#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 3.13 0.69 0.00 0.00 -1.26 -4.70 121.76 119.61 1bjx s ALA 120 Ca 0.00 -0.28 -0.06 0.00 0.00 0.00 0.00 51.96 51.62 1bjx s ALA 120 Cb 0.00 -2.93 0.05 0.00 0.00 0.00 0.00 23.12 20.24 1bjx s ALA 120 CO 0.00 -0.73 0.99 -0.08 0.00 0.00 0.00 175.76 175.94 1bjx s THR 121 N -3.12 2.45 -0.41 0.00 -1.32 0.45 -4.78 115.64 108.91 1bjx s THR 121 Ca 0.54 -0.25 -0.07 0.00 -1.21 0.00 0.00 61.69 60.70 1bjx s THR 121 Cb -0.11 -3.05 0.08 0.00 -1.51 0.00 0.00 72.50 67.91 1bjx s THR 121 CO 0.51 -0.06 0.22 -0.89 -2.21 0.00 0.00 174.62 172.20 1bjx s THR 122 N -3.20 3.93 0.08 5.08 2.01 -1.26 -1.18 115.64 121.10 1bjx s THR 122 Ca 0.59 -1.52 -0.29 0.00 0.31 0.00 0.00 61.69 60.78 1bjx s THR 122 Cb -0.11 -3.45 -0.05 0.00 0.01 0.00 0.00 72.50 68.91 1bjx s THR 122 CO 0.45 -0.50 0.94 -0.76 -0.69 0.00 0.00 174.62 174.05 1bjx s LEU 123 N 1.36 4.47 0.21 4.42 1.43 -1.22 -4.95 118.68 124.39 1bjx s LEU 123 Ca 0.03 1.72 -0.01 0.00 -1.03 0.00 0.00 54.13 54.84 1bjx s LEU 123 Cb -0.23 -3.54 0.17 0.00 0.03 0.00 0.00 46.19 42.63 1bjx s LEU 123 CO 0.01 -0.09 1.53 1.55 0.23 0.00 0.00 176.35 179.57 1bjx h PRO 124 N 5.84 0.46 0.00 1.29 0.13 -1.97 -3.45 132.00 134.29 1bjx h PRO 124 Ca -0.43 -0.29 0.01 0.00 -0.87 0.00 0.00 66.00 64.43 1bjx h PRO 124 Cb 1.21 0.03 -0.00 0.00 0.13 0.00 0.00 31.00 32.37 1bjx h PRO 124 CO 0.72 0.89 0.04 -0.40 -0.23 0.00 0.00 178.00 179.03 1bjx n ASP 125 N -3.94 -0.14 0.07 1.44 5.68 -1.26 -4.83 116.55 113.57 1bjx n ASP 125 Ca -0.03 -1.08 0.10 0.00 -0.50 0.00 0.00 54.79 53.29 1bjx n ASP 125 Cb 0.60 0.23 0.57 0.00 -1.14 0.00 0.00 41.12 41.37 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 0.15 0.27 0.99 6.12 0.00 -1.90 -0.65 103.07 108.04 1bjx h GLY 126 Ca -0.02 -0.09 0.14 0.00 0.00 0.00 0.00 47.33 47.36 1bjx h GLY 126 CO 0.03 0.07 0.37 0.00 0.00 0.00 0.00 176.54 177.01 1bjx h ALA 127 N 1.82 2.36 0.10 3.60 0.00 -1.94 -0.58 119.26 124.62 1bjx h ALA 127 Ca 0.15 -0.02 -0.30 0.00 0.00 0.00 0.00 54.91 54.74 1bjx h ALA 127 Cb 0.31 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1bjx h ALA 127 CO -0.03 -0.62 -1.49 0.00 0.00 0.00 0.00 179.25 177.12 1bjx h ALA 128 N 1.70 0.30 -0.60 0.00 0.00 -1.52 -3.12 119.26 116.03 1bjx h ALA 128 Ca 0.22 -1.10 0.17 0.00 0.00 0.00 0.00 54.91 54.21 1bjx h ALA 128 Cb 0.97 0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.98 1bjx h ALA 128 CO -0.00 1.16 0.46 0.00 0.00 0.00 0.00 179.25 180.87 1bjx h ALA 129 N 0.56 2.51 0.00 0.00 0.00 -1.05 0.72 119.26 122.01 1bjx h ALA 129 Ca -0.22 -0.02 -0.29 0.00 0.00 0.00 0.00 54.91 54.38 1bjx h ALA 129 Cb 2.00 0.04 -0.05 0.00 0.00 0.00 0.00 17.79 19.78 1bjx h ALA 129 CO 0.16 -0.77 -1.70 0.39 0.00 0.00 0.00 179.25 177.33 1bjx n GLU 130 N -4.22 0.63 0.09 0.00 -0.58 -1.15 -3.84 120.64 111.57 1bjx n GLU 130 Ca 0.11 0.30 -0.16 0.00 -0.42 0.00 0.00 57.16 56.99 1bjx n GLU 130 Cb 0.70 -1.80 -0.14 0.00 -0.57 0.00 0.00 31.44 29.63 1bjx n GLU 130 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 1bjx h SER 131 N 0.00 0.41 0.83 1.62 0.87 -0.91 -3.26 113.55 113.11 1bjx h SER 131 Ca -0.28 -0.48 -0.04 0.00 -1.23 0.00 0.00 61.79 59.76 1bjx h SER 131 Cb 2.01 -0.13 0.01 0.00 -0.44 0.00 0.00 62.40 63.84 1bjx h SER 131 CO 0.08 1.39 -0.41 0.25 -0.53 0.00 0.00 176.83 177.61 1bjx h LEU 132 N 0.07 -0.96 -1.89 2.23 6.46 0.18 -1.49 115.31 119.91 1bjx h LEU 132 Ca -0.17 0.03 0.11 0.00 -0.12 0.00 0.00 57.88 57.73 1bjx h LEU 132 Cb 1.99 0.25 -0.01 0.00 -0.73 0.00 0.00 40.66 42.16 1bjx h LEU 132 CO 0.19 -0.68 0.48 0.58 -0.62 0.00 0.00 178.44 178.39 1bjx h VAL 133 N -1.13 0.28 0.00 1.05 2.07 -1.71 0.62 116.25 117.43 1bjx h VAL 133 Ca -0.11 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.36 