ALA 129 Ca -0.31 -0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.44 1bjx h ALA 129 Cb 2.05 0.04 0.01 0.00 0.00 0.00 0.00 17.79 19.88 1bjx h ALA 129 CO 0.15 -0.71 -0.69 0.93 0.00 0.00 0.00 179.25 178.93 1bjx h GLU 130 N 0.01 0.18 -0.55 0.00 3.07 -1.60 -3.30 114.58 112.39 1bjx h GLU 130 Ca 0.28 -0.31 0.09 0.00 -0.50 0.00 0.00 59.36 58.92 1bjx h GLU 130 Cb 1.11 0.11 -0.03 0.00 -0.84 0.00 0.00 28.75 29.10 1bjx h GLU 130 CO -0.01 1.15 0.37 0.66 -1.40 0.00 0.00 179.01 179.78 1bjx h SER 131 N -0.60 0.34 -0.20 1.42 4.64 -1.36 -1.94 113.55 115.85 1bjx h SER 131 Ca -0.14 0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 61.19 1bjx h SER 131 Cb 1.44 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 63.46 1bjx h SER 131 CO 0.07 0.21 0.12 0.25 -0.87 0.00 0.00 176.83 176.61 1bjx h LEU 132 N 0.38 0.25 -0.92 5.97 5.85 -1.34 -1.58 115.31 123.93 1bjx h LEU 132 Ca 0.25 -0.06 0.11 0.00 0.84 0.00 0.00 57.88 59.02 1bjx h LEU 132 Cb 0.49 -0.06 -0.08 0.00 0.37 0.00 0.00 40.66 41.38 1bjx h LEU 132 CO -0.07 0.23 0.55 0.58 -0.34 0.00 0.00 178.44 179.40 1bjx h VAL 133 N 0.24 0.90 -0.04 1.05 2.07 -1.43 0.26 116.25 119.31 1bjx h VAL 133 Ca 0.07 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 67.29 1bjx h VAL 133 Cb 0.04 -0.06 0.00 0.00 -1.52 0.00 0.00 31.29 29.75 1bjx h VAL 133 CO -0.01 0.16 0.00 -0.62 0.02 0.00 0.00 177.57 177.12 1bjx n GLU 134 N -4.69 1.20 0.02 1.57 1.02 -0.96 -3.78 120.64 115.02 1bjx n GLU 134 Ca 0.17 -0.30 -0.19 0.00 -0.02 0.00 0.00 57.16 56.82 1bjx n GLU 134 Cb 0.33 -1.35 -0.10 0.00 -0.02 0.00 0.00 31.44 30.29 1bjx n GLU 134 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1bjx h SER 135 N 0.63 0.75 -2.32 1.62 0.87 0.52 -3.48 113.55 112.14 1bjx h SER 135 Ca 0.00 -0.74 -0.09 0.00 -1.23 0.00 0.00 61.79 59.74 1bjx h SER 135 Cb 0.14 -0.23 -0.02 0.00 -0.44 0.00 0.00 62.40 61.85 1bjx h SER 135 CO 0.00 1.38 -0.05 -1.54 -0.53 0.00 0.00 176.83 176.09 1bjx n SER 136 N -4.03 -0.34 -0.06 6.23 3.41 -1.25 -5.06 113.62 112.52 1bjx n SER 136 Ca -0.10 -1.53 -0.14 0.00 -0.26 0.00 0.00 58.87 56.84 1bjx n SER 136 Cb 0.77 0.66 -0.07 0.00 -0.26 0.00 0.00 64.21 65.32 1bjx n SER 136 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 1bjx h GLU 137 N 0.00 0.48 -6.70 4.33 4.57 -1.93 -3.45 114.58 111.88 1bjx h GLU 137 Ca -0.07 -0.28 -0.67 0.00 -1.18 0.00 0.00 59.36 57.15 1bjx h GLU 137 Cb 0.33 0.02 -0.18 0.00 -0.16 0.00 0.00 28.75 28.76 1bjx h GLU 137 CO 0.10 0.87 -0.80 0.08 -1.18 0.00 0.00 179.01 178.09 1bjx s VAL 138 N -4.16 2.85 -0.24 0.32 1.01 -1.26 -2.62 120.40 116.30 1bjx s VAL 138 Ca -0.13 -1.54 -0.28 0.00 0.00 0.00 0.00 61.98 60.03 1bjx s VAL 138 Cb 0.06 -2.32 0.15 0.00 0.00 0.00 0.00 36.38 34.27 1bjx s VAL 138 CO 0.79 0.07 1.15 0.00 0.00 0.00 0.00 175.10 177.11 1bjx s ALA 139 N -1.21 -2.03 0.25 5.51 0.00 -0.71 -4.30 121.76 119.28 1bjx s ALA 139 Ca 0.19 1.73 0.05 0.00 0.00 0.00 0.00 51.96 53.93 1bjx s ALA 139 Cb -0.10 -1.22 -0.05 0.00 0.00 0.00 0.00 23.12 21.74 1bjx s ALA 139 CO 0.10 -0.24 -0.04 0.14 0.00 0.00 0.00 175.76 175.72 1bjx s VAL 140 N -0.58 1.38 -0.21 0.00 -7.23 -1.23 0.16 120.40 112.69 1bjx s VAL 140 Ca 0.03 -2.09 -0.04 0.00 -1.81 0.00 0.00 61.98 58.07 1bjx s VAL 140 Cb -0.02 -2.36 0.10 0.00 0.56 0.00 0.00 36.38 34.66 1bjx s VAL 140 CO -0.05 -0.34 0.35 -0.63 -0.31 0.00 0.00 175.10 174.11 1bjx s ILE 141 N -3.19 -0.55 -0.01 -0.62 1.01 -0.97 -1.47 121.20 115.40 1bjx s