#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bjx n ALA 120 N 0.00 0.00 -2.97 0.00 0.00 -1.26 -4.63 120.51 111.65 1bjx n ALA 120 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.33 1bjx n ALA 120 Cb 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.36 1bjx n ALA 120 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 1bjx s THR 121 N 0.83 0.10 -0.14 0.00 -1.32 -1.22 -4.89 115.64 108.99 1bjx s THR 121 Ca 0.00 -0.82 -0.24 0.00 -1.21 0.00 0.00 61.69 59.42 1bjx s THR 121 Cb 0.00 -0.67 -0.02 0.00 -1.51 0.00 0.00 72.50 70.30 1bjx s THR 121 CO 0.00 -0.45 0.75 -0.89 -2.21 0.00 0.00 174.62 171.81 1bjx s THR 122 N -1.97 4.96 -0.07 5.08 2.01 -1.23 0.17 115.64 124.60 1bjx s THR 122 Ca -0.10 1.47 -0.21 0.00 0.31 0.00 0.00 61.69 63.16 1bjx s THR 122 Cb -0.04 -4.06 -0.04 0.00 0.01 0.00 0.00 72.50 68.36 1bjx s THR 122 CO -0.01 0.11 0.62 -0.76 -0.69 0.00 0.00 174.62 173.89 1bjx s LEU 123 N 1.69 4.32 -0.05 4.42 1.43 0.36 -4.92 118.68 125.92 1bjx s LEU 123 Ca 0.36 1.08 -0.25 0.00 -1.03 0.00 0.00 54.13 54.28 1bjx s LEU 123 Cb -0.17 -2.94 -0.20 0.00 0.03 0.00 0.00 46.19 42.91 1bjx s LEU 123 CO 0.14 -0.04 1.06 1.55 0.23 0.00 0.00 176.35 179.28 1bjx h PRO 124 N 6.55 -0.06 0.00 1.29 0.13 -1.96 -3.33 132.00 134.62 1bjx h PRO 124 Ca -0.42 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 1bjx h PRO 124 Cb 1.19 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1bjx h PRO 124 CO 0.74 0.52 0.00 -0.40 -0.23 0.00 0.00 178.00 178.63 1bjx n ASP 125 N -4.82 0.00 0.19 1.44 5.68 -1.26 -4.66 116.55 113.11 1bjx n ASP 125 Ca -0.09 -0.94 0.05 0.00 -0.50 0.00 0.00 54.79 53.31 1bjx n ASP 125 Cb 0.30 0.00 0.35 0.00 -1.14 0.00 0.00 41.12 40.63 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 1.85 6.12 0.00 -1.91 -2.79 103.07 106.34 1bjx h GLY 126 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 47.33 47.35 1bjx h GLY 126 CO 0.00 0.00 0.06 0.00 0.00 0.00 0.00 176.54 176.60 1bjx h ALA 127 N 1.61 1.82 0.00 3.60 0.00 -1.95 -0.80 119.26 123.55 1bjx h ALA 127 Ca -0.00 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 1bjx h ALA 127 Cb 0.84 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 1bjx h ALA 127 CO 0.05 -0.09 -1.09 0.00 0.00 0.00 0.00 179.25 178.12 1bjx n ALA 128 N -2.43 2.39 0.20 0.00 0.00 -1.06 -3.29 120.51 116.33 1bjx n ALA 128 Ca -0.01 -0.30 0.10 0.00 0.00 0.00 0.00 53.44 53.22 1bjx n ALA 128 Cb 0.16 -1.08 0.22 0.00 0.00 0.00 0.00 19.45 18.75 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 1.87 0.91 0.12 0.00 0.00 -1.12 -3.21 119.26 117.82 1bjx h ALA 129 Ca -0.04 -0.15 -0.36 0.00 0.00 0.00 0.00 54.91 54.36 1bjx h ALA 129 Cb 1.13 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.87 1bjx h ALA 129 CO 0.01 0.21 -1.95 -1.91 0.00 0.00 0.00 179.25 175.61 1bjx n GLU 130 N -3.17 0.75 0.09 0.00 2.13 -0.92 -3.94 120.64 115.59 1bjx n GLU 130 Ca 0.03 0.28 0.12 0.00 0.66 0.00 0.00 57.16 58.25 1bjx n GLU 130 Cb 0.55 -1.71 0.60 0.00 0.27 0.00 0.00 31.44 31.15 1bjx n GLU 130 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 1bjx h SER 131 N -0.01 0.13 -0.28 4.31 0.87 -1.63 -2.04 113.55 114.90 1bjx h SER 131 Ca -0.42 0.00 -0.09 0.00 -1.23 0.00 0.00 61.79 60.05 1bjx h SER 131 Cb 1.98 -0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 63.91 1bjx h SER 131 CO 0.07 0.08 -0.16 0.25 -0.53 0.00 0.00 176.83 176.54 1bjx h LEU 132 N 0.14 0.62 -0.19 2.23 5.85 -1.69 -0.92 115.31 121.36 1bjx h LEU 132 Ca 0.14 -0.42 0.05 0.00 0.84 0.00 0.00 57.88 58.49 1bjx h LEU 132 Cb 0.38 -0.17 -0.07 0.00 0.37 0.00 0.00 40.66 41.17 1bjx h LEU 132 CO -0.02 0.91 -0.28 0.58 -0.34 0.00 0.00 178.44 179.29 1bjx h VAL 133 N 0.33 0.35 0.00 1.05 2.07 -1.49 -0.37 116.25 118.19 1bjx h VAL 