1bjx h VAL 133 Cb 0.87 0.60 -0.01 0.00 -1.52 0.00 0.00 31.29 31.23 1bjx h VAL 133 CO 0.18 0.00 -0.41 -0.33 0.02 0.00 0.00 177.57 177.04 1bjx h GLU 134 N 0.00 0.00 0.25 1.57 5.08 -1.35 -3.35 114.58 116.78 1bjx h GLU 134 Ca 0.18 0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.54 1bjx h GLU 134 Cb 1.14 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.35 1bjx h GLU 134 CO -0.00 0.16 -0.47 0.77 -1.00 0.00 0.00 179.01 178.46 1bjx h SER 135 N 0.00 -1.37 -4.88 1.42 0.02 0.12 -3.45 113.55 105.41 1bjx h SER 135 Ca -0.01 0.14 -0.61 0.00 -0.84 0.00 0.00 61.79 60.47 1bjx h SER 135 Cb 1.15 0.49 -0.12 0.00 0.14 0.00 0.00 62.40 64.06 1bjx h SER 135 CO 0.02 -0.57 -0.45 -1.54 -1.14 0.00 0.00 176.83 173.16 1bjx n SER 136 N -5.50 2.95 -0.13 3.07 3.41 -1.25 -5.04 113.62 111.12 1bjx n SER 136 Ca -0.09 -3.09 -0.13 0.00 -0.26 0.00 0.00 58.87 55.30 1bjx n SER 136 Cb 0.41 0.45 -0.02 0.00 -0.26 0.00 0.00 64.21 64.80 1bjx n SER 136 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1bjx h GLU 137 N 0.00 0.95 -6.61 4.33 5.08 -1.87 -3.44 114.58 113.02 1bjx h GLU 137 Ca -0.38 -0.49 -0.69 0.00 -1.00 0.00 0.00 59.36 56.80 1bjx h GLU 137 Cb 1.19 0.01 -0.25 0.00 0.50 0.00 0.00 28.75 30.20 1bjx h GLU 137 CO 0.63 1.15 -0.84 0.08 -1.00 0.00 0.00 179.01 179.02 1bjx s VAL 138 N -4.44 2.47 -0.16 3.13 1.01 -1.26 -3.14 120.40 118.00 1bjx s VAL 138 Ca -0.11 -1.20 -0.29 0.00 0.00 0.00 0.00 61.98 60.38 1bjx s VAL 138 Cb 0.11 -1.98 0.11 0.00 0.00 0.00 0.00 36.38 34.63 1bjx s VAL 138 CO 0.88 0.42 0.91 0.00 0.00 0.00 0.00 175.10 177.31 1bjx s ALA 139 N -0.81 -1.89 0.09 5.51 0.00 -0.24 -4.26 121.76 120.15 1bjx s ALA 139 Ca 0.12 1.60 0.07 0.00 0.00 0.00 0.00 51.96 53.76 1bjx s ALA 139 Cb -0.10 -0.70 -0.03 0.00 0.00 0.00 0.00 23.12 22.28 1bjx s ALA 139 CO 0.03 -0.31 -0.18 0.54 0.00 0.00 0.00 175.76 175.83 1bjx s VAL 140 N -0.79 1.50 -0.08 0.00 0.11 -1.24 0.11 120.40 120.01 1bjx s VAL 140 Ca -0.03 -1.46 -0.03 0.00 -2.93 0.00 0.00 61.98 57.52 1bjx s VAL 140 Cb -0.01 -1.39 0.05 0.00 -1.53 0.00 0.00 36.38 33.50 1bjx s VAL 140 CO 0.02 -0.12 0.16 -0.63 -3.33 0.00 0.00 175.10 171.20 1bjx s ILE 141 N -1.22 -0.26 0.63 7.04 1.01 -0.98 -0.66 121.20 126.76 1bjx s ILE 141 Ca 0.03 0.35 -0.06 0.00 0.00 0.00 0.00 60.65 60.98 1bjx s ILE 141 Cb -0.10 -0.30 0.03 0.00 0.01 0.00 0.00 42.46 42.10 1bjx s ILE 141 CO 0.04 0.15 0.94 -0.83 0.00 0.00 0.00 174.94 175.24 1bjx s GLY 142 N 2.28 1.64 -0.55 6.18 0.00 -0.49 -3.49 107.32 112.89 1bjx s GLY 142 Ca 0.03 -0.78 0.05 0.00 0.00 0.00 0.00 44.72 44.03 1bjx s GLY 142 CO -0.06 -0.45 0.50 0.69 0.00 0.00 0.00 173.10 173.78 1bjx n PHE 143 N -2.71 1.36 -4.08 1.90 3.01 0.90 -3.87 117.46 113.98 1bjx n PHE 143 Ca 0.06 -3.83 -0.33 0.00 1.01 0.00 0.00 57.45 54.36 1bjx n PHE 143 Cb 0.59 -0.28 -0.07 0.00 -0.01 0.00 0.00 39.48 39.71 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 -1.11 3.30 -0.09 1.38 0.08 -1.20 -2.08 117.98 118.26 1bjx s PHE 144 Ca 0.32 0.21 0.15 0.00 0.12 0.00 0.00 56.93 57.73 1bjx s PHE 144 Cb 0.05 -1.74 -0.18 0.00 -0.57 0.00 0.00 43.02 40.59 1bjx s PHE 144 CO -0.14 0.56 0.74 0.36 -0.10 0.00 0.00 175.22 176.64 1bjx n LYS 145 N 1.11 0.63 -3.39 0.44 -0.00 -1.26 -3.66 118.16 112.02 1bjx n LYS 145 Ca -0.12 0.26 -0.26 0.00 -0.00 0.00 0.00 58.31 58.18 1bjx n LYS 145 Cb 0.53 -1.80 -0.08 0.00 -0.00 0.00 0.00 35.03 33.67 1bjx n LYS 145 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1bjx n ASP 146 N -2.96 1.58 0.04 -5.58 8.00 -1.26 -4.88 116.55 111.49 1bjx n ASP 146 Ca -0.13 -2.95 0.21 0.00 0.71 0.00 0.00 54.79 52.63 1bjx n ASP 146 Cb 0.94 -0.65 0.62 0.00 -0.02 0.00 0.00 41.12 42.01 1bjx n ASP 146 CO 0.00 0.00 0.00 -0.37 -0.39 0.00 0.00 177.20 176.44 1bjx h VAL 147 N 3.12 0.19 -0.08 