#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 3.30 0.48 0.00 0.00 -1.26 -4.15 121.76 120.12 1bjx s ALA 120 Ca 0.00 0.28 -0.01 0.00 0.00 0.00 0.00 51.96 52.23 1bjx s ALA 120 Cb 0.00 -2.96 -0.00 0.00 0.00 0.00 0.00 23.12 20.16 1bjx s ALA 120 CO 0.00 0.26 0.71 -0.08 0.00 0.00 0.00 175.76 176.65 1bjx s THR 121 N -1.69 3.90 -0.51 0.00 -1.32 0.41 -4.83 115.64 111.60 1bjx s THR 121 Ca 0.49 -0.42 -0.14 0.00 -1.21 0.00 0.00 61.69 60.41 1bjx s THR 121 Cb -0.15 -3.46 0.12 0.00 -1.51 0.00 0.00 72.50 67.50 1bjx s THR 121 CO 0.20 -0.35 0.44 -0.89 -2.21 0.00 0.00 174.62 171.82 1bjx s THR 122 N -2.63 4.93 0.08 5.08 2.01 -1.26 -0.53 115.64 123.32 1bjx s THR 122 Ca 0.50 -1.52 -0.30 0.00 0.31 0.00 0.00 61.69 60.67 1bjx s THR 122 Cb -0.10 -4.15 -0.06 0.00 0.01 0.00 0.00 72.50 68.20 1bjx s THR 122 CO 0.39 -0.80 1.12 -0.76 -0.69 0.00 0.00 174.62 173.88 1bjx s LEU 123 N 1.54 4.41 0.16 4.42 1.43 -0.92 -4.93 118.68 124.78 1bjx s LEU 123 Ca 0.04 1.95 -0.05 0.00 -1.03 0.00 0.00 54.13 55.04 1bjx s LEU 123 Cb -0.28 -3.58 0.02 0.00 0.03 0.00 0.00 46.19 42.38 1bjx s LEU 123 CO 0.02 -0.35 1.43 1.55 0.23 0.00 0.00 176.35 179.24 1bjx h PRO 124 N 6.31 0.59 0.00 1.29 0.13 -1.97 -3.44 132.00 134.92 1bjx h PRO 124 Ca -0.42 -0.42 0.00 0.00 -0.87 0.00 0.00 66.00 64.28 1bjx h PRO 124 Cb 1.21 0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.41 1bjx h PRO 124 CO 0.77 1.04 0.00 -0.40 -0.23 0.00 0.00 178.00 179.19 1bjx n ASP 125 N -3.92 0.00 0.28 1.44 5.68 -1.26 -4.79 116.55 113.97 1bjx n ASP 125 Ca -0.04 -0.95 0.12 0.00 -0.50 0.00 0.00 54.79 53.41 1bjx n ASP 125 Cb 0.67 0.00 0.78 0.00 -1.14 0.00 0.00 41.12 41.42 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 0.00 0.00 1.16 6.12 0.00 -1.91 -1.50 103.07 106.94 1bjx h GLY 126 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 47.33 47.45 1bjx h GLY 126 CO 0.00 0.00 0.31 0.00 0.00 0.00 0.00 176.54 176.85 1bjx h ALA 127 N 1.98 2.33 0.00 3.60 0.00 -1.94 -0.47 119.26 124.75 1bjx h ALA 127 Ca -0.00 -0.01 -0.18 0.00 0.00 0.00 0.00 54.91 54.72 1bjx h ALA 127 Cb 0.05 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 1bjx h ALA 127 CO 0.00 -0.52 -1.45 0.00 0.00 0.00 0.00 179.25 177.28 1bjx n ALA 128 N -2.58 1.91 0.25 0.00 0.00 -0.57 -3.27 120.51 116.25 1bjx n ALA 128 Ca 0.07 -0.57 0.11 0.00 0.00 0.00 0.00 53.44 53.05 1bjx n ALA 128 Cb 0.50 -0.94 0.65 0.00 0.00 0.00 0.00 19.45 19.66 1bjx n ALA 128 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1bjx h ALA 129 N 1.40 1.36 0.11 0.00 0.00 -1.02 -0.88 119.26 120.23 1bjx h ALA 129 Ca -0.18 -0.14 -0.35 0.00 0.00 0.00 0.00 54.91 54.24 1bjx h ALA 129 Cb 1.61 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.36 1bjx h ALA 129 CO 0.05 0.19 -1.93 -1.91 0.00 0.00 0.00 179.25 175.65 1bjx n GLU 130 N -3.79 0.74 0.27 0.00 4.07 -1.05 -3.93 120.64 116.96 1bjx n GLU 130 Ca -0.02 0.29 0.15 0.00 -0.06 0.00 0.00 57.16 57.52 1bjx n GLU 130 Cb 0.26 -1.71 0.74 0.00 -0.06 0.00 0.00 31.44 30.67 1bjx n GLU 130 CO 0.00 0.00 0.00 0.77 -0.06 0.00 0.00 177.13 177.84 1bjx h SER 131 N -0.03 0.00 0.04 4.31 0.02 -1.50 -3.03 113.55 113.35 1bjx h SER 131 Ca -0.42 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.53 1bjx h SER 131 Cb 1.97 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.51 1bjx h SER 131 CO 0.06 0.09 -0.02 0.25 -1.14 0.00 0.00 176.83 176.07 1bjx h LEU 132 N 0.00 -0.04 -1.23 5.07 5.85 -1.29 -1.42 115.31 122.25 1bjx h LEU 132 Ca -0.00 -0.46 0.05 0.00 0.84 0.00 0.00 57.88 58.31 1bjx h LEU 132 Cb 0.40 0.01 -0.05 0.00 0.37 0.00 0.00 40.66 41.40 1bjx h LEU 132 CO 0.01 0.45 0.54 0.58 -0.34 0.00 0.00 178.44 179.68 1bjx h VAL 133 N -0.55 1.10 0.00 1.05 2.07 -1.65 -0.39 116.25 117.87 1bjx h VAL 133 Ca -0.01 -0.33 0.00 0.00 0.82 0.00 0.00 66.70 67.18 1bjx h VAL 133 Cb 0.50 0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.30 1bjx h VAL 133 CO 0.01 0.18 0.00 -0.33 0.02 0.00 0.00 177.57 177.45 1bjx h GLU 134 N 0.98 0.00 -0.40 1.57 4.39 -1.52 -3.27 114.58 116.33 1bjx h GLU 134 Ca 0.34 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 60.01 1bjx h GLU 134 Cb 0.12 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.75 1bjx h GLU 134 CO -0.11 0.00 0.13 0.66 -1.16 0.00 0.00 179.01 178.53 1bjx h SER 135 N 0.00 0.58 -3.15 1.42 4.64 0.09 -3.46 113.55 113.66 1bjx h SER 135 Ca 0.00 -0.20 -0.19 0.00 -0.47 0.00 0.00 61.79 60.93 1bjx h SER 135 Cb 0.78 -0.15 -0.05 0.00 -0.31 0.00 0.00 62.40 62.67 1bjx h SER 135 CO 0.00 0.62 -0.18 -1.54 -0.87 0.00 0.00 176.83 174.86 1bjx n SER 136 N -4.61 -0.02 -0.09 4.97 3.41 -1.21 -5.06 113.62 111.02 1bjx n SER 136 Ca -0.00 -1.84 -0.12 0.00 -0.26 0.00 0.00 58.87 56.65 1bjx n SER 136 Cb 0.17 0.59 -0.05 0.00 -0.26 0.00 0.00 64.21 64.67 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 0.51 -5.96 4.33 4.81 -1.90 -3.46 114.58 112.91 1bjx h GLU 137 Ca -0.10 -0.22 -0.61 0.00 -0.13 0.00 0.00 59.36 58.31 1bjx h GLU 137 Cb 0.46 -0.02 -0.14 0.00 0.63 0.00 0.00 28.75 29.69 1bjx h GLU 137 CO 0.14 0.77 -0.70 0.14 -0.73 0.00 0.00 179.01 178.63 1bjx s VAL 138 N -4.62 2.24 -0.30 0.32 -7.23 -1.26 -3.14 120.40 106.42 1bjx s VAL 138 Ca -0.13 -2.25 -0.17 0.00 -1.81 0.00 0.00 61.98 57.62 1bjx s VAL 138 Cb 0.07 -2.54 0.19 0.00 0.56 0.00 0.00 36.38 34.66 1bjx s VAL 138 CO 0.77 -0.26 1.20 0.00 -0.31 0.00 0.00 175.10 176.50 1bjx s ALA 139 N -2.62 -2.83 -0.06 1.32 0.00 -0.92 -4.53 121.76 112.12 1bjx s ALA 139 Ca 0.32 1.96 0.02 0.00 0.00 0.00 0.00 51.96 54.25 1bjx s ALA 139 Cb 0.01 -2.06 -0.03 0.00 0.00 0.00 0.00 23.12 21.04 1bjx s ALA 139 CO 0.16 -0.62 -0.11 0.54 0.00 0.00 0.00 175.76 175.73 1bjx s VAL 140 N 1.59 3.38 -0.17 0.00 0.11 -1.25 -0.27 120.40 123.79 1bjx s VAL 140 Ca -0.05 -0.60 -0.01 0.00 -2.93 0.00 0.00 61.98 58.39 1bjx s VAL 140 Cb -0.02 -2.36 0.05 0.00 -1.53 0.00 0.00 36.38 32.52 1bjx s VAL 140 CO -0.14 0.59 -0.02 -0.63 -3.33 0.00 0.00 175.10 171.58 1bjx s ILE 141 N -0.73 0.91 0.19 7.04 1.01 -1.04 0.14 121.20 128.72 1bjx s ILE 141 Ca 0.11 -0.60 -0.30 0.00 0.00 0.00 0.00 60.65 59.86 1bjx s ILE 141 Cb -0.11 -1.19 -0.08 0.00 0.01 0.00 0.00 42.46 41.09 1bjx s ILE 141 CO 0.01 0.02 1.09 -0.83 0.00 0.00 0.00 174.94 175.22 1bjx s GLY 142 N 1.71 2.90 -0.95 6.18 0.00 -0.29 -3.71 107.32 113.17 1bjx s GLY 142 Ca -0.00 0.81 -0.01 0.00 0.00 0.00 0.00 44.72 45.52 1bjx s GLY 142 CO -0.07 1.60 1.30 0.69 0.00 0.00 0.00 173.10 176.61 1bjx n PHE 143 N 2.15 2.69 -3.65 1.90 3.01 -0.74 -2.61 117.46 120.21 1bjx n PHE 143 Ca 0.02 -3.02 -0.34 0.00 1.01 0.00 0.00 57.45 55.11 1bjx n PHE 143 Cb 0.46 -1.04 -0.05 0.00 -0.01 0.00 0.00 39.48 38.84 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 -2.85 3.56 -0.07 1.38 0.08 -1.15 -2.82 117.98 116.11 1bjx s PHE 144 Ca 0.34 0.69 0.14 0.00 0.12 0.00 0.00 56.93 58.22 1bjx s PHE 144 Cb 0.09 -2.08 -0.12 0.00 -0.57 0.00 0.00 43.02 40.34 1bjx s PHE 144 CO 0.06 0.53 1.02 1.57 -0.10 0.00 0.00 175.22 178.29 1bjx h LYS 145 N 3.64 0.00 -2.47 0.44 5.09 -1.88 -3.27 116.57 118.12 1bjx h LYS 145 Ca -0.49 0.00 -0.59 0.00 0.09 0.00 0.00 60.65 59.66 1bjx h LYS 145 Cb 1.19 0.00 -0.39 0.00 0.10 0.00 0.00 32.23 33.13 1bjx h LYS 145 CO 0.67 0.50 -0.89 -0.40 -2.09 0.00 0.00 179.45 177.24 1bjx n ASP 146 N -3.08 0.51 0.18 7.07 5.75 -1.26 -4.88 116.55 120.85 1bjx n ASP 146 Ca -0.07 -2.63 0.18 0.00 -0.01 0.00 0.00 54.79 52.26 1bjx n ASP 146 Cb 0.87 -0.61 0.70 0.00 -1.03 0.00 0.00 41.12 41.05 1bjx n ASP 146 CO 0.00 0.00 0.00 -0.37 -0.11 0.00 0.00 177.20 