ILE 141 Ca 0.28 0.05 -0.23 0.00 0.00 0.00 0.00 60.65 60.75 1bjx s ILE 141 Cb 0.04 -0.69 -0.05 0.00 0.01 0.00 0.00 42.46 41.77 1bjx s ILE 141 CO 0.10 -0.04 0.67 -0.83 0.00 0.00 0.00 174.94 174.84 1bjx s GLY 142 N 2.51 2.66 -1.12 6.18 0.00 -0.45 -3.13 107.32 113.98 1bjx s GLY 142 Ca 0.06 0.13 -0.08 0.00 0.00 0.00 0.00 44.72 44.83 1bjx s GLY 142 CO -0.13 0.99 1.24 0.69 0.00 0.00 0.00 173.10 175.89 1bjx n PHE 143 N 3.13 4.46 -3.63 1.90 3.01 0.21 -3.24 117.46 123.31 1bjx n PHE 143 Ca -0.04 -3.53 -0.35 0.00 1.01 0.00 0.00 57.45 54.54 1bjx n PHE 143 Cb 0.51 -1.62 -0.06 0.00 -0.01 0.00 0.00 39.48 38.31 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 -1.53 3.61 -0.13 1.38 0.08 -1.16 -2.39 117.98 117.85 1bjx s PHE 144 Ca 0.32 0.76 0.17 0.00 0.12 0.00 0.00 56.93 58.30 1bjx s PHE 144 Cb -0.06 -2.13 -0.13 0.00 -0.57 0.00 0.00 43.02 40.14 1bjx s PHE 144 CO -0.03 0.58 0.82 0.36 -0.10 0.00 0.00 175.22 176.86 1bjx n LYS 145 N 1.21 0.62 -3.43 0.44 -0.00 -1.26 -3.36 118.16 112.37 1bjx n LYS 145 Ca -0.11 0.21 -0.27 0.00 -0.00 0.00 0.00 58.31 58.14 1bjx n LYS 145 Cb 0.53 -1.80 -0.10 0.00 -0.00 0.00 0.00 35.03 33.65 1bjx n LYS 145 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.40 177.00 1bjx n ASP 146 N -2.86 0.06 -0.11 -5.58 5.68 -1.26 -4.88 116.55 107.59 1bjx n ASP 146 Ca -0.09 -2.52 0.26 0.00 -0.50 0.00 0.00 54.79 51.94 1bjx n ASP 146 Cb 0.82 -0.59 0.61 0.00 -1.14 0.00 0.00 41.12 40.82 1bjx n ASP 146 CO 0.00 0.00 0.00 -0.37 -1.33 0.00 0.00 177.20 175.50 1bjx h VAL 147 N 4.31 0.18 -0.18 2.12 -1.51 -1.95 1.20 116.25 120.42 1bjx h VAL 147 Ca 0.23 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.70 1bjx h VAL 147 Cb 0.88 0.30 0.00 0.00 -2.13 0.00 0.00 31.29 30.34 1bjx h VAL 147 CO 0.43 0.00 0.00 -0.62 -1.23 0.00 0.00 177.57 176.15 1bjx n GLU 148 N -3.52 1.43 0.00 5.19 -0.58 -1.26 -4.15 120.64 117.75 1bjx n GLU 148 Ca 0.18 -0.64 0.00 0.00 -0.42 0.00 0.00 57.16 56.28 1bjx n GLU 148 Cb 1.15 -1.15 0.00 0.00 -0.57 0.00 0.00 31.44 30.87 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 0.02 0.00 -0.09 1.62 3.41 0.41 -4.93 113.62 114.06 1bjx n SER 149 Ca 0.06 0.00 -0.15 0.00 -0.26 0.00 0.00 58.87 58.52 1bjx n SER 149 Cb 0.16 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.04 1bjx n SER 149 CO 0.00 0.00 0.00 -0.78 -0.16 0.00 0.00 175.04 174.10 1bjx h ASP 150 N 0.00 0.00 -0.00 4.04 1.82 -1.89 -3.27 116.42 117.12 1bjx h ASP 150 Ca 0.00 -0.29 0.00 0.00 -0.39 0.00 0.00 57.03 56.35 1bjx h ASP 150 Cb 0.00 0.00 -0.00 0.00 0.68 0.00 0.00 39.33 40.01 1bjx h ASP 150 CO 0.00 1.18 0.01 -1.28 -1.61 0.00 0.00 179.24 177.54 1bjx h SER 151 N -1.00 0.00 1.56 2.28 0.87 -1.93 -0.41 113.55 114.92 1bjx h SER 151 Ca -0.20 0.00 -0.08 0.00 -1.23 0.00 0.00 61.79 60.28 1bjx h SER 151 Cb 0.97 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.92 1bjx h SER 151 CO -0.12 0.00 -0.44 0.00 -0.53 0.00 0.00 176.83 175.73 1bjx h ALA 152 N 1.99 0.76 -0.38 6.23 0.00 -1.81 -3.29 119.26 122.75 1bjx h ALA 152 Ca 0.00 -0.33 -0.13 0.00 0.00 0.00 0.00 54.91 54.44 1bjx h ALA 152 Cb 0.02 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1bjx h ALA 152 CO -0.00 0.44 -0.29 0.87 0.00 0.00 0.00 179.25 180.27 1bjx h LYS 153 N 0.00 0.87 -0.39 0.00 1.57 -1.11 -3.05 116.57 114.46 1bjx h LYS 153 Ca -0.01 -0.42 0.00 0.00 -1.87 0.00 0.00 60.65 58.34 1bjx h LYS 153 Cb 1.27 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.56 1bjx