2.53 -1.51 -1.95 1.01 116.25 119.56 1bjx h VAL 147 Ca 0.15 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.62 1bjx h VAL 147 Cb 0.80 0.42 0.00 0.00 -2.13 0.00 0.00 31.29 30.38 1bjx h VAL 147 CO 0.60 0.00 0.00 -0.62 -1.23 0.00 0.00 177.57 176.32 1bjx n GLU 148 N -3.40 1.31 0.00 5.19 1.02 -1.26 -4.18 120.64 119.32 1bjx n GLU 148 Ca 0.11 -0.46 0.00 0.00 -0.02 0.00 0.00 57.16 56.78 1bjx n GLU 148 Cb 0.89 -1.28 0.00 0.00 -0.02 0.00 0.00 31.44 31.03 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 -0.28 -0.30 0.10 1.62 3.41 0.35 -4.92 113.62 113.60 1bjx n SER 149 Ca 0.13 -0.48 0.11 0.00 -0.26 0.00 0.00 58.87 58.37 1bjx n SER 149 Cb 0.16 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.10 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 -1.89 0.82 0.06 4.04 2.03 -1.26 -3.51 116.55 116.84 1bjx n ASP 150 Ca 0.00 0.31 -0.10 0.00 0.52 0.00 0.00 54.79 55.52 1bjx n ASP 150 Cb 0.00 0.51 -0.13 0.00 -0.72 0.00 0.00 41.12 40.78 1bjx n ASP 150 CO 0.00 0.00 0.00 -1.28 -1.92 0.00 0.00 177.20 174.00 1bjx h SER 151 N 0.00 0.13 1.93 1.67 0.87 -1.92 -3.27 113.55 112.95 1bjx h SER 151 Ca 0.00 -0.15 -0.00 0.00 -1.23 0.00 0.00 61.79 60.41 1bjx h SER 151 Cb 1.00 -0.04 -0.00 0.00 -0.44 0.00 0.00 62.40 62.92 1bjx h SER 151 CO 0.00 1.12 -0.07 0.00 -0.53 0.00 0.00 176.83 177.35 1bjx h ALA 152 N 0.86 0.96 -0.84 6.23 0.00 -1.78 -3.26 119.26 121.44 1bjx h ALA 152 Ca -0.10 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 1bjx h ALA 152 Cb 1.87 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 19.62 1bjx h ALA 152 CO 0.14 0.01 0.46 0.87 0.00 0.00 0.00 179.25 180.73 1bjx h LYS 153 N 0.00 1.17 -0.49 0.00 1.79 -1.61 -2.34 116.57 115.09 1bjx h LYS 153 Ca -0.00 -0.13 -0.10 0.00 -2.18 0.00 0.00 60.65 58.24 1bjx h LYS 153 Cb 1.00 -0.23 -0.02 0.00 -1.58 0.00 0.00 32.23 31.41 1bjx h LYS 153 CO 0.00 0.85 -0.08 1.96 -1.08 0.00 0.00 179.45 181.10 1bjx h GLN 154 N 1.17 0.93 -0.23 3.15 1.08 -1.70 -3.01 115.11 116.51 1bjx h GLN 154 Ca 0.30 -0.34 0.05 0.00 -1.45 0.00 0.00 58.65 57.21 1bjx h GLN 154 Cb 0.02 -0.06 -0.07 0.00 -0.05 0.00 0.00 27.48 27.31 1bjx h GLN 154 CO -0.05 1.00 -0.43 0.35 -0.95 0.00 0.00 178.83 178.75 1bjx h PHE 155 N 0.78 -1.23 0.03 2.96 3.57 -1.52 0.28 116.94 121.81 1bjx h PHE 155 Ca 0.13 0.06 0.03 0.00 3.53 0.00 0.00 57.97 61.71 1bjx h PHE 155 Cb 0.63 0.57 -0.04 0.00 2.79 0.00 0.00 35.95 39.90 1bjx h PHE 155 CO 0.05 -0.46 -0.29 -0.07 -2.23 0.00 0.00 178.31 175.30 1bjx h LEU 156 N -0.44 -0.85 -0.53 0.59 3.38 -1.51 0.38 115.31 116.34 1bjx h LEU 156 Ca 0.10 0.11 0.08 0.00 0.09 0.00 0.00 57.88 58.26 1bjx h LEU 156 Cb 0.61 0.34 -0.07 0.00 0.09 0.00 0.00 40.66 41.63 1bjx h LEU 156 CO -0.46 -0.36 0.16 1.56 0.09 0.00 0.00 178.44 179.43 1bjx h GLN 157 N -0.45 0.31 -0.32 1.13 4.20 -1.27 0.96 115.11 119.67 1bjx h GLN 157 Ca 0.05 -0.02 -0.04 0.00 0.06 0.00 0.00 58.65 58.71 1bjx h GLN 157 Cb 0.52 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.22 1bjx h GLN 157 CO -0.23 0.21 0.06 0.00 -0.67 0.00 0.00 178.83 178.20 1bjx h ALA 158 N 1.38 0.42 -0.09 3.87 0.00 0.18 -2.74 119.26 122.28 1bjx h ALA 158 Ca 0.26 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 1bjx h ALA 158 Cb 0.32 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1bjx h ALA 158 CO -0.29 0.11 -0.09 0.00 0.00 0.00 0.00 179.25 178.99 1bjx h ALA 159 N 0.89 1.69 0.00 0.00 0.00 0.38 -1.92 119.26 120.29 1bjx h ALA 159 Ca 0.10 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 1bjx h ALA 159 Cb 0.34 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1bjx h ALA 159 CO 0.01 0.23 -0.18 0.93 0.00 0.00 0.00 179.25 180.24 1bjx h GLU 160 N 0.13 0.00 -0.28 0.00 4.39 -0.52 -2.82 114.58 115.49 1bjx h GLU 160 Ca 0.03 0.00 0.03 