176.72 1bjx h VAL 147 N 4.24 0.17 0.00 2.12 -1.51 -1.95 0.58 116.25 119.89 1bjx h VAL 147 Ca 0.22 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.69 1bjx h VAL 147 Cb 0.86 0.56 0.00 0.00 -2.13 0.00 0.00 31.29 30.58 1bjx h VAL 147 CO 0.47 0.00 0.00 -0.62 -1.23 0.00 0.00 177.57 176.19 1bjx n GLU 148 N -3.27 0.85 0.00 5.19 1.02 -1.26 -4.15 120.64 119.01 1bjx n GLU 148 Ca 0.04 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.18 1bjx n GLU 148 Cb 0.63 -1.45 0.00 0.00 -0.02 0.00 0.00 31.44 30.60 1bjx n GLU 148 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 1bjx n SER 149 N -0.95 -0.22 -0.01 1.62 3.41 0.20 -4.93 113.62 112.74 1bjx n SER 149 Ca 0.18 -0.38 -0.14 0.00 -0.26 0.00 0.00 58.87 58.27 1bjx n SER 149 Cb 0.08 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 63.89 1bjx n SER 149 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1bjx n ASP 150 N -1.47 1.40 0.20 4.04 9.92 -1.26 -3.60 116.55 125.78 1bjx n ASP 150 Ca 0.00 0.31 0.05 0.00 -0.53 0.00 0.00 54.79 54.62 1bjx n ASP 150 Cb 0.00 -0.38 0.42 0.00 -0.64 0.00 0.00 41.12 40.52 1bjx n ASP 150 CO 0.00 0.00 0.00 -1.28 0.13 0.00 0.00 177.20 176.05 1bjx h SER 151 N 0.03 0.00 0.62 -2.24 0.87 -1.92 -2.86 113.55 108.05 1bjx h SER 151 Ca -0.36 0.00 -0.24 0.00 -1.23 0.00 0.00 61.79 59.96 1bjx h SER 151 Cb 2.03 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 63.98 1bjx h SER 151 CO 0.08 0.33 -1.09 0.00 -0.53 0.00 0.00 176.83 175.62 1bjx h ALA 152 N 1.67 0.26 -0.17 6.23 0.00 -1.78 -3.29 119.26 122.18 1bjx h ALA 152 Ca -0.00 -0.82 0.05 0.00 0.00 0.00 0.00 54.91 54.13 1bjx h ALA 152 Cb 0.67 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.37 1bjx h ALA 152 CO 0.04 0.97 -0.17 0.87 0.00 0.00 0.00 179.25 180.96 1bjx h LYS 153 N 0.10 -0.19 -0.69 0.00 1.79 -1.56 0.33 116.57 116.35 1bjx h LYS 153 Ca -0.09 0.01 0.13 0.00 -2.18 0.00 0.00 60.65 58.53 1bjx h LYS 153 Cb 1.78 0.04 -0.04 0.00 -1.58 0.00 0.00 32.23 32.43 1bjx h LYS 153 CO 0.17 -0.12 0.46 1.96 -1.08 0.00 0.00 179.45 180.84 1bjx h GLN 154 N -0.19 0.37 0.75 3.15 1.08 -1.65 -2.12 115.11 116.49 1bjx h GLN 154 Ca 0.11 -0.02 -0.04 0.00 -1.45 0.00 0.00 58.65 57.25 1bjx h GLN 154 Cb 0.36 -0.08 0.01 0.00 -0.05 0.00 0.00 27.48 27.71 1bjx h GLN 154 CO -0.28 0.24 -0.36 0.35 -0.95 0.00 0.00 178.83 177.83 1bjx h PHE 155 N 0.38 -0.94 -0.42 2.96 3.57 -1.02 -1.55 116.94 119.92 1bjx h PHE 155 Ca 0.33 -0.02 0.07 0.00 3.53 0.00 0.00 57.97 61.88 1bjx h PHE 155 Cb 0.78 0.31 -0.09 0.00 2.79 0.00 0.00 35.95 39.74 1bjx h PHE 155 CO -0.00 -0.58 -0.44 -0.07 -2.23 0.00 0.00 178.31 174.99 1bjx h LEU 156 N -1.01 -1.47 -0.23 0.59 4.07 -0.93 0.49 115.31 116.82 1bjx h LEU 156 Ca -0.10 0.22 0.06 0.00 0.08 0.00 0.00 57.88 58.14 1bjx h LEU 156 Cb 0.78 0.64 -0.06 0.00 1.08 0.00 0.00 40.66 43.09 1bjx h LEU 156 CO 0.17 -0.37 -0.20 1.56 -1.08 0.00 0.00 178.44 178.52 1bjx h GLN 157 N -0.33 -0.20 -0.89 1.13 4.20 -1.45 0.26 115.11 117.85 1bjx h GLN 157 Ca 0.14 0.01 0.03 0.00 0.06 0.00 0.00 58.65 58.89 1bjx h GLN 157 Cb 0.58 0.04 -0.05 0.00 0.30 0.00 0.00 27.48 28.36 1bjx h GLN 157 CO -0.59 -0.13 0.58 0.00 -0.67 0.00 0.00 178.83 178.03 1bjx h ALA 158 N 0.89 1.43 -0.09 3.87 0.00 -0.19 0.14 119.26 125.31 1bjx h ALA 158 Ca 0.13 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.90 1bjx h ALA 158 Cb 0.41 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1bjx h ALA 158 CO -0.35 0.49 -0.37 0.00 0.00 0.00 0.00 179.25 179.02 1bjx h ALA 159 N 1.48 1.21 0.00 0.00 0.00 0.15 -2.66 119.26 119.44 1bjx h ALA 159 Ca 0.35 -0.37 -0.09 0.00 0.00 0.00 0.00 54.91 54.79 1bjx h ALA 159 Cb -0.01 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1bjx h ALA 159 CO -0.10 0.54 -0.49 0.93 0.00 0.00 0.00 