133 Ca 0.06 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.58 1bjx h VAL 133 Cb 0.69 0.35 0.00 0.00 -1.52 0.00 0.00 31.29 30.81 1bjx h VAL 133 CO 0.05 0.00 0.00 -0.33 0.02 0.00 0.00 177.57 177.31 1bjx h GLU 134 N -0.32 0.00 -0.96 1.57 5.08 -1.57 -3.22 114.58 115.17 1bjx h GLU 134 Ca 0.12 0.00 0.15 0.00 -1.00 0.00 0.00 59.36 58.63 1bjx h GLU 134 Cb 0.50 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 29.66 1bjx h GLU 134 CO -0.37 0.00 0.61 0.66 -1.00 0.00 0.00 179.01 178.91 1bjx h SER 135 N 0.00 0.76 -2.36 1.42 4.64 0.41 -3.45 113.55 114.97 1bjx h SER 135 Ca 0.00 0.06 -0.09 0.00 -0.47 0.00 0.00 61.79 61.29 1bjx h SER 135 Cb 0.68 -0.09 -0.02 0.00 -0.31 0.00 0.00 62.40 62.66 1bjx h SER 135 CO 0.00 0.35 -0.06 -1.54 -0.87 0.00 0.00 176.83 174.72 1bjx n SER 136 N -4.63 -0.36 -0.02 4.97 3.41 -1.21 -5.06 113.62 110.71 1bjx n SER 136 Ca 0.20 -1.56 -0.15 0.00 -0.26 0.00 0.00 58.87 57.09 1bjx n SER 136 Cb 0.48 0.69 -0.10 0.00 -0.26 0.00 0.00 64.21 65.03 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 0.33 -6.66 4.33 4.57 -1.87 -3.45 114.58 111.83 1bjx h GLU 137 Ca -0.08 -0.29 -0.66 0.00 -1.18 0.00 0.00 59.36 57.15 1bjx h GLU 137 Cb 0.34 0.07 -0.18 0.00 -0.16 0.00 0.00 28.75 28.82 1bjx h GLU 137 CO 0.11 0.95 -0.79 0.14 -1.18 0.00 0.00 179.01 178.23 1bjx s VAL 138 N -3.50 2.79 -0.30 0.32 -7.23 -1.26 -2.78 120.40 108.45 1bjx s VAL 138 Ca -0.14 -1.64 -0.16 0.00 -1.81 0.00 0.00 61.98 58.22 1bjx s VAL 138 Cb 0.03 -2.31 0.19 0.00 0.56 0.00 0.00 36.38 34.85 1bjx s VAL 138 CO 0.78 0.02 1.16 0.00 -0.31 0.00 0.00 175.10 176.75 1bjx s ALA 139 N -1.34 -2.68 0.15 1.32 0.00 -0.62 -4.27 121.76 114.32 1bjx s ALA 139 Ca 0.20 2.01 0.07 0.00 0.00 0.00 0.00 51.96 54.24 1bjx s ALA 139 Cb -0.10 -1.98 -0.04 0.00 0.00 0.00 0.00 23.12 21.01 1bjx s ALA 139 CO 0.11 -0.51 -0.02 0.54 0.00 0.00 0.00 175.76 175.88 1bjx s VAL 140 N 1.46 3.71 -0.11 0.00 0.11 -1.22 0.16 120.40 124.51 1bjx s VAL 140 Ca -0.06 -1.32 -0.04 0.00 -2.93 0.00 0.00 61.98 57.63 1bjx s VAL 140 Cb -0.03 -2.83 0.05 0.00 -1.53 0.00 0.00 36.38 32.04 1bjx s VAL 140 CO -0.13 -0.03 0.08 -0.63 -3.33 0.00 0.00 175.10 171.05 1bjx s ILE 141 N -1.57 -0.10 0.02 7.04 1.01 -0.71 -1.36 121.20 125.53 1bjx s ILE 141 Ca 0.26 0.12 -0.27 0.00 0.00 0.00 0.00 60.65 60.76 1bjx s ILE 141 Cb -0.10 -0.37 -0.04 0.00 0.01 0.00 0.00 42.46 41.95 1bjx s ILE 141 CO 0.18 -0.06 0.84 -0.83 0.00 0.00 0.00 174.94 175.07 1bjx s GLY 142 N 2.15 2.83 -0.75 6.18 0.00 -0.31 -2.97 107.32 114.45 1bjx s GLY 142 Ca 0.03 0.37 -0.14 0.00 0.00 0.00 0.00 44.72 44.99 1bjx s GLY 142 CO -0.06 1.34 0.69 -1.36 0.00 0.00 0.00 173.10 173.71 1bjx s PHE 143 N 0.42 3.64 0.07 1.90 0.40 0.28 -0.40 117.98 124.28 1bjx s PHE 143 Ca 0.43 -1.88 0.07 0.00 -0.60 0.00 0.00 56.93 54.95 1bjx s PHE 143 Cb -0.21 -3.78 -0.04 0.00 0.51 0.00 0.00 43.02 39.51 1bjx s PHE 143 CO 0.25 -0.99 -0.15 -0.06 0.70 0.00 0.00 175.22 174.97 1bjx s PHE 144 N 0.47 2.64 -0.10 0.36 0.08 -0.75 -1.58 117.98 119.09 1bjx s PHE 144 Ca 0.15 -0.21 0.16 0.00 0.12 0.00 0.00 56.93 57.15 1bjx s PHE 144 Cb -0.15 -1.45 -0.17 0.00 -0.57 0.00 0.00 43.02 40.69 1bjx s PHE 144 CO -0.06 0.34 0.75 0.36 -0.10 0.00 0.00 175.22 176.51 1bjx n LYS 145 N 1.17 0.63 -3.38 0.44 2.85 -1.26 -3.55 118.16 115.05 1bjx n LYS 145 Ca -0.15 0.22 -0.27 0.00 -1.05 0.00 0.00 58.31 57.07 1bjx n LYS 145 Cb 0.52 -1.79 -0.10 0.00 -0.65 0.00 0.00 35.03 33.02 1bjx n LYS 145 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 177.40 176.95 1bjx n ASP 146 N -2.91 -0.23 0.17 -5.58 5.75 -1.26 -4.85 116.55 107.64 1bjx n ASP 146 Ca -0.12 -2.46 0.18 0.00 -0.01 0.00 0.00 54.79 52.38 1bjx n ASP 146 Cb 0.90 -0.57 0.68 0.00 -1.03 0.00 0.00 41.12 41.10 