0.00 0.34 0.00 0.00 59.36 59.76 1bjx h GLU 160 Cb 0.24 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.86 1bjx h GLU 160 CO 0.01 0.18 0.08 0.00 -1.16 0.00 0.00 179.01 178.12 1bjx h ALA 161 N 1.82 0.30 -2.31 3.43 0.00 -1.29 -3.42 119.26 117.80 1bjx h ALA 161 Ca -0.00 0.04 -0.49 0.00 0.00 0.00 0.00 54.91 54.46 1bjx h ALA 161 Cb 0.32 0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.16 1bjx h ALA 161 CO 0.02 -0.33 -0.05 -1.50 0.00 0.00 0.00 179.25 177.39 1bjx s ILE 162 N -6.17 5.00 0.00 0.00 2.07 -1.07 -5.00 121.20 116.02 1bjx s ILE 162 Ca -0.13 -0.03 0.00 0.00 -1.41 0.00 0.00 60.65 59.08 1bjx s ILE 162 Cb 0.11 -3.82 0.00 0.00 0.13 0.00 0.00 42.46 38.87 1bjx s ILE 162 CO 0.70 -0.60 0.78 0.47 -1.91 0.00 0.00 174.94 174.38 1bjx n ASP 163 N -1.70 0.00 -0.36 4.50 9.92 -1.26 -4.86 116.55 122.80 1bjx n ASP 163 Ca -0.02 -1.59 0.07 0.00 -0.53 0.00 0.00 54.79 52.72 1bjx n ASP 163 Cb 0.55 -0.12 0.14 0.00 -0.64 0.00 0.00 41.12 41.06 1bjx n ASP 163 CO 0.00 0.00 0.00 -0.90 0.13 0.00 0.00 177.20 176.43 1bjx n ASP 164 N 0.00 2.77 -4.00 -2.24 5.75 -1.26 -4.99 116.55 112.57 1bjx n ASP 164 Ca 0.00 -2.67 -0.17 0.00 -0.01 0.00 0.00 54.79 51.94 1bjx n ASP 164 Cb 0.62 -0.34 -0.14 0.00 -1.03 0.00 0.00 41.12 40.23 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 -2.17 0.58 -1.24 2.12 -1.09 -1.26 -5.03 121.20 113.11 1bjx s ILE 165 Ca 0.26 -0.34 -0.20 0.00 -2.23 0.00 0.00 60.65 58.14 1bjx s ILE 165 Cb 0.21 -0.49 -0.01 0.00 -1.58 0.00 0.00 42.46 40.59 1bjx s ILE 165 CO 0.06 0.14 1.85 -0.81 -1.23 0.00 0.00 174.94 174.95 1bjx n PRO 166 N 2.85 2.37 -2.18 2.79 -0.04 -1.26 -4.95 135.00 134.57 1bjx n PRO 166 Ca -0.13 -2.84 -0.41 0.00 -0.04 0.00 0.00 63.50 60.08 1bjx n PRO 166 Cb 0.57 -3.59 -0.03 0.00 -0.04 0.00 0.00 33.50 30.41 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 7.54 3.21 0.08 0.54 0.40 -1.26 -3.67 117.98 124.81 1bjx s PHE 167 Ca 0.61 1.25 0.05 0.00 -0.60 0.00 0.00 56.93 58.23 1bjx s PHE 167 Cb 0.02 -3.63 -0.03 0.00 0.51 0.00 0.00 43.02 39.89 1bjx s PHE 167 CO 0.10 -1.93 -0.13 0.20 0.70 0.00 0.00 175.22 174.17 1bjx s GLY 168 N 0.15 0.87 -0.13 4.36 0.00 0.16 0.17 107.32 112.90 1bjx s GLY 168 Ca 0.55 -1.08 -0.13 0.00 0.00 0.00 0.00 44.72 44.07 1bjx s GLY 168 CO 0.41 -1.12 0.37 -1.50 0.00 0.00 0.00 173.10 171.26 1bjx s ILE 169 N -1.69 0.00 0.10 0.90 2.07 -0.33 -1.40 121.20 120.85 1bjx s ILE 169 Ca 0.01 -0.02 -0.17 0.00 -1.41 0.00 0.00 60.65 59.06 1bjx s ILE 169 Cb -0.08 -0.52 0.04 0.00 0.13 0.00 0.00 42.46 42.03 1bjx s ILE 169 CO 0.02 -0.01 0.41 0.28 -1.91 0.00 0.00 174.94 173.73 1bjx s THR 170 N 0.14 0.06 -0.00 4.00 -1.32 -1.25 -3.44 115.64 113.82 1bjx s THR 170 Ca -0.00 -0.51 0.00 0.00 -1.21 0.00 0.00 61.69 59.97 1bjx s THR 170 Cb -0.03 -1.09 0.00 0.00 -1.51 0.00 0.00 72.50 69.88 1bjx s THR 170 CO 0.01 -0.28 0.55 -1.20 -2.21 0.00 0.00 174.62 171.48 1bjx n SER 171 N 0.04 1.10 -4.75 8.08 7.64 -1.24 -3.21 113.62 121.27 1bjx n SER 171 Ca -0.17 -1.10 -0.39 0.00 1.01 0.00 0.00 58.87 58.23 1bjx n SER 171 Cb 0.62 -0.00 0.04 0.00 -1.01 0.00 0.00 64.21 63.86 1bjx n SER 171 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 1bjx s ASN 172 N -0.10 5.32 0.30 6.43 2.47 -1.26 -4.83 114.94 123.27 1bjx s ASN 172 Ca 0.00 2.79 0.09 0.00 0.42 0.00 0.00 52.86 56.16 1bjx s ASN 172 Cb 0.00 -2.64 0.45 0.00 -1.45 0.00 0.00 41.25 37.61 1bjx s ASN 172 CO 0.00 -1.54 1.67 -1.28 -3.72 0.00 0.00 177.10 172.24 1bjx h SER 173 N 1.55 0.09 -0.94 -4.21 0.87 -1.96 -3.04 113.55 105.90 1bjx h SER 173 Ca -0.51 -0.04 0.12 0.00 -1.23 0.00 0.00 61.79 60.12 1bjx h SER 173 Cb 1.30 -0.03 -0.08 0.00 -0.44 0.00 0.00 62.40 63.15 1bjx h SER 173 CO 0.58 0.59 0.57 -0.78 -0.53 0.00 0.00 176.83 177.26 1bjx h ASP 174 N 0.07 0.83 