179.25 180.13 1bjx h GLU 160 N 0.16 0.00 -0.87 0.00 5.08 0.78 -3.28 114.58 116.46 1bjx h GLU 160 Ca 0.02 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.36 1bjx h GLU 160 Cb 0.73 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.94 1bjx h GLU 160 CO 0.06 0.40 0.46 0.00 -1.00 0.00 0.00 179.01 178.93 1bjx h ALA 161 N 1.58 1.11 -2.46 3.43 0.00 -0.41 -3.43 119.26 119.09 1bjx h ALA 161 Ca -0.01 -0.14 -0.53 0.00 0.00 0.00 0.00 54.91 54.23 1bjx h ALA 161 Cb 1.33 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 1bjx h ALA 161 CO 0.05 0.63 -0.07 -1.50 0.00 0.00 0.00 179.25 178.36 1bjx s ILE 162 N -5.81 4.90 -0.03 0.00 2.07 -1.21 -4.99 121.20 116.12 1bjx s ILE 162 Ca -0.13 0.49 0.05 0.00 -1.41 0.00 0.00 60.65 59.65 1bjx s ILE 162 Cb 0.16 -3.64 0.08 0.00 0.13 0.00 0.00 42.46 39.19 1bjx s ILE 162 CO 0.83 -0.16 0.93 0.47 -1.91 0.00 0.00 174.94 175.10 1bjx n ASP 163 N -0.37 0.93 -0.08 4.50 8.00 -1.26 -4.44 116.55 123.83 1bjx n ASP 163 Ca 0.01 -2.07 0.03 0.00 0.71 0.00 0.00 54.79 53.47 1bjx n ASP 163 Cb 0.53 -0.19 0.04 0.00 -0.02 0.00 0.00 41.12 41.48 1bjx n ASP 163 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1bjx n ASP 164 N -0.46 1.56 -3.94 -2.24 -0.08 -1.26 -5.03 116.55 105.10 1bjx n ASP 164 Ca 0.04 -2.17 -0.18 0.00 -1.51 0.00 0.00 54.79 50.97 1bjx n ASP 164 Cb 0.57 -0.15 -0.15 0.00 2.34 0.00 0.00 41.12 43.72 1bjx n ASP 164 CO 0.00 0.00 0.00 -0.63 0.12 0.00 0.00 177.20 176.69 1bjx s ILE 165 N -1.30 0.50 -1.24 5.18 -1.09 -1.26 -5.05 121.20 116.95 1bjx s ILE 165 Ca 0.10 -0.20 -0.19 0.00 -2.23 0.00 0.00 60.65 58.12 1bjx s ILE 165 Cb 0.09 -0.47 0.04 0.00 -1.58 0.00 0.00 42.46 40.54 1bjx s ILE 165 CO 0.01 0.18 1.73 -2.16 -1.23 0.00 0.00 174.94 173.47 1bjx s PRO 166 N 0.31 3.69 0.42 2.79 0.04 -1.26 -4.85 135.00 136.14 1bjx s PRO 166 Ca -0.04 -1.72 -0.24 0.00 0.04 0.00 0.00 61.00 59.04 1bjx s PRO 166 Cb -0.08 -5.46 -0.08 0.00 0.04 0.00 0.00 34.50 28.92 1bjx s PRO 166 CO -0.00 -2.53 1.14 -0.06 0.04 0.00 0.00 177.00 175.60 1bjx s PHE 167 N 5.44 3.04 0.07 0.56 0.40 -1.26 -3.89 117.98 122.34 1bjx s PHE 167 Ca 0.55 1.57 0.01 0.00 -0.60 0.00 0.00 56.93 58.45 1bjx s PHE 167 Cb 0.03 -3.34 -0.04 0.00 0.51 0.00 0.00 43.02 40.18 1bjx s PHE 167 CO 0.06 -1.25 -0.05 0.20 0.70 0.00 0.00 175.22 174.88 1bjx s GLY 168 N -1.29 0.62 -0.03 4.36 0.00 0.12 0.16 107.32 111.26 1bjx s GLY 168 Ca 0.59 -1.25 -0.16 0.00 0.00 0.00 0.00 44.72 43.90 1bjx s GLY 168 CO 0.35 -1.35 0.35 -1.50 0.00 0.00 0.00 173.10 170.95 1bjx s ILE 169 N -3.59 0.05 -0.08 0.90 2.07 0.31 -1.14 121.20 119.72 1bjx s ILE 169 Ca 0.08 -0.39 -0.30 0.00 -1.41 0.00 0.00 60.65 58.63 1bjx s ILE 169 Cb 0.05 -0.65 0.11 0.00 0.13 0.00 0.00 42.46 42.11 1bjx s ILE 169 CO -0.07 -0.22 0.97 0.28 -1.91 0.00 0.00 174.94 173.99 1bjx s THR 170 N -1.21 0.00 0.00 4.00 -1.32 -1.07 -2.17 115.64 113.87 1bjx s THR 170 Ca -0.12 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.36 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 0.05 0.00 0.50 -1.54 -2.21 0.00 0.00 174.62 171.42 1bjx n SER 171 N 0.06 0.93 -4.68 8.08 3.41 -1.23 -2.94 113.62 117.24 1bjx n SER 171 Ca -0.08 -1.21 -0.42 0.00 -0.26 0.00 0.00 58.87 56.91 1bjx n SER 171 Cb 0.60 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.52 1bjx n SER 171 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 1bjx s ASN 172 N -0.21 6.48 0.51 4.04 2.47 -1.26 -4.83 114.94 122.14 1bjx s ASN 172 Ca 0.00 2.66 0.31 0.00 0.42 0.00 0.00 52.86 56.25 1bjx s ASN 172 Cb 0.00 -2.56 1.43 0.00 -1.45 0.00 0.00 41.25 38.67 1bjx s ASN 172 CO 0.00 -0.98 1.82 0.28 -3.72 0.00 0.00 177.10 174.50 1bjx h SER 173 N 8.87 0.11 -0.89 -4.21 0.02 -1.96 0.12 113.55 115.61 1bjx h SER 173 Ca -0.45 0.02 0.13 0.00 -0.84 