h LYS 153 CO 0.04 1.07 0.25 1.96 -0.57 0.00 0.00 179.45 182.20 1bjx h GLN 154 N 0.68 0.52 -0.09 3.15 1.08 -1.62 -2.15 115.11 116.68 1bjx h GLN 154 Ca 0.07 -0.04 0.04 0.00 -1.45 0.00 0.00 58.65 57.28 1bjx h GLN 154 Cb 0.87 -0.11 -0.06 0.00 -0.05 0.00 0.00 27.48 28.12 1bjx h GLN 154 CO 0.08 0.37 -0.33 0.35 -0.95 0.00 0.00 178.83 178.34 1bjx h PHE 155 N 0.52 -0.92 0.12 2.96 3.04 -1.62 0.12 116.94 121.16 1bjx h PHE 155 Ca 0.14 0.04 0.02 0.00 3.98 0.00 0.00 57.97 62.15 1bjx h PHE 155 Cb -0.03 0.42 -0.04 0.00 2.56 0.00 0.00 35.95 38.86 1bjx h PHE 155 CO -0.04 -0.41 -0.33 -0.07 -2.02 0.00 0.00 178.31 175.44 1bjx h LEU 156 N -0.43 -0.95 -1.20 0.59 3.38 -1.41 0.91 115.31 116.19 1bjx h LEU 156 Ca 0.08 0.11 0.18 0.00 0.09 0.00 0.00 57.88 58.34 1bjx h LEU 156 Cb 0.56 0.36 -0.09 0.00 0.09 0.00 0.00 40.66 41.59 1bjx h LEU 156 CO -0.33 -0.42 0.61 1.56 0.09 0.00 0.00 178.44 179.95 1bjx h GLN 157 N -0.56 0.66 0.05 1.13 4.20 -0.95 0.12 115.11 119.76 1bjx h GLN 157 Ca 0.03 -0.04 -0.24 0.00 0.06 0.00 0.00 58.65 58.46 1bjx h GLN 157 Cb 0.59 -0.15 0.02 0.00 0.30 0.00 0.00 27.48 28.24 1bjx h GLN 157 CO -0.19 0.44 -0.96 0.00 -0.67 0.00 0.00 178.83 177.45 1bjx h ALA 158 N 1.61 0.05 -0.80 3.87 0.00 0.45 -3.14 119.26 121.31 1bjx h ALA 158 Ca 0.51 -0.68 0.04 0.00 0.00 0.00 0.00 54.91 54.78 1bjx h ALA 158 Cb 0.89 0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.70 1bjx h ALA 158 CO -0.27 0.56 0.53 0.00 0.00 0.00 0.00 179.25 180.07 1bjx h ALA 159 N 0.32 1.52 0.00 0.00 0.00 0.21 -0.41 119.26 120.90 1bjx h ALA 159 Ca -0.13 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.68 1bjx h ALA 159 Cb 1.65 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 19.16 1bjx h ALA 159 CO 0.19 0.39 -0.27 0.93 0.00 0.00 0.00 179.25 180.49 1bjx h GLU 160 N 0.98 0.00 0.04 0.00 3.07 -1.05 -2.98 114.58 114.63 1bjx h GLU 160 Ca 0.32 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 59.18 1bjx h GLU 160 Cb 0.05 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.96 1bjx h GLU 160 CO -0.09 0.27 -0.02 0.00 -1.40 0.00 0.00 179.01 177.77 1bjx h ALA 161 N 1.73 -0.06 -2.45 3.43 0.00 -1.02 -3.42 119.26 117.47 1bjx h ALA 161 Ca -0.00 -0.02 -0.52 0.00 0.00 0.00 0.00 54.91 54.36 1bjx h ALA 161 Cb 0.54 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 1bjx h ALA 161 CO 0.04 -0.52 -0.08 0.42 0.00 0.00 0.00 179.25 179.10 1bjx s ILE 162 N -6.11 4.92 0.00 0.00 1.01 -1.13 -5.00 121.20 114.90 1bjx s ILE 162 Ca -0.13 0.39 0.00 0.00 0.00 0.00 0.00 60.65 60.91 1bjx s ILE 162 Cb 0.06 -3.67 0.00 0.00 0.01 0.00 0.00 42.46 38.86 1bjx s ILE 162 CO 0.66 -0.22 0.00 -0.67 0.00 0.00 0.00 174.94 174.70 1bjx n ASP 163 N -0.57 2.41 0.20 3.58 -0.08 -1.26 -4.72 116.55 116.11 1bjx n ASP 163 Ca 0.00 0.00 0.14 0.00 -1.51 0.00 0.00 54.79 53.42 1bjx n ASP 163 Cb 0.53 0.00 0.69 0.00 2.34 0.00 0.00 41.12 44.68 1bjx n ASP 163 CO 0.00 0.00 0.00 -2.24 0.12 0.00 0.00 177.20 175.08 1bjx h ASP 164 N 0.00 0.00 -3.35 1.67 2.03 -1.97 -3.41 116.42 111.39 1bjx h ASP 164 Ca 0.00 0.00 -0.59 0.00 -0.73 0.00 0.00 57.03 55.71 1bjx h ASP 164 Cb 0.62 0.00 -0.09 0.00 -0.83 0.00 0.00 39.33 39.03 1bjx h ASP 164 CO 0.00 0.00 -0.20 -0.63 -1.03 0.00 0.00 179.24 177.38 1bjx s ILE 165 N -3.61 5.22 -1.20 4.15 -1.09 -1.26 -4.99 121.20 118.42 1bjx s ILE 165 Ca -0.01 0.78 -0.20 0.00 -2.23 0.00 0.00 60.65 58.99 1bjx s ILE 165 Cb 0.09 -3.75 0.03 0.00 -1.58 0.00 0.00 42.46 37.25 1bjx s