0.43 6.23 3.58 -1.93 1.02 116.42 126.65 1bjx h ASP 174 Ca -0.00 0.05 -0.11 0.00 0.42 0.00 0.00 57.03 57.39 1bjx h ASP 174 Cb 0.93 -0.11 -0.01 0.00 1.72 0.00 0.00 39.33 41.86 1bjx h ASP 174 CO 0.07 0.44 -0.48 0.58 -2.88 0.00 0.00 179.24 176.97 1bjx h VAL 175 N 0.91 1.35 0.23 2.25 2.07 -1.81 -2.40 116.25 118.84 1bjx h VAL 175 Ca 0.47 -1.68 -0.30 0.00 0.82 0.00 0.00 66.70 66.01 1bjx h VAL 175 Cb 0.47 1.87 0.03 0.00 -1.52 0.00 0.00 31.29 32.15 1bjx h VAL 175 CO -0.27 0.48 -1.34 -0.26 0.02 0.00 0.00 177.57 176.21 1bjx h PHE 176 N 0.05 0.87 0.00 1.57 -1.00 -0.78 -3.19 116.94 114.46 1bjx h PHE 176 Ca -0.00 -0.63 0.00 0.00 2.81 0.00 0.00 57.97 60.15 1bjx h PHE 176 Cb 0.88 -0.03 0.00 0.00 3.61 0.00 0.00 35.95 40.40 1bjx h PHE 176 CO 0.00 1.51 0.00 0.45 -1.61 0.00 0.00 178.31 178.67 1bjx n SER 177 N -3.82 0.00 -0.05 2.17 2.88 0.33 -1.20 113.62 113.93 1bjx n SER 177 Ca -0.17 0.12 -0.22 0.00 -1.33 0.00 0.00 58.87 57.27 1bjx n SER 177 Cb 1.04 -0.32 -0.13 0.00 -0.75 0.00 0.00 64.21 64.05 1bjx n SER 177 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 1bjx n LYS 178 N -1.32 0.66 -0.02 -1.46 4.81 -0.91 -4.15 118.16 115.78 1bjx n LYS 178 Ca 0.07 0.43 0.13 0.00 -0.87 0.00 0.00 58.31 58.08 1bjx n LYS 178 Cb 0.14 -1.73 0.44 0.00 0.02 0.00 0.00 35.03 33.90 1bjx n LYS 178 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 1bjx n TYR 179 N -4.00 0.04 -3.36 5.64 4.02 -1.16 -4.98 117.16 113.37 1bjx n TYR 179 Ca -0.32 -0.02 -0.14 0.00 -0.01 0.00 0.00 57.90 57.41 1bjx n TYR 179 Cb 0.85 0.00 0.02 0.00 -0.02 0.00 0.00 39.34 40.19 1bjx n TYR 179 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 176.86 176.79 1bjx n GLN 180 N 0.38 -1.47 -3.75 -0.72 7.27 -0.34 -4.96 117.38 113.80 1bjx n GLN 180 Ca 0.18 1.04 -0.37 0.00 0.07 0.00 0.00 57.00 57.92 1bjx n GLN 180 Cb 0.39 -4.74 -0.12 0.00 2.41 0.00 0.00 30.24 28.18 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 -4.91 3.94 0.47 1.69 1.43 -1.15 -4.95 118.68 115.20 1bjx s LEU 181 Ca 0.17 -0.74 0.32 0.00 -1.03 0.00 0.00 54.13 52.85 1bjx s LEU 181 Cb -0.04 -1.89 1.67 0.00 0.03 0.00 0.00 46.19 45.95 1bjx s LEU 181 CO 0.80 -0.21 1.97 0.44 0.23 0.00 0.00 176.35 179.59 1bjx h ASP 182 N 8.25 0.00 -0.71 2.29 3.32 -1.93 -3.45 116.42 124.19 1bjx h ASP 182 Ca -0.31 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.74 1bjx h ASP 182 Cb 1.12 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.67 1bjx h ASP 182 CO 0.61 0.00 0.00 0.29 -1.72 0.00 0.00 179.24 178.42 1bjx n LYS 183 N -2.65 0.00 -0.85 3.56 5.02 -1.26 -5.15 118.16 116.82 1bjx n LYS 183 Ca -0.02 0.00 -0.30 0.00 -2.02 0.00 0.00 58.31 55.97 1bjx n LYS 183 Cb 0.09 0.00 0.17 0.00 -0.02 0.00 0.00 35.03 35.27 1bjx n LYS 183 CO 0.00 0.00 0.00 0.16 -0.52 0.00 0.00 177.40 177.04 1bjx s ASP 184 N 0.04 2.85 -0.25 4.39 1.47 -1.26 -4.98 116.67 118.94 1bjx s ASP 184 Ca 0.00 1.85 -0.31 0.00 1.18 0.00 0.00 52.55 55.27 1bjx s ASP 184 Cb 0.00 -2.43 0.17 0.00 -0.34 0.00 0.00 42.92 40.32 1bjx s ASP 184 CO 0.00 -3.09 1.26 -0.83 0.68 0.00 0.00 175.17 173.20 1bjx s GLY 185 N -2.90 -0.06 -0.07 2.12 0.00 -0.89 -5.00 107.32 100.52 1bjx s GLY 185 Ca 0.66 2.42 0.05 0.00 0.00 0.00 0.00 44.72 47.84 1bjx s GLY 185 CO 0.59 0.97 -0.22 0.14 0.00 0.00 0.00 173.10 174.57 1bjx s VAL 186 N -1.33 2.27 -0.01 1.40 1.01 -1.26 -0.07 120.40 122.42 1bjx s VAL 186 Ca 0.07 -0.98 -0.03 0.00 0.00 0.00 0.00 61.98 61.05 1bjx s VAL 186 Cb -0.01 -1.85 -0.00 0.00 0.00 0.00 0.00 36.38 34.51 1bjx s VAL 186 CO -0.05 0.56 0.05 -0.69 0.00 0.00 0.00 175.10 174.98 1bjx s VAL 187 N -0.05 0.05 0.02 2.92 1.01 -1.23 -0.09 120.40 123.04 1bjx s VAL 187 Ca -0.06 -0.42 0.01 0.00 0.00 0.00 0.00 61.98 61.51 1bjx s VAL 187 Cb -0.15 -0.22 -0.04 0.00 0.00 0.00 0.00 