0.00 0.00 61.79 60.65 1bjx h SER 173 Cb 1.21 0.00 -0.09 0.00 0.14 0.00 0.00 62.40 63.67 1bjx h SER 173 CO 0.94 0.02 0.50 -0.78 -1.14 0.00 0.00 176.83 176.37 1bjx h ASP 174 N 0.09 0.67 1.24 3.07 1.82 -1.94 0.24 116.42 121.61 1bjx h ASP 174 Ca 0.54 0.07 -0.07 0.00 -0.39 0.00 0.00 57.03 57.18 1bjx h ASP 174 Cb 1.95 -0.05 -0.01 0.00 0.68 0.00 0.00 39.33 41.90 1bjx h ASP 174 CO -0.07 0.33 -0.31 0.58 -1.61 0.00 0.00 179.24 178.15 1bjx h VAL 175 N 0.76 0.63 0.06 2.25 2.07 -1.08 -2.89 116.25 118.05 1bjx h VAL 175 Ca 0.46 -1.53 -0.00 0.00 0.82 0.00 0.00 66.70 66.44 1bjx h VAL 175 Cb 0.56 2.04 0.00 0.00 -1.52 0.00 0.00 31.29 32.37 1bjx h VAL 175 CO -0.31 0.31 -0.03 -0.26 0.02 0.00 0.00 177.57 177.29 1bjx h PHE 176 N 0.00 -0.07 -0.01 1.57 -1.00 -0.56 -3.23 116.94 113.63 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 1.02 0.02 -0.00 0.00 3.61 0.00 0.00 35.95 40.60 1bjx h PHE 176 CO 0.00 0.45 0.04 1.03 -1.61 0.00 0.00 178.31 178.21 1bjx h SER 177 N -0.94 0.00 0.76 2.17 0.87 -0.79 -2.26 113.55 113.36 1bjx h SER 177 Ca -0.01 0.00 -0.04 0.00 -1.23 0.00 0.00 61.79 60.51 1bjx h SER 177 Cb 0.55 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 62.52 1bjx h SER 177 CO 0.01 0.00 -0.37 0.50 -0.53 0.00 0.00 176.83 176.45 1bjx h LYS 178 N 0.00 -0.99 -1.01 2.24 3.64 -1.53 -3.02 116.57 115.90 1bjx h LYS 178 Ca 0.01 0.07 -0.39 0.00 -1.27 0.00 0.00 60.65 59.06 1bjx h LYS 178 Cb 0.08 0.22 -0.23 0.00 -0.41 0.00 0.00 32.23 31.89 1bjx h LYS 178 CO -0.00 -0.64 0.50 0.66 -2.27 0.00 0.00 179.45 177.69 1bjx n TYR 179 N -5.48 2.28 -3.75 1.91 4.01 -1.05 -4.93 117.16 110.15 1bjx n TYR 179 Ca -0.14 -1.54 -0.21 0.00 -0.16 0.00 0.00 57.90 55.85 1bjx n TYR 179 Cb 0.42 -0.79 0.01 0.00 -0.31 0.00 0.00 39.34 38.67 1bjx n TYR 179 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1bjx n GLN 180 N -0.70 -0.66 -3.18 -0.72 0.00 -0.88 -4.87 117.38 106.37 1bjx n GLN 180 Ca 0.44 -0.13 -0.39 0.00 0.00 0.00 0.00 57.00 56.92 1bjx n GLN 180 Cb 1.34 -0.75 -0.06 0.00 0.00 0.00 0.00 30.24 30.77 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 -5.65 4.25 0.00 2.61 1.43 -1.14 -4.93 118.68 115.26 1bjx s LEU 181 Ca 0.19 0.93 0.20 0.00 -1.03 0.00 0.00 54.13 54.42 1bjx s LEU 181 Cb -0.11 -2.86 1.10 0.00 0.03 0.00 0.00 46.19 44.35 1bjx s LEU 181 CO 0.46 -0.11 1.64 -0.67 0.23 0.00 0.00 176.35 177.90 1bjx n ASP 182 N 4.07 0.00 0.00 2.29 -0.08 -1.26 -4.90 116.55 116.67 1bjx n ASP 182 Ca -0.04 -0.21 0.00 0.00 -1.51 0.00 0.00 54.79 53.03 1bjx n ASP 182 Cb 0.51 -0.19 0.00 0.00 2.34 0.00 0.00 41.12 43.78 1bjx n ASP 182 CO 0.00 0.00 0.00 2.29 0.12 0.00 0.00 177.20 179.61 1bjx n LYS 183 N -1.19 0.00 -3.31 -0.67 2.85 -1.26 -5.15 118.16 109.43 1bjx n LYS 183 Ca 0.12 0.00 -0.32 0.00 -1.05 0.00 0.00 58.31 57.06 1bjx n LYS 183 Cb 0.13 0.00 -0.05 0.00 -0.65 0.00 0.00 35.03 34.46 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 6.66 -0.30 -5.58 -1.08 -1.26 -4.93 116.67 112.18 1bjx s ASP 184 Ca 0.00 1.03 -0.23 0.00 -0.52 0.00 0.00 52.55 52.84 1bjx s ASP 184 Cb 0.00 -2.27 0.20 0.00 -1.46 0.00 0.00 42.92 39.39 1bjx s ASP 184 CO 0.00 -0.13 1.45 -0.83 0.52 0.00 0.00 175.17 176.18 1bjx s GLY 185 N -2.39 0.49 -0.29 2.66 0.00 -1.13 -5.01 107.32 101.67 1bjx s GLY 185 Ca 0.50 3.71 -0.11 0.00 0.00 0.00 0.00 44.72 48.81 1bjx s GLY 185 CO 0.21 2.16 0.19 -1.34 0.00 0.00 0.00 173.10 174.31 1bjx s VAL 186 N 0.24 5.21 0.13 1.40 -7.23 -1.26 -1.79 120.40 117.10 1bjx s VAL 186 Ca 0.04 0.08 0.10 0.00 -1.81 0.00 0.00 61.98 60.39 1bjx s VAL 186 Cb -0.04 -3.51 -0.04 0.00 0.56 0.00 0.00 36.38 33.35 1bjx s VAL 186 CO -0.15 0.22 -0.25 -0.69 -0.31 0.00 0.00 175.10 173.92 1bjx s VAL 187 N 1.74 2.12 -0.01 1.32 1.01 -1.24 -2.59 120.40 122.74 1bjx s VAL 