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 4.23 0.17 0.00 2.12 -1.51 -1.87 0.51 116.25 119.90 1bjx h VAL 147 Ca 0.24 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.71 1bjx h VAL 147 Cb 0.90 0.54 0.00 0.00 -2.13 0.00 0.00 31.29 30.60 1bjx h VAL 147 CO 0.40 0.00 0.00 -0.62 -1.23 0.00 0.00 177.57 176.12 1bjx n GLU 148 N -3.28 0.40 0.00 5.19 1.02 -1.26 -4.23 120.64 118.49 1bjx n GLU 148 Ca 0.05 0.07 0.00 0.00 -0.02 0.00 0.00 57.16 57.26 1bjx n GLU 148 Cb 0.66 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.58 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 -1.18 -0.07 -0.08 1.62 3.41 0.18 -4.96 113.62 112.55 1bjx n SER 149 Ca 0.11 -0.44 -0.22 0.00 -0.26 0.00 0.00 58.87 58.06 1bjx n SER 149 Cb 0.12 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 63.95 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 -1.42 1.93 -0.04 4.04 2.03 -1.26 -3.58 116.55 118.25 1bjx n ASP 150 Ca 0.00 0.37 0.24 0.00 0.52 0.00 0.00 54.79 55.92 1bjx n ASP 150 Cb 0.00 -0.94 0.71 0.00 -0.72 0.00 0.00 41.12 40.17 1bjx n ASP 150 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 1bjx h SER 151 N -0.73 0.00 0.23 1.67 0.02 -1.93 0.48 113.55 113.29 1bjx h SER 151 Ca -0.38 0.00 -0.33 0.00 -0.84 0.00 0.00 61.79 60.24 1bjx h SER 151 Cb 1.50 0.00 0.03 0.00 0.14 0.00 0.00 62.40 64.07 1bjx h SER 151 CO -0.14 0.00 -1.48 0.00 -1.14 0.00 0.00 176.83 174.07 1bjx h ALA 152 N 1.44 -0.10 -0.61 3.77 0.00 -1.80 -3.33 119.26 118.63 1bjx h ALA 152 Ca 0.31 -0.90 0.12 0.00 0.00 0.00 0.00 54.91 54.44 1bjx h ALA 152 Cb 1.48 0.23 -0.09 0.00 0.00 0.00 0.00 17.79 19.41 1bjx h ALA 152 CO -0.00 0.73 0.10 0.87 0.00 0.00 0.00 179.25 180.94 1bjx h LYS 153 N 0.09 0.21 -0.77 0.00 1.57 -0.96 0.32 116.57 117.03 1bjx h LYS 153 Ca -0.27 -0.01 0.17 0.00 -1.87 0.00 0.00 60.65 58.67 1bjx h LYS 153 Cb 2.11 -0.05 -0.05 0.00 0.08 0.00 0.00 32.23 34.32 1bjx h LYS 153 CO 0.24 0.14 0.52 1.96 -0.57 0.00 0.00 179.45 181.75 1bjx h GLN 154 N 0.22 0.34 0.44 3.15 1.08 -1.63 -1.87 115.11 116.84 1bjx h GLN 154 Ca 0.33 -0.02 -0.02 0.00 -1.45 0.00 0.00 58.65 57.48 1bjx h GLN 154 Cb 0.51 -0.08 0.00 0.00 -0.05 0.00 0.00 27.48 27.86 1bjx h GLN 154 CO -0.44 0.22 -0.21 0.35 -0.95 0.00 0.00 178.83 177.80 1bjx h PHE 155 N 0.35 -0.55 -0.46 2.96 3.57 -0.50 -2.63 116.94 119.67 1bjx h PHE 155 Ca 0.38 -0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.95 1bjx h PHE 155 Cb 0.99 0.18 -0.10 0.00 2.79 0.00 0.00 35.95 39.82 1bjx h PHE 155 CO -0.00 -0.23 -0.40 -0.07 -2.23 0.00 0.00 178.31 175.38 1bjx h LEU 156 N -0.94 -1.34 -0.63 0.59 4.07 -0.86 0.37 115.31 116.57 1bjx h LEU 156 Ca -0.06 0.22 0.12 0.00 0.08 0.00 0.00 57.88 58.24 1bjx h LEU 156 Cb 0.57 0.61 -0.09 0.00 1.08 0.00 0.00 40.66 42.83 1bjx h LEU 156 CO 0.10 -0.35 0.13 1.56 -1.08 0.00 0.00 178.44 178.80 1bjx h GLN 157 N -0.27 0.24 -0.30 1.13 4.20 -1.47 0.56 115.11 119.20 1bjx h GLN 157 Ca 0.16 -0.01 -0.04 0.00 0.06 0.00 0.00 58.65 58.82 1bjx h GLN 157 Cb 0.57 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.28 1bjx h GLN 157 CO -0.60 0.16 0.04 0.00 -0.67 0.00 0.00 178.83 177.76 1bjx h ALA 158 N 1.51 0.40 -0.87 3.87 0.00 -0.63 -0.94 119.26 122.59 1bjx h ALA 158 Ca 0.33 -0.20 0.08 0.00 0.00 0.00 0.00 54.91 55.13 1bjx h ALA 158 Cb 0.51 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 18.13 1bjx h ALA 158 CO -0.43 0.09 0.57 0.00 0.00 0.00 0.00 179.25 179.48 1bjx h ALA 159 N 0.87 1.60 0.00 0.00 0.00 0.84 -0.56 119.26 122.01 1bjx h ALA 159 Ca 0.09 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.85 1bjx h ALA 159 Cb 0.35 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1bjx h ALA 159 CO 0.01 0.25 -0.63 0.93 0.00 0.00 0.00 179.25 179.81 1bjx h GLU 160 N 0.92 0.00 -0.84 0.00 5.08 -0.64 -3.21 114.58 115.90 1bjx h GLU 160 Ca 0.39 0.00 0.08 0.00 -1.00 0.00 0.00 59.36 58.83 1bjx h GLU 160 Cb 0.30 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.49 1bjx h GLU 160 CO -0.15 0.63 0.50 0.00 -1.00 0.00 0.00 179.01 178.99 1bjx h ALA 161 N 1.37 1.17 -2.65 3.43 0.00 0.31 -3.42 119.26 119.48 1bjx h ALA 161 Ca -0.01 0.01 -0.56 0.00 0.00 0.00 0.00 54.91 54.35 1bjx h ALA 161 Cb 1.25 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.83 1bjx h ALA 161 CO 0.08 0.19 -0.33 -1.50 0.00 0.00 0.00 179.25 177.68 1bjx s ILE 162 N -6.05 5.20 -0.03 0.00 2.07 -1.17 -5.00 121.20 116.22 1bjx s ILE 162 Ca -0.12 -0.18 0.04 0.00 -1.41 0.00 0.00 60.65 58.98 1bjx s ILE 162 Cb 0.19 -3.67 0.07 0.00 0.13 0.00 0.00 42.46 39.17 1bjx s ILE 162 CO 0.79 -0.05 0.91 0.47 -1.91 0.00 0.00 174.94 175.14 1bjx n ASP 163 N -0.24 0.96 -0.10 4.50 9.92 -1.26 -4.75 116.55 125.58 1bjx n ASP 163 Ca -0.04 -2.00 0.05 0.00 -0.53 0.00 0.00 54.79 52.28 1bjx n ASP 163 Cb 0.53 -0.16 0.07 0.00 -0.64 0.00 0.00 41.12 40.91 1bjx n ASP 163 CO 0.00 0.00 0.00 -0.67 0.13 0.00 0.00 177.20 176.66 1bjx n ASP 164 N -0.44 1.77 -4.10 -2.24 2.03 -1.26 -5.03 116.55 107.27 1bjx n ASP 164 Ca 0.04 -2.45 -0.17 0.00 0.52 0.00 0.00 54.79 52.72 1bjx n ASP 164 Cb 0.54 -0.24 -0.13 0.00 -0.72 0.00 0.00 41.12 40.58 1bjx n ASP 164 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1bjx s ILE 165 N -1.72 0.86 -1.27 5.18 -1.09 -1.26 -5.06 121.20 116.84 1bjx s ILE 165 Ca 0.16 -0.93 -0.16 0.00 -2.23 0.00 0.00 60.65 57.49 1bjx s ILE 165 Cb 0.14 -0.81 0.11 0.00 -1.58 0.00 0.00 42.46 40.32 1bjx s ILE 165 CO 0.01 -0.09 1.66 -0.81 -1.23 0.00 0.00 174.94 174.48 1bjx n PRO 166 N 1.90 3.27 -2.60 2.79 -0.04 -1.26 -4.99 135.00 134.07 1bjx n PRO 166 Ca -0.19 -3.48 -0.41 0.00 -0.04 0.00 0.00 63.50 59.38 1bjx n PRO 166 Cb 0.55 -3.28 -0.04 0.00 -0.04 0.00 0.00 33.50 30.70 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 2.91 3.68 0.06 0.54 0.40 -1.26 -3.46 117.98 120.84 1bjx s PHE 167 Ca 0.48 1.67 0.02 0.00 -0.60 0.00 0.00 56.93 58.50 1bjx s PHE 167 Cb 0.02 -3.19 -0.03 0.00 0.51 0.00 0.00 43.02 40.33 1bjx s PHE 167 CO 0.04 -0.31 -0.07 0.20 0.70 0.00 0.00 175.22 175.77 1bjx s GLY 168 N -0.01 0.59 0.08 4.36 0.00 -0.47 -3.44 107.32 108.44 1bjx s GLY 168 Ca 0.49 -0.97 0.05 0.00 0.00 0.00 0.00 44.72 44.29 1bjx s GLY 168 CO 0.32 -1.04 -0.14 -1.50 0.00 0.00 0.00 173.10 170.74 1bjx s ILE 169 N -2.20 1.11 0.05 0.90 2.07 0.46 -1.16 121.20 122.43 1bjx s ILE 169 Ca -0.02 -1.38 0.09 0.00 -1.41 0.00 0.00 60.65 57.92 1bjx s ILE 169 Cb -0.04 -1.15 -0.03 0.00 0.13 0.00 0.00 42.46 41.37 1bjx s ILE 169 CO -0.02 -0.28 -0.25 -0.89 -1.91 0.00 0.00 174.94 171.59 1bjx s THR 170 N -1.50 2.25 -0.02 4.00 2.01 0.46 0.13 115.64 122.99 1bjx s THR 170 Ca -0.00 -1.37 0.03 0.00 0.31 0.00 0.00 61.69 60.66 1bjx s THR 170 Cb -0.09 -1.89 0.04 0.00 0.01 0.00 0.00 72.50 70.57 1bjx s THR 170 CO 0.02 0.36 0.83 -0.24 -0.69 0.00 0.00 174.62 174.89 1bjx n SER 171 N 1.72 0.96 -4.67 3.53 2.88 -1.23 -1.80 113.62 115.01 1bjx n SER 171 Ca -0.17 -1.76 -0.23 0.00 -1.33 0.00 0.00 58.87 55.38 1bjx n SER 171 Cb 0.52 -0.09 -0.07 0.00 -0.75 0.00 0.00 64.21 63.82 1bjx n SER 171 CO 0.00 0.00 0.00 0.21 -1.23 0.00 0.00 175.04 174.02 1bjx s ASN 172 N -0.86 4.63 0.11 -3.46 2.47 -1.26 -4.81 114.94 111.75 1bjx s ASN 172 Ca 0.04 -0.64 0.11 0.00 0.42 0.00 0.00 52.86 52.79 1bjx s ASN 172 Cb 0.04 -0.87 -0.15 0.00 -1.45 0.00 0.00 41.25 38.83 1bjx s ASN 172 CO 0.00 -0.05 1.13 -1.28 -3.72 0.00 0.00 177.10 173.19 1bjx h SER 173 N 1.81 0.00 -0.70 -4.21 0.87 -1.93 -3.27 113.55 106.12 1bjx h SER 173 Ca -0.44 0.00 0.17 0.00 -1.23 0.00 0.00 61.79 60.29 1bjx h SER 173 Cb 1.25 