ILE 165 CO 0.32 0.32 1.74 -2.16 -1.23 0.00 0.00 174.94 173.94 1bjx s PRO 166 N 0.76 3.52 0.25 2.79 0.04 -1.26 -4.97 135.00 136.13 1bjx s PRO 166 Ca 0.22 -1.56 -0.30 0.00 0.04 0.00 0.00 61.00 59.40 1bjx s PRO 166 Cb -0.14 -5.42 -0.09 0.00 0.04 0.00 0.00 34.50 28.89 1bjx s PRO 166 CO 0.08 -2.67 1.21 -0.06 0.04 0.00 0.00 177.00 175.60 1bjx s PHE 167 N 6.10 3.36 0.04 0.56 0.40 -1.26 -3.55 117.98 123.63 1bjx s PHE 167 Ca 0.56 1.47 0.05 0.00 -0.60 0.00 0.00 56.93 58.42 1bjx s PHE 167 Cb 0.02 -3.47 -0.02 0.00 0.51 0.00 0.00 43.02 40.06 1bjx s PHE 167 CO 0.05 -1.25 -0.15 0.20 0.70 0.00 0.00 175.22 174.76 1bjx s GLY 168 N -0.29 0.85 -0.09 4.36 0.00 -0.54 0.16 107.32 111.77 1bjx s GLY 168 Ca 0.50 -0.85 -0.07 0.00 0.00 0.00 0.00 44.72 44.29 1bjx s GLY 168 CO 0.42 -0.81 0.24 -1.50 0.00 0.00 0.00 173.10 171.45 1bjx s ILE 169 N -0.79 -0.01 0.09 0.90 2.07 0.11 -1.34 121.20 122.23 1bjx s ILE 169 Ca 0.03 0.04 -0.25 0.00 -1.41 0.00 0.00 60.65 59.06 1bjx s ILE 169 Cb -0.08 -0.35 0.07 0.00 0.13 0.00 0.00 42.46 42.23 1bjx s ILE 169 CO 0.01 0.02 0.61 0.28 -1.91 0.00 0.00 174.94 173.94 1bjx s THR 170 N 0.41 0.00 0.00 4.00 -1.32 -1.20 -2.41 115.64 115.13 1bjx s THR 170 Ca -0.02 -0.04 0.00 0.00 -1.21 0.00 0.00 61.69 60.42 1bjx s THR 170 Cb -0.04 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 69.95 1bjx s THR 170 CO -0.02 -0.02 0.62 -1.54 -2.21 0.00 0.00 174.62 171.44 1bjx n SER 171 N 0.03 1.19 -4.69 8.08 3.41 -1.22 -2.97 113.62 117.46 1bjx n SER 171 Ca -0.18 -1.30 -0.44 0.00 -0.26 0.00 0.00 58.87 56.69 1bjx n SER 171 Cb 0.62 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.54 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 3.66 -0.25 4.04 5.15 -1.26 -4.84 115.26 121.61 1bjx n ASN 172 Ca 0.00 1.03 0.16 0.00 -0.60 0.00 0.00 54.58 55.17 1bjx n ASN 172 Cb 0.11 -1.49 0.46 0.00 -0.53 0.00 0.00 39.78 38.33 1bjx n ASN 172 CO 0.00 0.00 0.00 -1.28 1.40 0.00 0.00 177.26 177.38 1bjx h SER 173 N 7.55 0.51 -0.71 1.20 0.87 -1.96 0.21 113.55 121.21 1bjx h SER 173 Ca -0.46 0.04 0.20 0.00 -1.23 0.00 0.00 61.79 60.34 1bjx h SER 173 Cb 1.24 -0.05 -0.03 0.00 -0.44 0.00 0.00 62.40 63.11 1bjx h SER 173 CO 0.93 0.23 0.51 -0.78 -0.53 0.00 0.00 176.83 177.18 1bjx h ASP 174 N 0.52 0.07 1.23 6.23 3.58 -1.94 0.52 116.42 126.62 1bjx h ASP 174 Ca 0.46 0.01 -0.15 0.00 0.42 0.00 0.00 57.03 57.76 1bjx h ASP 174 Cb 0.97 -0.01 -0.02 0.00 1.72 0.00 0.00 39.33 41.99 1bjx h ASP 174 CO -0.19 0.03 -0.79 0.58 -2.88 0.00 0.00 179.24 175.99 1bjx h VAL 175 N 0.07 1.10 0.04 2.25 2.07 -0.90 -3.04 116.25 117.83 1bjx h VAL 175 Ca 0.34 -2.60 -0.00 0.00 0.82 0.00 0.00 66.70 65.26 1bjx h VAL 175 Cb 1.27 2.53 0.00 0.00 -1.52 0.00 0.00 31.29 33.57 1bjx h VAL 175 CO -0.03 0.63 -0.02 -0.26 0.02 0.00 0.00 177.57 177.91 1bjx h PHE 176 N 0.00 -0.04 0.00 1.57 -1.00 0.02 -3.18 116.94 114.31 1bjx h PHE 176 Ca -0.03 -0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.75 1bjx h PHE 176 Cb 1.55 0.01 0.00 0.00 3.61 0.00 0.00 35.95 41.12 1bjx h PHE 176 CO 0.00 0.60 0.05 0.77 -1.61 0.00 0.00 178.31 178.12 1bjx h SER 177 N -0.93 0.00 0.17 2.17 0.02 -0.87 0.33 113.55 114.44 1bjx h SER 177 Ca -0.00 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.94 1bjx h SER 177 Cb 0.66 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.21 1bjx h SER 177 CO 0.01 0.00 -0.08 0.50 -1.14 0.00 0.00 176.83 176.12 1bjx h LYS 178 N 0.00 -0.22 -0.20 3.45 3.64 -1.52 -3.22 