36.38 35.98 1bjx s VAL 187 CO 0.05 -0.23 0.07 -0.22 0.00 0.00 0.00 175.10 174.77 1bjx s LEU 188 N -0.71 3.83 -0.13 3.92 0.20 -1.26 -2.31 118.68 122.22 1bjx s LEU 188 Ca -0.08 0.08 0.02 0.00 0.69 0.00 0.00 54.13 54.85 1bjx s LEU 188 Cb -0.05 -2.32 0.00 0.00 -0.43 0.00 0.00 46.19 43.39 1bjx s LEU 188 CO 0.00 0.24 -0.21 -0.36 -0.29 0.00 0.00 176.35 175.73 1bjx s PHE 189 N -1.25 2.67 0.06 5.38 0.40 0.31 -3.75 117.98 121.80 1bjx s PHE 189 Ca 0.25 -1.13 0.00 0.00 -0.60 0.00 0.00 56.93 55.45 1bjx s PHE 189 Cb -0.12 -1.80 -0.04 0.00 0.51 0.00 0.00 43.02 41.58 1bjx s PHE 189 CO 0.16 -0.49 -0.04 -1.59 0.70 0.00 0.00 175.22 173.96 1bjx s LYS 190 N 0.62 0.63 0.30 0.44 0.00 -0.98 -1.08 119.74 119.67 1bjx s LYS 190 Ca -0.11 -1.15 0.21 0.00 0.00 0.00 0.00 55.97 54.92 1bjx s LYS 190 Cb -0.16 0.04 0.14 0.00 0.00 0.00 0.00 37.83 37.84 1bjx s LYS 190 CO 0.03 -0.06 1.32 0.87 0.00 0.00 0.00 175.35 177.50 1bjx h LYS 191 N 3.37 0.00 0.00 1.78 1.79 -1.86 -3.39 116.57 118.26 1bjx h LYS 191 Ca -0.34 0.00 -0.29 0.00 -2.18 0.00 0.00 60.65 57.83 1bjx h LYS 191 Cb 1.16 0.00 0.06 0.00 -1.58 0.00 0.00 32.23 31.87 1bjx h LYS 191 CO 0.61 0.10 0.10 1.97 -1.08 0.00 0.00 179.45 181.15 1bjx n PHE 192 N -2.96 -3.23 -1.70 -1.35 1.16 -1.26 -4.88 117.46 103.24 1bjx n PHE 192 Ca 0.01 -1.07 0.00 0.00 -1.87 0.00 0.00 57.45 54.52 1bjx n PHE 192 Cb 0.60 -0.50 0.00 0.00 -1.61 0.00 0.00 39.48 37.97 1bjx n PHE 192 CO 0.00 0.00 0.00 -3.47 -1.87 0.00 0.00 176.76 171.42 1bjx n ASP 193 N -3.03 -0.89 0.10 5.98 -0.08 -1.26 -3.25 116.55 114.11 1bjx n ASP 193 Ca 0.11 0.00 -0.12 0.00 -1.51 0.00 0.00 54.79 53.26 1bjx n ASP 193 Cb 0.38 0.00 -0.05 0.00 2.34 0.00 0.00 41.12 43.78 1bjx n ASP 193 CO 0.00 0.00 0.00 -0.08 0.12 0.00 0.00 177.20 177.24 1bjx h GLU 194 N 0.00 -0.41 0.00 -0.67 4.22 -1.93 -3.47 114.58 112.32 1bjx h GLU 194 Ca 0.00 0.03 0.00 0.00 0.08 0.00 0.00 59.36 59.47 1bjx h GLU 194 Cb 0.00 0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.34 1bjx h GLU 194 CO 0.00 -0.27 0.00 0.41 -2.18 0.00 0.00 179.01 176.97 1bjx n GLY 195 N -1.36 1.74 3.44 1.92 0.00 -1.20 -5.05 105.19 104.68 1bjx n GLY 195 Ca -0.06 -0.09 -0.22 0.00 0.00 0.00 0.00 46.02 45.65 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 1.72 0.00 1.61 3.00 -1.26 -2.32 118.95 121.70 1bjx s ARG 196 Ca 0.00 -2.00 0.00 0.00 0.00 0.00 0.00 55.73 53.73 1bjx s ARG 196 Cb 0.00 -0.57 0.00 0.00 0.00 0.00 0.00 34.95 34.38 1bjx s ARG 196 CO 0.00 -0.36 0.00 0.09 0.00 0.00 0.00 175.30 175.03 1bjx n ASN 197 N -0.94 1.13 -2.44 0.23 3.02 -1.25 -4.97 115.26 110.04 1bjx n ASN 197 Ca -0.03 0.00 -0.02 0.00 -0.03 0.00 0.00 54.58 54.50 1bjx n ASN 197 Cb 0.66 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.81 1bjx n ASN 197 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1bjx n ASN 198 N -1.82 -4.19 -4.78 6.41 2.85 -1.26 -4.97 115.26 107.50 1bjx n ASN 198 Ca 0.00 1.13 -0.39 0.00 -0.11 0.00 0.00 54.58 55.21 1bjx n ASN 198 Cb 0.15 -4.48 -0.06 0.00 1.24 0.00 0.00 39.78 36.63 1bjx n ASN 198 CO 0.00 0.00 0.00 0.12 -2.11 0.00 0.00 177.26 175.27 1bjx s PHE 199 N -0.99 3.73 0.00 1.20 2.19 0.87 -5.01 117.98 119.97 1bjx s PHE 199 Ca -0.10 1.23 0.00 0.00 0.33 0.00 0.00 56.93 58.39 1bjx s PHE 199 Cb 0.01 -2.57 0.00 0.00 -1.31 0.00 0.00 43.02 39.15 1bjx s PHE 199 CO 0.64 0.43 0.00 0.39 1.83 0.00 0.00 175.22 178.51 1bjx n GLU 200 N 2.37 3.55 0.00 10.12 1.02 -1.26 -4.07 120.64 132.37 1bjx n GLU 200 Ca -0.08 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.06 1bjx n GLU 200 Cb 0.51 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.93 1bjx n GLU 200 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1bjx n GLY 201 N 4.75 3.64 3.20 0.62 0.00 -1.26 -4.48 105.19 111.66 1bjx n GLY 201 