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 63.17 1bjx h SER 173 CO 0.61 0.84 0.48 0.44 -0.53 0.00 0.00 176.83 178.67 1bjx h ASP 174 N 0.00 0.18 0.67 6.23 5.19 -1.96 0.50 116.42 127.24 1bjx h ASP 174 Ca -0.08 0.01 -0.20 0.00 -0.62 0.00 0.00 57.03 56.14 1bjx h ASP 174 Cb 1.72 -0.02 -0.01 0.00 0.18 0.00 0.00 39.33 41.19 1bjx h ASP 174 CO 0.10 0.09 -0.91 0.58 -3.12 0.00 0.00 179.24 175.97 1bjx h VAL 175 N 0.19 1.54 0.47 -1.35 2.07 -1.84 -2.67 116.25 114.66 1bjx h VAL 175 Ca 0.34 -2.78 -0.02 0.00 0.82 0.00 0.00 66.70 65.06 1bjx h VAL 175 Cb 1.06 2.56 0.00 0.00 -1.52 0.00 0.00 31.29 33.40 1bjx h VAL 175 CO -0.06 0.81 -0.23 -0.26 0.02 0.00 0.00 177.57 177.85 1bjx h PHE 176 N 0.07 -0.59 -0.26 1.57 -1.00 -0.23 -2.88 116.94 113.63 1bjx h PHE 176 Ca -0.04 -0.01 0.07 0.00 2.81 0.00 0.00 57.97 60.80 1bjx h PHE 176 Cb 1.56 0.19 -0.01 0.00 3.61 0.00 0.00 35.95 41.31 1bjx h PHE 176 CO 0.02 -0.32 0.40 0.77 -1.61 0.00 0.00 178.31 177.57 1bjx h SER 177 N -1.13 0.00 0.82 2.17 0.02 -0.91 0.14 113.55 114.67 1bjx h SER 177 Ca -0.06 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 60.84 1bjx h SER 177 Cb 0.53 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.08 1bjx h SER 177 CO 0.11 0.00 -0.39 0.50 -1.14 0.00 0.00 176.83 175.90 1bjx h LYS 178 N 0.00 -1.06 -0.30 3.45 3.11 -1.25 -3.01 116.57 117.50 1bjx h LYS 178 Ca 0.12 0.07 0.00 0.00 -2.81 0.00 0.00 60.65 58.03 1bjx h LYS 178 Cb 0.92 0.24 0.00 0.00 -1.00 0.00 0.00 32.23 32.39 1bjx h LYS 178 CO -0.00 -0.71 0.00 0.66 -2.81 0.00 0.00 179.45 176.59 1bjx n TYR 179 N -5.12 0.40 -3.53 1.91 4.02 -0.79 -4.94 117.16 109.11 1bjx n TYR 179 Ca -0.14 -0.20 -0.23 0.00 -0.01 0.00 0.00 57.90 57.32 1bjx n TYR 179 Cb 0.43 0.00 0.04 0.00 -0.02 0.00 0.00 39.34 39.79 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 0.48 -1.41 -3.41 -0.72 6.02 0.42 -4.94 117.38 113.82 1bjx n GLN 180 Ca 0.13 0.71 -0.38 0.00 -0.01 0.00 0.00 57.00 57.46 1bjx n GLN 180 Cb 0.31 -4.42 -0.06 0.00 1.02 0.00 0.00 30.24 27.08 1bjx n GLN 180 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1bjx s LEU 181 N -5.76 4.36 0.00 1.08 1.43 -1.14 -4.95 118.68 113.70 1bjx s LEU 181 Ca 0.35 0.86 0.20 0.00 -1.03 0.00 0.00 54.13 54.50 1bjx s LEU 181 Cb -0.11 -2.62 0.86 0.00 0.03 0.00 0.00 46.19 44.35 1bjx s LEU 181 CO 0.83 0.15 1.64 -0.67 0.23 0.00 0.00 176.35 178.53 1bjx n ASP 182 N 2.84 0.00 -0.59 2.29 -0.08 -1.26 -4.90 116.55 114.85 1bjx n ASP 182 Ca -0.11 0.47 0.00 0.00 -1.51 0.00 0.00 54.79 53.64 1bjx n ASP 182 Cb 0.52 -0.49 0.00 0.00 2.34 0.00 0.00 41.12 43.49 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 -1.49 0.00 -2.04 -0.67 2.85 -1.26 -5.15 118.16 110.41 1bjx n LYS 183 Ca 0.05 0.00 -0.34 0.00 -1.05 0.00 0.00 58.31 56.97 1bjx n LYS 183 Cb 0.23 0.00 0.02 0.00 -0.65 0.00 0.00 35.03 34.63 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 0.23 5.47 -0.11 -5.58 -1.08 -1.26 -4.97 116.67 109.37 1bjx s ASP 184 Ca 0.00 2.08 -0.33 0.00 -0.52 0.00 0.00 52.55 53.78 1bjx s ASP 184 Cb 0.00 -2.57 0.14 0.00 -1.46 0.00 0.00 42.92 39.03 1bjx s ASP 184 CO 0.00 -1.39 1.33 -0.83 0.52 0.00 0.00 175.17 174.80 1bjx s GLY 185 N -2.16 -0.39 -0.12 2.66 0.00 -0.61 -5.00 107.32 101.69 1bjx s GLY 185 Ca 0.70 1.10 0.01 0.00 0.00 0.00 0.00 44.72 46.52 1bjx s GLY 185 CO 0.33 0.28 -0.13 -1.34 0.00 0.00 0.00 173.10 172.25 1bjx s VAL 186 N -2.26 1.39 0.26 1.40 -7.23 -1.26 0.98 120.40 113.68 1bjx s VAL 186 Ca 0.13 -0.54 0.11 0.00 -1.81 0.00 0.00 61.98 59.88 1bjx s VAL 186 Cb 0.04 -1.31 -0.05 0.00 0.56 0.00 0.00 36.38 35.62 1bjx s VAL 186 CO -0.05 0.43 -0.16 -0.69 -0.31 0.00 0.00 175.10 174.32 1bjx s VAL 187 N 1.38 2.68 -0.08 1.32 1.01 -1.16 -3.03 120.40 122.52 1bjx s VAL 187 Ca 0.01 -2.22 -0.01 0.00 