187 Ca 0.07 -1.72 0.00 0.00 0.00 0.00 0.00 61.98 60.33 1bjx s VAL 187 Cb -0.16 -1.89 -0.04 0.00 0.00 0.00 0.00 36.38 34.29 1bjx s VAL 187 CO 0.10 0.03 0.03 -0.22 0.00 0.00 0.00 175.10 175.05 1bjx s LEU 188 N -2.07 3.67 -0.16 3.92 0.20 -1.26 -2.51 118.68 120.47 1bjx s LEU 188 Ca 0.12 0.07 0.01 0.00 0.69 0.00 0.00 54.13 55.03 1bjx s LEU 188 Cb -0.10 -2.08 0.02 0.00 -0.43 0.00 0.00 46.19 43.60 1bjx s LEU 188 CO 0.06 0.29 -0.20 -0.36 -0.29 0.00 0.00 176.35 175.84 1bjx s PHE 189 N -1.10 2.74 0.24 5.38 0.40 0.63 -3.64 117.98 122.63 1bjx s PHE 189 Ca 0.20 -1.52 0.04 0.00 -0.60 0.00 0.00 56.93 55.05 1bjx s PHE 189 Cb -0.12 -1.88 -0.05 0.00 0.51 0.00 0.00 43.02 41.48 1bjx s PHE 189 CO 0.10 -0.73 -0.01 -1.59 0.70 0.00 0.00 175.22 173.69 1bjx s LYS 190 N 1.10 1.37 0.02 0.44 0.00 -0.55 -2.17 119.74 119.97 1bjx s LYS 190 Ca 0.00 -1.69 0.02 0.00 0.00 0.00 0.00 55.97 54.30 1bjx s LYS 190 Cb -0.14 -0.72 -0.25 0.00 0.00 0.00 0.00 37.83 36.72 1bjx s LYS 190 CO -0.08 -0.07 0.92 0.87 0.00 0.00 0.00 175.35 176.99 1bjx h LYS 191 N 2.44 0.14 0.00 1.78 1.79 -1.86 -3.38 116.57 117.48 1bjx h LYS 191 Ca -0.39 -0.24 -0.17 0.00 -2.18 0.00 0.00 60.65 57.67 1bjx h LYS 191 Cb 1.22 0.09 0.04 0.00 -1.58 0.00 0.00 32.23 32.00 1bjx h LYS 191 CO 0.65 0.97 0.06 1.97 -1.08 0.00 0.00 179.45 182.02 1bjx n PHE 192 N -3.35 -3.31 -4.03 -1.35 1.16 -1.26 -4.79 117.46 100.53 1bjx n PHE 192 Ca -0.12 -0.63 0.00 0.00 -1.87 0.00 0.00 57.45 54.82 1bjx n PHE 192 Cb 1.02 -0.29 0.00 0.00 -1.61 0.00 0.00 39.48 38.60 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 -0.93 0.21 5.98 8.00 -1.26 -2.71 116.55 122.82 1bjx n ASP 193 Ca 0.06 0.00 0.08 0.00 0.71 0.00 0.00 54.79 55.64 1bjx n ASP 193 Cb 0.22 0.00 0.40 0.00 -0.02 0.00 0.00 41.12 41.72 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 0.00 0.00 -1.24 4.57 -1.93 -3.47 114.58 112.52 1bjx h GLU 194 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1bjx h GLU 194 Cb 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.59 1bjx h GLU 194 CO 0.00 0.29 0.00 0.41 -1.18 0.00 0.00 179.01 178.53 1bjx n GLY 195 N 0.20 2.59 3.48 1.92 0.00 -1.10 -5.02 105.19 107.25 1bjx n GLY 195 Ca 0.00 -0.05 -0.24 0.00 0.00 0.00 0.00 46.02 45.73 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 1.82 0.00 1.61 0.52 -1.26 -1.48 118.95 120.17 1bjx s ARG 196 Ca 0.00 -2.08 0.00 0.00 -0.52 0.00 0.00 55.73 53.13 1bjx s ARG 196 Cb 0.00 -0.60 0.00 0.00 0.52 0.00 0.00 34.95 34.87 1bjx s ARG 196 CO 0.00 -0.41 0.00 0.09 0.02 0.00 0.00 175.30 175.00 1bjx n ASN 197 N -1.12 0.03 -2.52 0.23 3.02 -1.24 -4.94 115.26 108.72 1bjx n ASN 197 Ca -0.04 0.00 -0.02 0.00 -0.03 0.00 0.00 54.58 54.49 1bjx n ASN 197 Cb 0.65 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.83 1bjx n ASN 197 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1bjx n ASN 198 N -1.98 -6.94 -4.72 6.41 3.02 -1.26 -4.87 115.26 104.93 1bjx n ASN 198 Ca 0.00 0.99 -0.43 0.00 -0.03 0.00 0.00 54.58 55.11 1bjx n ASN 198 Cb 0.01 -4.58 -0.02 0.00 -0.61 0.00 0.00 39.78 34.58 1bjx n ASN 198 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 1bjx n PHE 199 N 0.34 2.60 -3.85 3.10 -0.00 -1.07 -4.98 117.46 113.60 1bjx n PHE 199 Ca 0.03 0.31 -0.27 0.00 -0.00 0.00 0.00 57.45 57.51 1bjx n PHE 199 Cb 0.10 -2.55 -0.17 0.00 -0.00 0.00 0.00 39.48 36.86 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 -0.39 1.22 0.00 -4.13 2.02 -1.26 -4.79 118.70 111.36 1bjx s GLU 200 Ca 0.66 -0.44 0.00 0.00 0.02 0.00 0.00 54.97 55.21 1bjx s GLU 200 Cb -0.55 -1.91 0.00 0.00 0.10 0.00 0.00 34.13 31.76 1bjx s GLU 200 CO 0.48 -0.45 0.00 0.41 0.02 0.00 0.00 175.26 175.72 1bjx n GLY 201 N 4.93 0.61 3.29 -1.39 0.00 -1.26 -5.05 105.19 106.31 1bjx n GLY 201 Ca -0.11 -0.94 -0.33 0.00 0.00 0.00 0.00 46.02 44.64 1bjx n GLY 201 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1bjx s GLU 202 N 0.00 3.28 -0.49 1.61 2.56 -1.26 -5.07 118.70 119.33 1bjx s GLU 202 Ca 0.00 -0.71 -0.28 0.00 0.00 0.00 0.00 54.97 53.97 1bjx s GLU 202 Cb 0.00 -2.69 0.01 0.00 2.00 0.00 0.00 34.13 33.44 1bjx s GLU 202 CO 0.00 0.02 1.47 0.08 -0.56 0.00 0.00 175.26 176.27 1bjx s VAL 203 N 0.84 3.78 0.08 3.70 1.01 -1.26 -4.76 120.40 123.79 1bjx s VAL 203 Ca -0.04 0.72 -0.10 0.00 0.00 0.00 0.00 61.98 62.56 1bjx s VAL 203 Cb -0.15 -4.26 0.01 0.00 0.00 0.00 0.00 36.38 31.98 1bjx s VAL 203 CO -0.00 -0.94 0.23 0.42 0.00 0.00 0.00 175.10 174.81 1bjx s THR 204 N 6.08 0.12 0.17 3.92 -4.23 -1.26 -4.85 115.64 115.59 1bjx s THR 204 Ca 0.59 -1.01 -0.20 0.00 -1.18 0.00 0.00 61.69 59.88 1bjx s THR 204 Cb -0.13 -1.21 0.10 0.00 1.34 0.00 0.00 72.50 72.60 1bjx s THR 204 CO 0.28 -0.56 1.62 0.50 -0.54 0.00 0.00 174.62 175.92 1bjx h LYS 205 N 2.86 -0.16 -0.79 3.99 3.64 -1.93 1.41 116.57 125.58 1bjx h LYS 205 Ca -0.33 0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.12 1bjx h LYS 205 Cb 1.20 0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 33.01 1bjx h LYS 205 CO 0.53 -0.11 0.52 0.93 -2.27 0.00 0.00 179.45 179.05 1bjx h GLU 206 N -0.17 0.84 0.17 1.90 5.08 -1.97 -0.98 114.58 119.45 1bjx h GLU 206 Ca 0.20 -0.05 -0.26 0.00 -1.00 0.00 0.00 59.36 58.25 1bjx h GLU 206 Cb 0.47 -0.19 0.02 0.00 0.50 0.00 0.00 28.75 29.56 1bjx h GLU 206 CO -0.51 0.55 -1.18 -0.91 -1.00 0.00 0.00 179.01 175.96 1bjx h ASN 207 N 0.86 0.56 0.32 1.42 2.35 -1.26 -3.22 115.58 116.62 1bjx h ASN 207 Ca 0.34 -0.92 -0.01 0.00 -0.55 0.00 0.00 56.30 55.16 1bjx h ASN 207 Cb 0.23 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.40 1bjx h ASN 207 CO -0.12 1.55 -0.25 -0.07 -1.65 0.00 0.00 177.43 176.89 1bjx h LEU 208 N -0.19 -0.65 -2.03 1.61 3.38 0.21 0.77 115.31 118.40 1bjx h LEU 208 Ca -0.22 0.05 0.13 0.00 0.09 0.00 0.00 57.88 57.93 1bjx h LEU 208 Cb 1.84 0.21 -0.02 0.00 0.09 0.00 0.00 40.66 42.78 1bjx h LEU 208 CO 0.17 -0.38 0.37 -0.07 0.09 0.00 0.00 178.44 178.62 1bjx h LEU 209 N -0.58 0.00 0.05 1.67 4.07 -1.34 -0.37 115.31 118.81 1bjx h LEU 209 Ca -0.02 0.00 -0.18 0.00 0.08 0.00 0.00 57.88 57.75 1bjx h LEU 209 Cb 0.50 0.00 0.02 0.00 1.08 0.00 0.00 40.66 42.26 1bjx h LEU 209 CO -0.01 0.00 -0.75 -0.78 -1.08 0.00 0.00 178.44 175.82 1bjx h ASP 210 N 0.00 0.58 0.90 -0.43 1.82 -1.21 -2.82 116.42 115.26 1bjx h ASP 210 Ca 0.21 -0.81 -0.04 0.00 -0.39 0.00 0.00 57.03 56.00 1bjx h ASP 210 Cb 0.95 -0.18 0.01 0.00 0.68 0.00 0.00 39.33 40.79 1bjx h ASP 210 CO -0.00 1.32 -0.43 0.15 -1.61 0.00 0.00 179.24 178.67 1bjx h PHE 211 N -0.10 -1.13 -0.98 0.28 3.57 0.70 -1.38 116.94 117.91 1bjx h PHE 211 Ca -0.11 -0.03 0.21 0.00 3.53 0.00 0.00 57.97 61.57 1bjx h PHE 211 Cb 1.48 0.37 -0.11 0.00 2.79 0.00 0.00 35.95 40.48 1bjx h PHE 211 CO 0.15 -0.70 0.57 0.82 -2.23 0.00 0.00 178.31 176.93 1bjx h ILE 212 N -1.31 0.63 -0.14 1.41 2.04 -1.38 0.35 117.51 119.10 1bjx h ILE 212 Ca -0.12 -0.23 -0.07 0.00 1.00 0.00 0.00 64.86 65.44 1bjx h ILE 212 Cb 0.93 -0.09 -0.01 0.00 -0.74 0.00 0.00 36.82 36.91 1bjx h ILE 212 CO 0.20 0.12 -0.23 0.11 0.00 0.00 0.00 178.15 178.36 1bjx h LYS 213 N 0.66 0.25 -0.33 2.37 1.79 -1.29 -2.10 116.57 117.91 1bjx h LYS 213 Ca 0.59 -0.08 0.00 0.00 -2.18 0.00 0.00 60.65 58.98 1bjx h LYS 213 Cb 1.00 -0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.63 1bjx h LYS 213 CO -0.43 0.47 0.00 1.58 -1.08 0.00 0.00 179.45 180.00 1bjx n HIS 214 N -4.18 0.44 -0.06 -1.35 -0.00 0.11 -4.34 115.22 105.84 1bjx n HIS 214 Ca -0.01 -0.22 -0.06 0.00 0.46 0.00 0.00 57.72 57.90 1bjx n HIS 214 Cb 0.35 0.00 -0.02 0.00 -0.12 0.00 