116.57 118.51 1bjx h LYS 178 Ca 0.00 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1bjx h LYS 178 Cb 0.10 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 31.97 1bjx h LYS 178 CO 0.00 0.20 0.00 0.66 -2.27 0.00 0.00 179.45 178.04 1bjx n TYR 179 N -4.95 0.26 -3.52 1.91 4.01 -0.90 -4.96 117.16 109.00 1bjx n TYR 179 Ca -0.08 -0.13 -0.21 0.00 -0.16 0.00 0.00 57.90 57.32 1bjx n TYR 179 Cb 0.27 0.00 0.03 0.00 -0.31 0.00 0.00 39.34 39.32 1bjx n TYR 179 CO 0.00 0.00 0.00 0.94 -0.46 0.00 0.00 176.86 177.34 1bjx n GLN 180 N 0.49 -1.37 -3.73 -0.72 7.27 0.11 -4.95 117.38 114.49 1bjx n GLN 180 Ca 0.16 0.81 -0.37 0.00 0.07 0.00 0.00 57.00 57.68 1bjx n GLN 180 Cb 0.37 -4.27 -0.11 0.00 2.41 0.00 0.00 30.24 28.64 1bjx n GLN 180 CO 0.00 0.00 0.00 -0.51 0.07 0.00 0.00 177.06 176.62 1bjx s LEU 181 N -5.46 3.80 0.57 1.69 1.43 -1.13 -4.95 118.68 114.63 1bjx s LEU 181 Ca 0.26 -0.04 0.38 0.00 -1.03 0.00 0.00 54.13 53.69 1bjx s LEU 181 Cb -0.08 -2.02 1.93 0.00 0.03 0.00 0.00 46.19 46.04 1bjx s LEU 181 CO 0.83 0.01 2.14 -0.78 0.23 0.00 0.00 176.35 178.78 1bjx h ASP 182 N 7.92 0.00 0.00 2.29 3.58 -1.93 -3.46 116.42 124.81 1bjx h ASP 182 Ca -0.37 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.08 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 0.60 0.00 0.00 2.29 -2.88 0.00 0.00 179.24 179.25 1bjx n LYS 183 N -2.90 0.00 -2.22 0.28 2.85 -1.26 -5.14 118.16 109.77 1bjx n LYS 183 Ca -0.02 0.00 -0.34 0.00 -1.05 0.00 0.00 58.31 56.90 1bjx n LYS 183 Cb 0.13 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.51 1bjx n LYS 183 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 177.40 177.69 1bjx s ASP 184 N 2.00 5.72 -0.11 -5.58 -1.08 -1.26 -4.95 116.67 111.41 1bjx s ASP 184 Ca 0.00 2.10 -0.31 0.00 -0.52 0.00 0.00 52.55 53.82 1bjx s ASP 184 Cb 0.00 -2.57 0.12 0.00 -1.46 0.00 0.00 42.92 39.01 1bjx s ASP 184 CO 0.00 -1.21 1.02 -0.83 0.52 0.00 0.00 175.17 174.67 1bjx s GLY 185 N -1.97 -0.33 -0.00 2.66 0.00 -1.00 -5.00 107.32 101.67 1bjx s GLY 185 Ca 0.71 1.59 0.05 0.00 0.00 0.00 0.00 44.72 47.07 1bjx s GLY 185 CO 0.29 0.66 -0.16 0.14 0.00 0.00 0.00 173.10 174.02 1bjx s VAL 186 N -2.16 1.27 0.01 1.40 1.01 -1.26 0.67 120.40 121.33 1bjx s VAL 186 Ca 0.04 -0.77 -0.05 0.00 0.00 0.00 0.00 61.98 61.20 1bjx s VAL 186 Cb -0.01 -1.07 -0.00 0.00 0.00 0.00 0.00 36.38 35.29 1bjx s VAL 186 CO -0.04 0.29 0.08 -0.69 0.00 0.00 0.00 175.10 174.74 1bjx s VAL 187 N -0.47 0.09 -0.01 2.92 1.01 -1.18 -0.90 120.40 121.85 1bjx s VAL 187 Ca 0.06 -0.71 -0.02 0.00 0.00 0.00 0.00 61.98 61.30 1bjx s VAL 187 Cb -0.07 -0.36 -0.04 0.00 0.00 0.00 0.00 36.38 35.92 1bjx s VAL 187 CO -0.00 -0.39 0.15 -0.22 0.00 0.00 0.00 175.10 174.64 1bjx s LEU 188 N -1.31 4.23 -0.27 3.92 0.20 -1.26 -2.30 118.68 121.90 1bjx s LEU 188 Ca -0.14 0.29 0.02 0.00 0.69 0.00 0.00 54.13 55.00 1bjx s LEU 188 Cb -0.08 -2.48 0.07 0.00 -0.43 0.00 0.00 46.19 43.26 1bjx s LEU 188 CO 0.01 0.27 -0.07 -0.36 -0.29 0.00 0.00 176.35 175.91 1bjx s PHE 189 N -1.27 3.06 0.43 5.38 0.08 0.43 -3.47 117.98 122.61 1bjx s PHE 189 Ca 0.25 -2.25 0.04 0.00 0.12 0.00 0.00 56.93 55.09 1bjx s PHE 189 Cb -0.12 -1.97 -0.04 0.00 -0.57 0.00 0.00 43.02 40.32 1bjx s PHE 189 CO 0.16 -0.86 0.05 -1.59 -0.10 0.00 0.00 175.22 172.88 1bjx s LYS 190 N 1.17 1.97 -0.03 0.44 0.00 -1.07 -1.73 119.74 120.49 1bjx s LYS 190 Ca -0.05 -2.18 0.18 0.00 0.00 0.00 0.00 55.97 53.92 1bjx s LYS 190 Cb -0.19 -1.20 -0.21 0.00 0.00 0.00 0.00 37.83 36.23 1bjx s LYS 190 CO -0.06 -0.28 0.55 1.63 0.00 0.00 0.00 175.35 177.19 1bjx n LYS 191 N -0.99 0.65 -0.75 1.78 4.76 -1.08 -4.56 118.16 117.96 1bjx n LYS 191 Ca -0.09 0.10 -0.02 0.00 -2.87 0.00 0.00 58.31 55.42 1bjx n LYS 191 Cb 0.66 -1.68 0.01 0.00 -1.84 0.00 0.00 35.03 32.18 1bjx n LYS 191 CO 0.00 0.00 0.00 1.97 -1.37 0.00 0.00 177.40 178.00 1bjx n PHE 192 N -2.76 -3.39 -2.47 2.13 1.16 -1.26 -4.85 117.46 106.03 1bjx n PHE 192 Ca -0.15 -0.16 0.00 0.00 -1.87 0.00 0.00 57.45 55.26 1bjx n PHE 192 Cb 0.89 -0.07 0.00 0.00 -1.61 0.00 0.00 39.48 38.69 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 -3.00 -1.47 -0.16 5.98 8.00 -1.26 -3.04 116.55 121.60 1bjx n ASP 193 Ca 0.02 0.00 -0.04 0.00 0.71 0.00 0.00 54.79 55.48 1bjx n ASP 193 Cb 0.06 0.00 0.06 0.00 -0.02 0.00 0.00 41.12 41.21 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 0.39 0.00 -1.24 4.57 -1.96 -3.47 114.58 112.88 1bjx h GLU 194 Ca 0.00 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.16 1bjx h GLU 194 Cb 0.00 -0.09 0.00 0.00 -0.16 0.00 0.00 28.75 28.50 1bjx h GLU 194 CO 0.00 0.26 0.00 0.41 -1.18 0.00 0.00 179.01 178.50 1bjx n GLY 195 N -1.26 1.55 3.31 1.92 0.00 -1.17 -5.08 105.19 104.47 1bjx n GLY 195 Ca 0.05 -0.30 -0.17 0.00 0.00 0.00 0.00 46.02 45.60 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 1.50 0.00 1.61 0.52 -1.26 -2.59 118.95 118.73 1bjx s ARG 196 Ca 0.00 -1.84 0.00 0.00 -0.52 0.00 0.00 55.73 53.37 1bjx s ARG 196 Cb 0.00 -0.04 0.00 0.00 0.52 0.00 0.00 34.95 35.43 1bjx s ARG 196 CO 0.00 -0.42 0.00 0.09 0.02 0.00 0.00 175.30 174.99 1bjx n ASN 197 N -0.77 0.00 -2.87 0.23 3.02 -1.23 -4.92 115.26 108.73 1bjx n ASN 197 Ca 0.01 0.00 -0.00 0.00 -0.03 0.00 0.00 54.58 54.56 1bjx n ASN 197 Cb 0.65 0.00 0.01 0.00 -0.61 0.00 0.00 39.78 39.83 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 1.21 -0.79 0.12 6.41 0.02 -1.26 -4.73 114.94 115.92 1bjx s ASN 198 Ca 0.00 -0.56 -0.35 0.00 -1.02 0.00 0.00 52.86 50.92 1bjx s ASN 198 Cb 0.00 1.02 -0.16 0.00 0.02 0.00 0.00 41.25 42.13 1bjx s ASN 198 CO 0.00 -0.07 1.36 0.33 0.02 0.00 0.00 177.10 178.74 1bjx n PHE 199 N 3.60 1.65 -3.92 2.20 -0.00 -0.08 -4.95 117.46 115.96 1bjx n PHE 199 Ca 0.10 0.57 -0.29 0.00 -0.00 0.00 0.00 57.45 57.83 1bjx n PHE 199 Cb 0.61 -2.37 -0.16 0.00 -0.00 0.00 0.00 39.48 37.56 1bjx n PHE 199 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.76 175.55 1bjx s GLU 200 N 0.41 1.59 0.00 -4.13 2.02 -1.26 -4.66 118.70 112.66 1bjx s GLU 200 Ca 0.81 -0.58 0.00 0.00 0.02 0.00 0.00 54.97 55.22 1bjx s GLU 200 Cb -0.88 -2.08 0.00 0.00 0.10 0.00 0.00 34.13 31.27 1bjx s GLU 200 CO 0.46 -0.42 0.00 0.41 0.02 0.00 0.00 175.26 175.73 1bjx n GLY 201 N 4.83 0.80 3.73 -1.39 0.00 -1.26 -5.05 105.19 106.85 1bjx n GLY 201 Ca -0.13 -1.99 -0.40 0.00 0.00 0.00 0.00 46.02 43.50 1bjx n GLY 201 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1bjx s GLU 202 N -1.29 4.49 -0.33 1.61 8.01 -1.26 -5.01 118.70 124.92 1bjx s GLU 202 Ca 0.00 1.07 -0.28 0.00 0.01 0.00 0.00 54.97 55.78 1bjx s GLU 202 Cb 0.00 -3.41 0.01 0.00 -4.31 0.00 0.00 34.13 26.43 1bjx s GLU 202 CO 0.00 0.15 1.02 0.08 0.01 0.00 0.00 175.26 176.52 1bjx s VAL 203 N 0.41 4.55 0.07 2.63 1.01 -1.26 -4.87 120.40 122.94 1bjx s VAL 203 Ca 0.41 1.58 -0.05 0.00 0.00 0.00 0.00 61.98 63.92 1bjx s VAL 203 Cb -0.20 -4.37 -0.02 0.00 0.00 0.00 0.00 36.38 31.79 1bjx s VAL 