Ca 0.00 -0.04 -0.31 0.00 0.00 0.00 0.00 46.02 45.67 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 2.86 -1.30 1.61 2.56 -1.26 -5.02 118.70 118.15 1bjx s GLU 202 Ca 0.00 -0.83 -0.08 0.00 0.00 0.00 0.00 54.97 54.06 1bjx s GLU 202 Cb 0.00 -2.18 -0.09 0.00 2.00 0.00 0.00 34.13 33.85 1bjx s GLU 202 CO 0.00 0.18 2.77 1.33 -0.56 0.00 0.00 175.26 178.97 1bjx n VAL 203 N 3.51 3.68 -3.42 3.70 0.24 -1.26 -4.71 118.33 120.08 1bjx n VAL 203 Ca -0.19 -2.17 -0.27 0.00 -2.04 0.00 0.00 64.34 59.66 1bjx n VAL 203 Cb 0.53 -2.43 -0.03 0.00 -1.47 0.00 0.00 33.84 30.44 1bjx n VAL 203 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 1bjx s THR 204 N 2.41 5.08 0.22 3.34 -4.23 -1.26 -4.33 115.64 116.88 1bjx s THR 204 Ca 0.61 -0.18 -0.10 0.00 -1.18 0.00 0.00 61.69 60.84 1bjx s THR 204 Cb 0.17 -3.77 0.22 0.00 1.34 0.00 0.00 72.50 70.45 1bjx s THR 204 CO -0.05 -0.36 1.65 0.50 -0.54 0.00 0.00 174.62 175.82 1bjx h LYS 205 N 1.47 0.10 -0.92 3.99 3.64 -1.91 0.95 116.57 123.89 1bjx h LYS 205 Ca -0.48 -0.01 0.12 0.00 -1.27 0.00 0.00 60.65 59.01 1bjx h LYS 205 Cb 1.20 -0.02 -0.08 0.00 -0.41 0.00 0.00 32.23 32.91 1bjx h LYS 205 CO 0.65 0.07 0.55 1.05 -2.27 0.00 0.00 179.45 179.50 1bjx h GLU 206 N 0.10 0.84 0.00 1.90 4.11 -1.95 0.28 114.58 119.86 1bjx h GLU 206 Ca 0.34 -0.05 -0.20 0.00 0.07 0.00 0.00 59.36 59.52 1bjx h GLU 206 Cb 0.55 -0.19 -0.03 0.00 0.50 0.00 0.00 28.75 29.58 1bjx h GLU 206 CO -0.57 0.56 -1.08 -0.91 0.07 0.00 0.00 179.01 177.08 1bjx h ASN 207 N 0.87 0.00 -0.03 3.06 2.35 -1.11 -3.28 115.58 117.43 1bjx h ASN 207 Ca 0.46 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 56.18 1bjx h ASN 207 Cb 0.49 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.86 1bjx h ASN 207 CO -0.28 0.84 -0.09 -0.07 -1.65 0.00 0.00 177.43 176.18 1bjx h LEU 208 N 0.00 0.14 -1.11 1.61 3.38 0.19 -0.94 115.31 118.57 1bjx h LEU 208 Ca -0.08 -0.60 0.15 0.00 0.09 0.00 0.00 57.88 57.43 1bjx h LEU 208 Cb 1.71 -0.04 -0.08 0.00 0.09 0.00 0.00 40.66 42.34 1bjx h LEU 208 CO 0.10 0.72 0.61 -0.07 0.09 0.00 0.00 178.44 179.88 1bjx h LEU 209 N -0.43 0.79 -0.01 1.67 3.38 -0.63 -1.64 115.31 118.44 1bjx h LEU 209 Ca -0.00 0.06 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 1bjx h LEU 209 Cb 0.70 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.35 1bjx h LEU 209 CO 0.02 0.38 -0.08 -0.78 0.09 0.00 0.00 178.44 178.08 1bjx h ASP 210 N 0.83 0.08 -0.27 -0.43 3.58 -1.61 -3.02 116.42 115.59 1bjx h ASP 210 Ca 0.50 -0.70 0.05 0.00 0.42 0.00 0.00 57.03 57.30 1bjx h ASP 210 Cb 0.68 -0.03 -0.08 0.00 1.72 0.00 0.00 39.33 41.63 1bjx h ASP 210 CO -0.27 0.78 -0.48 0.15 -2.88 0.00 0.00 179.24 176.54 1bjx h PHE 211 N -0.60 -1.40 -0.51 0.28 3.57 -0.49 1.18 116.94 118.96 1bjx h PHE 211 Ca -0.01 0.06 0.09 0.00 3.53 0.00 0.00 57.97 61.65 1bjx h PHE 211 Cb 0.78 0.65 -0.07 0.00 2.79 0.00 0.00 35.95 40.09 1bjx h PHE 211 CO 0.17 -0.49 0.08 0.82 -2.23 0.00 0.00 178.31 176.66 1bjx h ILE 212 N -0.44 0.68 -0.51 1.41 2.04 -1.43 -0.42 117.51 118.84 1bjx h ILE 212 Ca 0.09 -0.07 -0.09 0.00 1.00 0.00 0.00 64.86 65.78 1bjx h ILE 212 Cb 0.62 0.45 -0.02 0.00 -0.74 0.00 0.00 36.82 37.14 1bjx h ILE 212 CO -0.50 0.04 -0.03 0.50 0.00 0.00 0.00 178.15 178.15 1bjx h LYS 213 N 0.21 0.93 0.00 2.37 3.64 -1.10 -1.52 116.57 121.10 1bjx h LYS 213 Ca 0.26 -0.31 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 1bjx h LYS 213 Cb 0.37 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.11 1bjx h LYS 213 CO -0.36 0.97 0.00 0.45 -2.27 0.00 0.00 179.45 178.24 1bjx h HIS 214 N 0.79 0.00 0.00 1.91 3.86 0.25 -3.14 115.15 118.82 1bjx h HIS 214 Ca 0.14 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.35 1bjx h HIS 214 Cb 0.57 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.04 