0.00 29.99 30.20 1bjx n HIS 214 CO 0.00 0.00 0.00 0.09 0.46 0.00 0.00 176.34 176.89 1bjx n ASN 215 N 0.58 1.51 -3.25 0.26 5.03 -0.55 -4.54 115.26 114.29 1bjx n ASN 215 Ca 0.14 0.40 -0.25 0.00 0.87 0.00 0.00 54.58 55.74 1bjx n ASN 215 Cb 0.33 -0.74 -0.02 0.00 -1.02 0.00 0.00 39.78 38.33 1bjx n ASN 215 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1bjx n GLN 216 N -4.11 1.83 -3.57 3.52 10.64 -1.22 -4.69 117.38 119.79 1bjx n GLN 216 Ca -0.09 -1.47 -0.29 0.00 -1.83 0.00 0.00 57.00 53.32 1bjx n GLN 216 Cb 0.32 -2.51 -0.14 0.00 -0.86 0.00 0.00 30.24 27.05 1bjx n GLN 216 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 1bjx s LEU 217 N 0.30 1.04 -0.66 2.61 1.43 -1.26 -5.08 118.68 117.06 1bjx s LEU 217 Ca 0.41 -1.61 -0.26 0.00 -1.03 0.00 0.00 54.13 51.64 1bjx s LEU 217 Cb 0.10 -0.48 -0.01 0.00 0.03 0.00 0.00 46.19 45.83 1bjx s LEU 217 CO 0.00 -0.40 1.77 -2.16 0.23 0.00 0.00 176.35 175.79 1bjx s PRO 218 N 1.71 2.72 -1.01 1.29 0.04 -1.26 -4.87 135.00 133.62 1bjx s PRO 218 Ca 0.11 0.39 -0.08 0.00 0.04 0.00 0.00 61.00 61.46 1bjx s PRO 218 Cb -0.18 -4.41 -0.15 0.00 0.04 0.00 0.00 34.50 29.79 1bjx s PRO 218 CO -0.25 -2.68 3.20 1.28 0.04 0.00 0.00 177.00 178.59 1bjx n LEU 219 N 12.24 7.44 -3.34 -3.56 4.77 -1.26 -4.69 117.00 128.62 1bjx n LEU 219 Ca 0.19 -3.94 -0.39 0.00 -0.03 0.00 0.00 56.01 51.84 1bjx n LEU 219 Cb 0.51 -1.50 0.01 0.00 -2.33 0.00 0.00 43.42 40.11 1bjx n LEU 219 CO 0.70 1.94 1.71 0.55 -1.33 0.00 0.00 177.39 180.96 1bjx n VAL 220 N 3.12 5.13 -2.07 4.08 3.14 -1.26 -4.94 118.33 125.53 1bjx n VAL 220 Ca 0.65 -4.93 -0.31 0.00 -2.96 0.00 0.00 64.34 56.79 1bjx n VAL 220 Cb 0.49 -1.62 -0.04 0.00 -1.06 0.00 0.00 33.84 31.60 1bjx n VAL 220 CO 0.00 0.00 0.00 -0.63 -6.46 0.00 0.00 176.83 169.74 1bjx s ILE 221 N -3.47 3.44 -0.01 1.55 1.01 -1.26 -4.62 121.20 117.84 1bjx s ILE 221 Ca 0.47 -0.21 0.15 0.00 0.00 0.00 0.00 60.65 61.06 1bjx s ILE 221 Cb 0.26 -4.03 0.26 0.00 0.01 0.00 0.00 42.46 38.95 1bjx s ILE 221 CO -0.19 -0.98 1.11 1.21 0.00 0.00 0.00 174.94 176.09 1bjx n GLU 222 N 8.96 0.12 -0.82 2.79 4.07 -1.26 -5.10 120.64 129.40 1bjx n GLU 222 Ca 0.34 -1.70 -0.17 0.00 -0.06 0.00 0.00 57.16 55.57 1bjx n GLU 222 Cb 0.49 -0.32 0.13 0.00 -0.06 0.00 0.00 31.44 31.67 1bjx n GLU 222 CO 0.00 0.00 0.00 1.19 -0.06 0.00 0.00 177.13 178.26 1bjx n PHE 223 N 0.16 -3.74 -1.42 4.31 3.72 -1.26 -4.96 117.46 114.27 1bjx n PHE 223 Ca 0.05 -0.61 -0.21 0.00 -0.05 0.00 0.00 57.45 56.63 1bjx n PHE 223 Cb 0.94 -0.61 0.14 0.00 -0.94 0.00 0.00 39.48 39.00 1bjx n PHE 223 CO 0.00 0.00 0.00 -2.37 -0.05 0.00 0.00 176.76 174.34 1bjx n THR 224 N -3.46 3.04 -0.11 4.37 5.66 -1.26 -4.55 114.28 117.97 1bjx n THR 224 Ca 0.09 -2.70 -0.23 0.00 -3.05 0.00 0.00 64.05 58.15 1bjx n THR 224 Cb 0.33 -0.68 -0.08 0.00 -1.55 0.00 0.00 70.33 68.36 1bjx n THR 224 CO 0.00 0.00 0.00 1.21 -3.05 0.00 0.00 175.07 173.23 1bjx n GLU 225 N -1.04 0.47 -3.58 1.09 2.13 -1.26 -5.03 120.64 113.42 1bjx n GLU 225 Ca 0.51 0.21 -0.26 0.00 0.66 0.00 0.00 57.16 58.28 1bjx n GLU 225 Cb 1.14 -1.29 0.05 0.00 0.27 0.00 0.00 31.44 31.62 1bjx n GLU 225 CO 0.00 0.00 0.00 0.94 -0.41 0.00 0.00 177.13 177.66 1bjx n GLN 226 N -4.00 -2.07 0.02 5.31 -0.06 -1.26 -4.89 117.38 110.43 1bjx n GLN 226 Ca -0.43 0.58 0.00 0.00 -2.00 0.00 0.00 57.00 55.16 1bjx n GLN 226 Cb 0.80 -4.72 0.00 0.00 -4.06 0.00 0.00 30.24 22.26 1bjx n GLN 226 CO 0.00 0.00 0.00 2.41 -0.20 0.00 0.00 177.06 179.27 1bjx n THR 227 N -3.96 0.02 1.29 1.69 -1.04 -1.26 -5.24 114.28 105.78 1bjx n THR 227 Ca -0.12 0.01 0.13 0.00 -2.04 0.00 0.00 64.05 62.03 1bjx n THR 227 Cb 0.61 -0.61 0.35 0.00 -1.82 0.00 0.00 70.33 68.86 1bjx n THR 227 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43