203 CO 0.22 -0.46 0.08 0.42 0.00 0.00 0.00 175.10 175.36 1bjx s THR 204 N 3.54 0.18 0.18 3.92 -4.23 -1.26 -4.85 115.64 113.12 1bjx s THR 204 Ca 0.43 -1.47 -0.15 0.00 -1.18 0.00 0.00 61.69 59.32 1bjx s THR 204 Cb -0.12 -1.40 0.13 0.00 1.34 0.00 0.00 72.50 72.45 1bjx s THR 204 CO 0.16 -0.81 1.67 0.50 -0.54 0.00 0.00 174.62 175.60 1bjx h LYS 205 N 2.98 0.06 -0.80 3.99 3.64 -1.95 0.44 116.57 124.93 1bjx h LYS 205 Ca -0.34 -0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.00 1bjx h LYS 205 Cb 1.17 -0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.94 1bjx h LYS 205 CO 0.60 0.04 0.33 0.93 -2.27 0.00 0.00 179.45 179.09 1bjx h GLU 206 N 0.06 1.18 -0.04 1.90 4.39 -1.96 -1.76 114.58 118.35 1bjx h GLU 206 Ca 0.24 -0.20 -0.02 0.00 0.34 0.00 0.00 59.36 59.71 1bjx h GLU 206 Cb 0.36 -0.20 -0.00 0.00 -0.10 0.00 0.00 28.75 28.81 1bjx h GLU 206 CO -0.44 0.94 -0.05 -0.91 -1.16 0.00 0.00 179.01 177.39 1bjx h ASN 207 N 1.16 0.12 -0.21 1.42 4.21 -1.54 -2.77 115.58 117.98 1bjx h ASN 207 Ca 0.27 -0.50 0.04 0.00 1.21 0.00 0.00 56.30 57.31 1bjx h ASN 207 Cb 0.19 -0.03 -0.04 0.00 -1.12 0.00 0.00 38.32 37.32 1bjx h ASN 207 CO -0.03 0.60 -0.04 -0.07 -1.29 0.00 0.00 177.43 176.61 1bjx h LEU 208 N -0.36 -0.17 -2.27 1.61 3.38 -0.09 -0.24 115.31 117.18 1bjx h LEU 208 Ca 0.01 0.06 0.01 0.00 0.09 0.00 0.00 57.88 58.05 1bjx h LEU 208 Cb 0.57 0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.44 1bjx h LEU 208 CO 0.01 -0.06 0.05 -0.07 0.09 0.00 0.00 178.44 178.46 1bjx h LEU 209 N 0.01 0.00 0.07 1.67 3.38 -1.36 -2.42 115.31 116.66 1bjx h LEU 209 Ca 0.10 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.93 1bjx h LEU 209 Cb 0.15 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.91 1bjx h LEU 209 CO -0.20 0.00 -0.59 -0.78 0.09 0.00 0.00 178.44 176.96 1bjx h ASP 210 N 0.00 0.40 0.31 -0.43 1.82 -0.81 -3.05 116.42 114.66 1bjx h ASP 210 Ca 0.02 -0.88 -0.00 0.00 -0.39 0.00 0.00 57.03 55.78 1bjx h ASP 210 Cb 0.12 -0.13 -0.03 0.00 0.68 0.00 0.00 39.33 39.97 1bjx h ASP 210 CO -0.00 1.24 -0.48 0.15 -1.61 0.00 0.00 179.24 178.55 1bjx h PHE 211 N -0.39 -1.35 -0.62 0.28 3.57 -0.65 -2.30 116.94 115.49 1bjx h PHE 211 Ca -0.09 0.02 0.12 0.00 3.53 0.00 0.00 57.97 61.55 1bjx h PHE 211 Cb 1.39 0.55 -0.09 0.00 2.79 0.00 0.00 35.95 40.59 1bjx h PHE 211 CO 0.19 -0.59 0.15 0.82 -2.23 0.00 0.00 178.31 176.65 1bjx h ILE 212 N -0.83 0.64 0.00 1.41 2.04 -1.66 0.26 117.51 119.38 1bjx h ILE 212 Ca -0.04 -0.10 0.00 0.00 1.00 0.00 0.00 64.86 65.73 1bjx h ILE 212 Cb 0.76 0.33 0.00 0.00 -0.74 0.00 0.00 36.82 37.17 1bjx h ILE 212 CO -0.15 0.05 0.16 0.50 0.00 0.00 0.00 178.15 178.71 1bjx h LYS 213 N 0.28 0.00 0.00 2.37 3.64 -1.32 -0.47 116.57 121.07 1bjx h LYS 213 Ca 0.33 0.00 -0.15 0.00 -1.27 0.00 0.00 60.65 59.56 1bjx h LYS 213 Cb 0.49 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.29 1bjx h LYS 213 CO -0.41 0.00 -1.87 1.58 -2.27 0.00 0.00 179.45 176.48 1bjx n HIS 214 N -2.80 0.35 -0.09 1.91 -0.00 0.87 -4.19 115.22 111.27 1bjx n HIS 214 Ca -0.02 0.11 -0.22 0.00 0.46 0.00 0.00 57.72 58.06 1bjx n HIS 214 Cb 0.21 -0.84 -0.12 0.00 -0.12 0.00 0.00 29.99 29.12 1bjx n HIS 214 CO 0.00 0.00 0.00 -0.91 0.46 0.00 0.00 176.34 175.89 1bjx h ASN 215 N 0.00 0.06 -0.04 0.26 2.35 -0.52 -3.35 115.58 114.35 1bjx h ASN 215 Ca -0.20 -0.59 0.01 0.00 -0.55 0.00 0.00 56.30 54.97 1bjx h ASN 215 Cb 1.51 -0.02 -0.00 0.00 0.05 0.00 0.00 38.32 39.86 