1bjx h HIS 214 CO 0.04 0.00 -0.43 -0.91 0.86 0.00 0.00 177.93 177.49 1bjx h ASN 215 N 0.00 0.00 -2.72 2.45 -0.26 -0.46 -3.48 115.58 111.11 1bjx h ASN 215 Ca 0.00 0.00 -0.56 0.00 -0.56 0.00 0.00 56.30 55.18 1bjx h ASN 215 Cb 0.10 0.00 0.21 0.00 -1.06 0.00 0.00 38.32 37.57 1bjx h ASN 215 CO 0.00 0.68 -0.96 1.67 -1.06 0.00 0.00 177.43 177.76 1bjx n GLN 216 N -4.46 0.05 -2.81 0.81 7.27 -0.63 -4.20 117.38 113.41 1bjx n GLN 216 Ca -0.06 0.04 -0.01 0.00 0.07 0.00 0.00 57.00 57.04 1bjx n GLN 216 Cb 0.22 -1.47 -0.01 0.00 2.41 0.00 0.00 30.24 31.39 1bjx n GLN 216 CO 0.00 0.00 0.00 1.28 0.07 0.00 0.00 177.06 178.41 1bjx n LEU 217 N 0.99 -6.62 -3.95 1.69 4.77 -1.26 -4.69 117.00 107.93 1bjx n LEU 217 Ca 0.06 1.41 -0.39 0.00 -0.03 0.00 0.00 56.01 57.05 1bjx n LEU 217 Cb 0.52 -2.90 -0.05 0.00 -2.33 0.00 0.00 43.42 38.66 1bjx n LEU 217 CO 0.52 -3.06 1.99 -0.81 -1.33 0.00 0.00 177.39 174.70 1bjx n PRO 218 N 1.15 1.75 -3.28 3.23 -0.04 -1.26 -4.71 135.00 131.84 1bjx n PRO 218 Ca -0.09 -2.17 -0.26 0.00 -0.04 0.00 0.00 63.50 60.94 1bjx n PRO 218 Cb 0.23 -3.21 -0.07 0.00 -0.04 0.00 0.00 33.50 30.41 1bjx n PRO 218 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1bjx n LEU 219 N 9.29 2.90 -3.78 1.53 4.77 -1.26 -4.97 117.00 125.47 1bjx n LEU 219 Ca 0.49 -5.29 -0.28 0.00 -0.03 0.00 0.00 56.01 50.90 1bjx n LEU 219 Cb 0.42 -0.27 -0.11 0.00 -2.33 0.00 0.00 43.42 41.13 1bjx n LEU 219 CO 0.91 2.12 -0.02 0.55 -1.33 0.00 0.00 177.39 179.63 1bjx n VAL 220 N 0.77 1.69 -3.65 4.08 3.14 -1.26 -5.02 118.33 118.08 1bjx n VAL 220 Ca 0.28 -4.89 -0.03 0.00 -2.96 0.00 0.00 64.34 56.73 1bjx n VAL 220 Cb 0.45 -2.15 -0.05 0.00 -1.06 0.00 0.00 33.84 31.03 1bjx n VAL 220 CO 0.00 0.00 0.00 -0.51 -6.46 0.00 0.00 176.83 169.86 1bjx s ILE 221 N -1.64 -0.61 0.30 1.55 2.07 -1.26 -5.03 121.20 116.58 1bjx s ILE 221 Ca 0.28 0.00 0.00 0.00 -1.41 0.00 0.00 60.65 59.52 1bjx s ILE 221 Cb 0.00 -1.00 0.00 0.00 0.13 0.00 0.00 42.46 41.59 1bjx s ILE 221 CO -0.14 0.00 0.00 1.21 -1.91 0.00 0.00 174.94 174.10 1bjx n GLU 222 N 5.01 0.00 0.02 3.50 4.07 -1.26 -5.04 120.64 126.94 1bjx n GLU 222 Ca -0.15 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 56.95 1bjx n GLU 222 Cb 0.53 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.91 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 -3.26 -0.28 -3.50 4.31 3.72 -1.26 -5.08 117.46 112.12 1bjx n PHE 223 Ca 0.00 0.05 -0.30 0.00 -0.05 0.00 0.00 57.45 57.15 1bjx n PHE 223 Cb 0.00 0.21 -0.04 0.00 -0.94 0.00 0.00 39.48 38.71 1bjx n PHE 223 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 1bjx s THR 224 N -2.00 5.07 -0.28 4.37 -4.23 -1.26 -5.01 115.64 112.30 1bjx s THR 224 Ca 0.00 0.08 0.08 0.00 -1.18 0.00 0.00 61.69 60.68 1bjx s THR 224 Cb 0.00 -3.67 0.46 0.00 1.34 0.00 0.00 72.50 70.62 1bjx s THR 224 CO 0.00 -0.14 1.33 -1.84 -0.54 0.00 0.00 174.62 173.43 1bjx n GLU 225 N -0.42 2.32 -3.32 3.99 0.00 -1.26 -4.86 120.64 117.09 1bjx n GLU 225 Ca -0.02 -3.54 -0.10 0.00 0.00 0.00 0.00 57.16 53.51 1bjx n GLU 225 Cb 0.53 -1.91 0.00 0.00 0.00 0.00 0.00 31.44 30.06 1bjx n GLU 225 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.13 178.07 1bjx n GLN 226 N -0.99 -1.41 0.27 3.44 7.27 -1.26 -4.83 117.38 119.88 1bjx n GLN 226 Ca 0.33 1.20 0.11 0.00 0.07 0.00 0.00 57.00 58.71 1bjx n GLN 226 Cb 0.87 -4.61 0.75 0.00 2.41 0.00 0.00 30.24 29.67 1bjx n GLN 226 CO 0.00 0.00 0.00 1.15 0.07 0.00 0.00 177.06 178.28 1bjx h THR 227 N 0.07 0.78 -0.01 1.69 2.02 -2.02 -3.57 112.91 111.87 1bjx h THR 227 Ca -0.25 -0.10 0.00 0.00 0.77 0.00 0.00 66.41 66.84 1bjx h THR 227 Cb 1.15 1.06 0.00 0.00 -1.74 0.00 0.00 68.15 68.62 1bjx h THR 227 CO 0.33 0.03 0.00 0.00 0.37 0.00 0.00 175.52 176.25