0.00 0.00 0.00 61.98 59.76 1bjx s VAL 187 Cb -0.13 -2.39 -0.03 0.00 0.00 0.00 0.00 36.38 33.82 1bjx s VAL 187 CO -0.07 -0.34 -0.00 -0.22 0.00 0.00 0.00 175.10 174.47 1bjx s LEU 188 N -3.38 3.54 -0.27 3.92 0.20 -1.26 -1.74 118.68 119.69 1bjx s LEU 188 Ca 0.29 0.12 0.00 0.00 0.69 0.00 0.00 54.13 55.23 1bjx s LEU 188 Cb -0.06 -1.81 0.05 0.00 -0.43 0.00 0.00 46.19 43.94 1bjx s LEU 188 CO 0.15 0.37 -0.07 -0.36 -0.29 0.00 0.00 176.35 176.16 1bjx s PHE 189 N -0.89 3.22 0.14 5.38 0.40 0.43 -3.44 117.98 123.21 1bjx s PHE 189 Ca 0.13 -2.02 0.00 0.00 -0.60 0.00 0.00 56.93 54.45 1bjx s PHE 189 Cb -0.11 -2.01 -0.00 0.00 0.51 0.00 0.00 43.02 41.40 1bjx s PHE 189 CO 0.03 -0.83 0.02 0.36 0.70 0.00 0.00 175.22 175.49 1bjx n LYS 190 N 4.54 1.32 -0.04 0.44 0.00 -0.94 -1.58 118.16 121.89 1bjx n LYS 190 Ca -0.14 -1.06 -0.01 0.00 -0.00 0.00 0.00 58.31 57.09 1bjx n LYS 190 Cb 0.44 0.40 -0.11 0.00 -0.00 0.00 0.00 35.03 35.75 1bjx n LYS 190 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 1bjx n LYS 191 N -0.33 1.25 -1.72 -1.58 5.02 -1.12 -4.65 118.16 115.04 1bjx n LYS 191 Ca -0.04 -0.06 -0.14 0.00 -2.02 0.00 0.00 58.31 56.04 1bjx n LYS 191 Cb 0.19 -1.35 0.08 0.00 -0.02 0.00 0.00 35.03 33.93 1bjx n LYS 191 CO 0.00 0.00 0.00 1.97 -0.52 0.00 0.00 177.40 178.85 1bjx n PHE 192 N -2.31 -3.23 -1.92 2.13 1.16 -1.26 -4.82 117.46 107.22 1bjx n PHE 192 Ca -0.14 -1.02 0.00 0.00 -1.87 0.00 0.00 57.45 54.41 1bjx n PHE 192 Cb 0.72 -0.47 0.00 0.00 -1.61 0.00 0.00 39.48 38.12 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 -3.02 -1.04 -0.27 5.98 8.00 -1.26 -2.66 116.55 122.28 1bjx n ASP 193 Ca 0.10 0.00 0.04 0.00 0.71 0.00 0.00 54.79 55.64 1bjx n ASP 193 Cb 0.36 0.00 0.18 0.00 -0.02 0.00 0.00 41.12 41.64 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 0.56 0.00 -1.24 4.22 -1.98 -3.46 114.58 112.68 1bjx h GLU 194 Ca 0.00 -0.03 0.00 0.00 0.08 0.00 0.00 59.36 59.41 1bjx h GLU 194 Cb 0.00 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.12 1bjx h GLU 194 CO 0.00 0.37 0.00 0.41 -2.18 0.00 0.00 179.01 177.61 1bjx n GLY 195 N -1.32 1.61 3.22 1.92 0.00 -1.09 -5.06 105.19 104.47 1bjx n GLY 195 Ca 0.14 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.04 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 -0.09 1.05 0.00 1.61 0.52 -1.26 -2.22 118.95 118.55 1bjx s ARG 196 Ca 0.00 -1.49 0.00 0.00 -0.52 0.00 0.00 55.73 53.72 1bjx s ARG 196 Cb 0.00 -0.18 0.00 0.00 0.52 0.00 0.00 34.95 35.29 1bjx s ARG 196 CO 0.00 -0.14 0.00 0.09 0.02 0.00 0.00 175.30 175.27 1bjx n ASN 197 N -0.19 0.13 -2.70 0.23 3.02 -1.22 -4.94 115.26 109.58 1bjx n ASN 197 Ca -0.07 0.00 -0.03 0.00 -0.03 0.00 0.00 54.58 54.45 1bjx n ASN 197 Cb 0.63 0.00 0.03 0.00 -0.61 0.00 0.00 39.78 39.83 1bjx n ASN 197 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1bjx s ASN 198 N 1.00 -0.52 -0.27 6.41 2.20 -1.26 -4.75 114.94 117.75 1bjx s ASN 198 Ca 0.00 -0.59 -0.40 0.00 -0.94 0.00 0.00 52.86 50.93 1bjx s ASN 198 Cb 0.00 0.68 -0.15 0.00 -2.00 0.00 0.00 41.25 39.78 1bjx s ASN 198 CO 0.00 -0.02 1.78 0.33 -2.94 0.00 0.00 177.10 176.25 1bjx n PHE 199 N 2.76 2.07 -3.76 1.54 7.35 -1.17 -4.90 117.46 121.35 1bjx n PHE 199 Ca 0.12 0.48 -0.35 0.00 -0.76 0.00 0.00 57.45 56.94 1bjx n PHE 199 Cb 0.63 -2.48 -0.10 0.00 0.35 0.00 0.00 39.48 37.88 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 3.72 2.48 0.00 -4.13 8.01 -1.26 -4.75 118.70 122.76 1bjx s GLU 200 Ca 0.99 -2.57 0.00 0.00 0.01 0.00 0.00 54.97 53.40 1bjx s GLU 200 Cb -1.04 -3.66 0.00 0.00 -4.31 0.00 0.00 34.13 25.12 1bjx s GLU 200 CO 0.64 -1.16 0.00 0.41 0.01 0.00 0.00 175.26 175.16 1bjx n GLY 201 N 3.39 -0.97 3.65 -1.39 0.00 -1.26 -5.09 105.19 103.52 1bjx n GLY 201 Ca 0.08 -1.08 -0.43 0.00 0.00 0.00 0.00 46.02 44.59 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 -1.56 4.09 -1.07 1.61 8.01 -1.26 -4.91 118.70 123.61 1bjx s GLU 202 Ca 0.00 1.53 -0.24 0.00 0.01 0.00 0.00 54.97 56.27 1bjx s GLU 202 Cb 0.00 -3.83 -0.11 0.00 -4.31 0.00 0.00 34.13 25.88 1bjx s GLU 202 CO 0.00 -0.90 2.02 0.54 0.01 0.00 0.00 175.26 176.93 1bjx s VAL 203 N 3.94 3.37 0.18 2.63 0.11 -1.26 -4.76 120.40 124.61 1bjx s VAL 203 Ca 0.57 -0.54 0.11 0.00 -2.93 0.00 0.00 61.98 59.19 1bjx s VAL 203 Cb -0.20 -4.19 -0.04 0.00 -1.53 0.00 0.00 36.38 30.42 1bjx s VAL 203 CO 0.19 -0.70 -0.23 0.42 -3.33 0.00 0.00 175.10 171.45 1bjx s THR 204 N 12.46 2.21 0.17 5.04 -4.23 -1.26 -4.73 115.64 125.29 1bjx s THR 204 Ca 0.74 -1.96 -0.24 0.00 -1.18 0.00 0.00 61.69 59.05 1bjx s THR 204 Cb -0.04 -2.03 0.06 0.00 1.34 0.00 0.00 72.50 71.83 1bjx s THR 204 CO 0.11 -0.13 1.59 0.50 -0.54 0.00 0.00 174.62 176.14 1bjx h LYS 205 N 3.31 -0.24 -0.56 3.99 3.64 -1.91 0.77 116.57 125.58 1bjx h LYS 205 Ca -0.46 0.02 0.15 0.00 -1.27 0.00 0.00 60.65 59.09 1bjx h LYS 205 Cb 1.20 0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 33.05 1bjx h LYS 205 CO 0.47 -0.16 0.40 0.93 -2.27 0.00 0.00 179.45 178.82 1bjx h GLU 206 N -0.25 0.07 0.00 1.90 5.08 -1.96 0.90 114.58 120.33 1bjx h GLU 206 Ca 0.18 -0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.43 1bjx h GLU 206 Cb 0.56 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.77 1bjx h GLU 206 CO -0.60 0.04 -1.01 -0.91 -1.00 0.00 0.00 179.01 175.54 1bjx h ASN 207 N 0.07 0.00 0.08 1.42 2.35 -0.44 -3.32 115.58 115.74 1bjx h ASN 207 Ca 0.27 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 56.01 1bjx h ASN 207 Cb 0.97 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.34 1bjx h ASN 207 CO -0.02 0.40 -0.04 -0.07 -1.65 0.00 0.00 177.43 176.05 1bjx h LEU 208 N 0.00 -0.09 -2.60 1.61 3.38 0.27 -2.81 115.31 115.07 1bjx h LEU 208 Ca -0.08 -0.51 0.00 0.00 0.09 0.00 0.00 57.88 57.39 1bjx h LEU 208 Cb 1.37 0.02 -0.00 0.00 0.09 0.00 0.00 40.66 42.14 1bjx h LEU 208 CO 0.04 0.58 0.12 -0.07 0.09 0.00 0.00 178.44 179.20 1bjx h LEU 209 N -0.88 0.00 0.00 1.67 4.07 -1.44 -1.63 115.31 117.10 1bjx h LEU 209 Ca -0.01 0.00 -0.03 0.00 0.08 0.00 0.00 57.88 57.92 1bjx h LEU 209 Cb 0.59 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.33 1bjx h LEU 209 CO 0.02 0.00 -0.19 -0.78 -1.08 0.00 0.00 178.44 176.41 1bjx h ASP 210 N 0.00 0.00 0.56 -0.43 3.58 -1.65 -3.12 116.42 115.36 1bjx h ASP 210 Ca 0.01 -0.57 -0.03 0.00 0.42 0.00 0.00 57.03 56.86 1bjx h ASP 210 Cb 0.25 0.00 0.01 0.00 1.72 0.00 0.00 39.33 41.31 1bjx h ASP 210 CO -0.00 0.89 -0.27 0.15 -2.88 0.00 0.00 179.24 177.14 1bjx h PHE 211 N -1.00 -0.69 -0.89 0.28 3.57 -1.19 -2.34 116.94 114.68 1bjx h PHE 211 Ca -0.04 -0.02 0.16 0.00 3.53 0.00 0.00 57.97 61.60 1bjx h PHE 211 Cb 0.70 0.23 -0.10 0.00 2.79 0.00 0.00 35.95 39.57 1bjx h PHE 211 CO 0.14 -0.42 0.47 0.82 -2.23 0.00 0.00 178.31 177.09 1bjx h ILE 212 N -0.78 0.70 0.00 1.41 2.04 -1.50 0.45 117.51 119.83 1bjx h ILE 212 Ca -0.08 -0.22 0.00 0.00 1.00 0.00 0.00 64.86 65.57 1bjx h ILE 212 Cb 0.59 0.01 0.00 0.00 -0.74 0.00 0.00 36.82 36.67 1bjx h ILE 212 CO 0.13 0.12 0.00 0.11 0.00 0.00 0.00 178.15 178.50 1bjx h LYS 213 N 0.64 0.00 0.00 2.37 1.57 -1.44 -1.72 116.57 117.99 1bjx h LYS 213 Ca 0.50 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.28 1bjx h LYS 213 Cb 0.75 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.06 1bjx h LYS 213 CO -0.38 0.00 -0.90 1.58 -0.57 0.00 0.00 179.45 179.18 1bjx n HIS 214 N -2.30 0.63 -0.11 -1.35 -0.00 0.15 -3.99 115.22 108.26 1bjx n HIS 214 Ca 0.02 0.18 -0.14 0.00 0.46 0.00 0.00 57.72 58.24 1bjx n HIS 214 Cb 0.23 -0.71 -0.10 0.00 -0.12 0.00 0.00 29.99 29.28 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 -2.29 2.30 0.24 0.26 3.02 -0.97 -4.38 115.26 113.44 1bjx n ASN 215 Ca 0.02 -0.11 0.16 0.00 -0.03 0.00 0.00 54.58 54.62 1bjx n ASN 215 Cb 0.48 -0.29 0.79 0.00 -0.61 0.00 0.00 39.78 40.15 1bjx n ASN 215 CO 0.00 0.00 0.00 0.06 -2.62 0.00 0.00 177.26 174.70 1bjx h GLN 216 N 0.00 0.00 -3.84 3.52 3.07 -1.52 -3.34 115.11 112.99 1bjx h GLN 216 Ca -0.47 0.00 -0.65 0.00 0.09 0.00 0.00 58.65 57.62 1bjx h GLN 216 Cb 1.74 0.00 -0.40 0.00 0.08 0.00 0.00 27.48 28.90 1bjx h GLN 216 CO -0.07 0.00 -0.64 -0.51 0.09 0.00 0.00 178.83 177.70 1bjx s LEU 217 N -5.38 4.54 0.98 0.06 1.43 -1.26 -5.05 118.68 114.00 1bjx s LEU 217 Ca -0.01 -2.71 -0.13 0.00 -1.03 0.00 0.00 54.13 50.25 1bjx s LEU 217 Cb 0.10 -1.66 0.17 0.00 0.03 0.00 0.00 46.19 44.83 1bjx s LEU 217 CO 0.38 -0.30 1.13 -2.16 0.23 0.00 0.00 176.35 175.63 1bjx s PRO 218 N 0.14 0.61 -0.12 1.29 0.04 -1.26 -4.65 135.00 131.05 1bjx s PRO 218 Ca 0.15 0.29 -0.04 0.00 0.04 0.00 0.00 61.00 61.43 1bjx s PRO 218 Cb -0.23 -1.78 0.02 0.00 0.04 0.00 0.00 34.50 32.55 1bjx s PRO 218 CO -0.03 -2.56 0.09 1.28 0.04 0.00 0.00 177.00 175.82 1bjx n LEU 219 N -4.02 -5.64 -2.38 -3.56 4.77 -1.26 -4.87 117.00 100.05 1bjx n LEU 219 Ca 0.07 1.42 -0.33 0.00 -0.03 0.00 0.00 56.01 57.14 1bjx n LEU 219 Cb 0.59 -2.50 0.06 0.00 -2.33 0.00 0.00 43.42 39.24 1bjx n LEU 219 CO 0.56 -3.08 1.15 0.52 -1.33 0.00 0.00 177.39 175.21 1bjx n VAL 220 N 1.69 3.35 -3.24 4.08 0.31 -1.26 -4.84 118.33 118.42 1bjx n VAL 220 Ca -0.14 -3.52 -0.03 0.00 -0.01 0.00 0.00 64.34 60.63 1bjx n VAL 220 Cb 0.31 -1.18 -0.03 0.00 -0.91 0.00 0.00 33.84 32.03 1bjx n VAL 220 CO 0.00 0.00 0.00 -0.51 -1.32 0.00 0.00 176.83 175.00 1bjx s ILE 221 N -4.87 -0.80 0.00 2.52 2.07 -1.26 -5.13 121.20 113.73 1bjx s ILE 221 Ca 0.59 -0.15 0.00 0.00 -1.41 0.00 0.00 60.65 59.68 1bjx s ILE 221 Cb 0.47 -0.99 0.00 0.00 0.13 0.00 0.00 42.46 42.08 1bjx s ILE 221 CO -0.08 -0.14 0.00 -0.62 -1.91 0.00 0.00 174.94 172.19 1bjx n GLU 222 N 5.39 -0.04 -1.84 3.50 -0.58 -1.26 -4.98 120.64 120.82 1bjx n GLU 222 Ca 0.02 0.02 -0.01 0.00 -0.42 0.00 0.00 57.16 56.77 1bjx n GLU 222 Cb 0.51 -0.05 -0.00 0.00 -0.57 0.00 0.00 31.44 31.33 1bjx n GLU 222 CO 0.00 0.00 0.00 1.97 -0.48 0.00 0.00 177.13 178.62 1bjx n PHE 223 N -1.22 -0.40 -3.56 -0.32 -1.74 -1.26 -5.04 117.46 103.91 1bjx n PHE 223 Ca 0.00 -0.18 -0.06 0.00 -0.56 0.00 0.00 57.45 56.65 1bjx n PHE 223 Cb 0.01 0.04 0.02 0.00 1.52 0.00 0.00 39.48 41.06 1bjx n PHE 223 CO 0.00 0.00 0.00 -2.37 -0.56 0.00 0.00 176.76 173.83 1bjx n THR 224 N -0.04 0.00 -3.01 1.97 5.66 -1.26 -5.19 114.28 112.41 1bjx n THR 224 Ca 0.00 -0.66 0.00 0.00 -3.05 0.00 0.00 64.05 60.34 1bjx n THR 224 Cb 0.04 0.67 0.00 0.00 -1.55 0.00 0.00 70.33 69.49 1bjx n THR 224 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 1bjx n GLU 225 N -0.38 3.56 -3.85 1.09 4.71 -1.26 -4.81 120.64 119.70 1bjx n GLU 225 Ca -0.06 0.00 -0.27 0.00 -0.01 0.00 0.00 57.16 56.82 1bjx n GLU 225 Cb 0.41 0.00 0.03 0.00 -1.01 0.00 0.00 31.44 30.86 1bjx n GLU 225 CO 0.00 0.00 0.00 1.04 0.09 0.00 0.00 177.13 178.26 1bjx n GLN 226 N -0.02 -5.16 -4.34 3.49 6.02 -1.26 -4.97 117.38 111.13 1bjx n GLN 226 Ca 0.00 0.59 -0.18 0.00 -0.01 0.00 0.00 57.00 57.40 1bjx n GLN 226 Cb 0.00 -5.32 -0.10 0.00 1.02 0.00 0.00 30.24 25.84 1bjx n GLN 226 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 1bjx s THR 227 N -3.47 1.48 0.00 5.09 -4.23 -1.26 -5.35 115.64 107.90 1bjx s THR 227 Ca 0.39 -2.13 0.00 0.00 -1.18 0.00 0.00 61.69 58.77 1bjx s THR 227 Cb -0.20 -2.15 0.00 0.00 1.34 0.00 0.00 72.50 71.50 1bjx s THR 227 CO 0.83 -0.52 0.00 0.00 -0.54 0.00 0.00 174.62 174.39