1bjx h ASN 215 CO 0.02 1.52 0.14 0.06 -1.65 0.00 0.00 177.43 177.52 1bjx h GLN 216 N -0.85 0.00 -5.11 0.81 3.07 -1.45 -3.38 115.11 108.19 1bjx h GLN 216 Ca -0.34 0.00 -0.63 0.00 0.09 0.00 0.00 58.65 57.76 1bjx h GLN 216 Cb 1.40 0.00 -0.19 0.00 0.08 0.00 0.00 27.48 28.76 1bjx h GLN 216 CO -0.16 0.00 -0.60 -0.51 0.09 0.00 0.00 178.83 177.66 1bjx s LEU 217 N -6.45 3.62 0.00 0.06 1.43 -1.26 -5.10 118.68 110.99 1bjx s LEU 217 Ca -0.04 -0.07 -0.14 0.00 -1.03 0.00 0.00 54.13 52.85 1bjx s LEU 217 Cb 0.12 -1.94 0.20 0.00 0.03 0.00 0.00 46.19 44.61 1bjx s LEU 217 CO 0.41 0.07 0.84 -0.81 0.23 0.00 0.00 176.35 177.09 1bjx n PRO 218 N 4.24 -2.10 -4.98 1.29 -0.04 -1.26 -4.86 135.00 127.29 1bjx n PRO 218 Ca -0.16 -1.33 -0.32 0.00 -0.04 0.00 0.00 63.50 61.65 1bjx n PRO 218 Cb 0.52 -1.13 -0.15 0.00 -0.04 0.00 0.00 33.50 32.70 1bjx n PRO 218 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1bjx s LEU 219 N 0.00 2.45 -1.28 1.53 1.02 -1.26 -5.02 118.68 116.12 1bjx s LEU 219 Ca 0.52 -0.41 -0.06 0.00 0.02 0.00 0.00 54.13 54.20 1bjx s LEU 219 Cb -0.04 -1.52 0.10 0.00 0.02 0.00 0.00 46.19 44.75 1bjx s LEU 219 CO 0.39 0.18 2.47 1.33 0.02 0.00 0.00 176.35 180.74 1bjx n VAL 220 N 3.38 5.04 -2.52 -1.59 0.24 -1.26 -4.69 118.33 116.93 1bjx n VAL 220 Ca -0.18 -4.08 -0.32 0.00 -2.04 0.00 0.00 64.34 57.71 1bjx n VAL 220 Cb 0.53 -2.08 0.00 0.00 -1.47 0.00 0.00 33.84 30.81 1bjx n VAL 220 CO 0.00 0.00 0.00 2.30 -2.14 0.00 0.00 176.83 176.99 1bjx n ILE 221 N 1.81 3.57 -3.60 1.34 -5.35 -1.26 -4.98 119.36 110.89 1bjx n ILE 221 Ca 0.63 -5.20 -0.14 0.00 -0.27 0.00 0.00 62.75 57.77 1bjx n ILE 221 Cb 0.27 -1.36 -0.07 0.00 -1.74 0.00 0.00 39.64 36.75 1bjx n ILE 221 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 1bjx s GLU 222 N -3.79 0.84 -0.34 6.28 2.12 -1.26 -5.07 118.70 117.48 1bjx s GLU 222 Ca 0.47 0.76 0.15 0.00 0.36 0.00 0.00 54.97 56.71 1bjx s GLU 222 Cb 0.33 0.41 0.43 0.00 0.26 0.00 0.00 34.13 35.56 1bjx s GLU 222 CO -0.21 -0.15 1.23 0.34 -0.54 0.00 0.00 175.26 175.92 1bjx n PHE 223 N 2.17 -0.69 -3.68 5.30 7.35 -1.26 -4.98 117.46 121.67 1bjx n PHE 223 Ca -0.15 -2.19 -0.21 0.00 -0.76 0.00 0.00 57.45 54.14 1bjx n PHE 223 Cb 0.56 0.69 0.04 0.00 0.35 0.00 0.00 39.48 41.12 1bjx n PHE 223 CO 0.00 0.00 0.00 2.41 -0.76 0.00 0.00 176.76 178.41 1bjx n THR 224 N -0.60 -4.45 -3.13 -2.13 -1.04 -1.26 -4.65 114.28 97.01 1bjx n THR 224 Ca -0.00 -0.44 0.00 0.00 -2.04 0.00 0.00 64.05 61.56 1bjx n THR 224 Cb 0.84 -3.89 0.00 0.00 -1.82 0.00 0.00 70.33 65.46 1bjx n THR 224 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1bjx n GLU 225 N -4.31 0.00 -2.86 -2.82 4.71 -1.26 -4.94 120.64 109.16 1bjx n GLU 225 Ca -0.26 0.00 -0.00 0.00 -0.01 0.00 0.00 57.16 56.88 1bjx n GLU 225 Cb 0.66 0.00 -0.00 0.00 -1.01 0.00 0.00 31.44 31.09 1bjx n GLU 225 CO 0.00 0.00 0.00 0.94 0.09 0.00 0.00 177.13 178.16 1bjx n GLN 226 N -0.82 -2.58 -1.27 3.49 7.27 -1.26 -4.75 117.38 117.46 1bjx n GLN 226 Ca 0.00 2.21 0.15 0.00 0.07 0.00 0.00 57.00 59.43 1bjx n GLN 226 Cb 0.00 -3.94 -0.05 0.00 2.41 0.00 0.00 30.24 28.65 1bjx n GLN 226 CO 0.00 0.00 0.00 2.41 0.07 0.00 0.00 177.06 179.54 1bjx n THR 227 N 1.01 0.00 -0.69 1.69 -1.04 -1.26 -4.99 114.28 109.00 1bjx n THR 227 Ca -0.03 0.38 0.00 0.00 -2.04 0.00 0.00 64.05 62.36 1bjx n THR 227 Cb 0.19 -0.77 0.00 0.00 -1.82 0.00 0.00 70.33 67.93 1bjx n THR 227 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43