#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dnk n SER 137 N 0.00 -0.93 -0.05 1.61 7.64 -1.26 -4.80 113.62 115.83 2dnk n SER 137 Ca 0.00 -0.99 -0.01 0.00 1.01 0.00 0.00 58.87 58.88 2dnk n SER 137 Cb 0.00 -1.26 -0.00 0.00 -1.01 0.00 0.00 64.21 61.93 2dnk n SER 137 CO 0.00 0.00 0.00 -1.28 -3.01 0.00 0.00 175.04 170.75 2dnk h SER 138 N -0.81 0.00 0.00 6.43 0.87 -2.10 -3.49 113.55 114.45 2dnk h SER 138 Ca -0.49 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.07 2dnk h SER 138 Cb 1.10 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.06 2dnk h SER 138 CO 0.68 0.47 0.00 0.61 -0.53 0.00 0.00 176.83 178.06 2dnk n GLY 139 N 1.77 -0.63 3.56 5.77 0.00 -1.26 -5.19 105.19 109.22 2dnk n GLY 139 Ca -0.01 0.44 -0.14 0.00 0.00 0.00 0.00 46.02 46.31 2dnk n GLY 139 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dnk s SER 140 N 0.00 -0.51 0.20 1.61 1.04 -1.26 -5.05 113.70 109.72 2dnk s SER 140 Ca 0.00 0.59 -0.22 0.00 0.48 0.00 0.00 55.95 56.80 2dnk s SER 140 Cb 0.00 0.47 0.12 0.00 0.10 0.00 0.00 66.02 66.71 2dnk s SER 140 CO 0.00 -0.44 1.56 0.28 0.98 0.00 0.00 173.24 175.62 2dnk h SER 141 N 2.91 -1.50 0.00 7.02 0.02 -2.07 -3.47 113.55 116.46 2dnk h SER 141 Ca -0.23 0.28 0.00 0.00 -0.84 0.00 0.00 61.79 61.00 2dnk h SER 141 Cb 1.15 0.73 0.00 0.00 0.14 0.00 0.00 62.40 64.42 2dnk h SER 141 CO 0.32 -0.30 0.00 0.61 -1.14 0.00 0.00 176.83 176.33 2dnk n GLY 142 N -1.42 0.44 3.41 -3.77 0.00 -1.26 -4.95 105.19 97.63 2dnk n GLY 142 Ca 0.06 -1.76 -0.35 0.00 0.00 0.00 0.00 46.02 43.96 2dnk n GLY 142 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dnk n LEU 144 N 4.59 2.48 -4.23 0.00 7.99 -1.26 -4.99 117.00 121.58 2dnk n LEU 144 Ca -0.17 0.11 -0.37 0.00 -0.01 0.00 0.00 56.01 55.57 2dnk n LEU 144 Cb 0.51 -0.90 0.04 0.00 -0.11 0.00 0.00 43.42 42.97 2dnk n LEU 144 CO 0.31 0.75 -0.67 -2.11 -1.51 0.00 0.00 177.39 174.16 2dnk n ARG 145 N -3.74 0.06 -3.68 3.23 -4.01 -1.26 -4.92 116.66 102.34 2dnk n ARG 145 Ca -0.48 0.03 -0.38 0.00 -1.04 0.00 0.00 57.85 55.99 2dnk n ARG 145 Cb 0.94 -1.27 -0.10 0.00 -3.04 0.00 0.00 32.46 28.99 2dnk n ARG 145 CO 0.00 0.00 0.00 -0.65 -3.04 0.00 0.00 177.63 173.94 2dnk s GLN 146 N -1.96 2.35 0.55 2.89 -1.52 -1.26 -5.09 119.66 115.62 2dnk s GLN 146 Ca 0.53 -2.02 -0.17 0.00 -1.95 0.00 0.00 55.36 51.75 2dnk s GLN 146 Cb -0.33 -3.76 -0.06 0.00 -0.22 0.00 0.00 33.01 28.64 2dnk s GLN 146 CO 0.70 -1.14 1.04 -1.25 -0.25 0.00 0.00 175.29 174.38 2dnk s PRO 147 N 0.85 3.56 0.86 2.91 0.04 -1.26 -5.06 135.00 136.90 2dnk s PRO 147 Ca 0.10 1.21 -0.12 0.00 0.04 0.00 0.00 61.00 62.23 2dnk s PRO 147 Cb -0.23 -2.07 0.11 0.00 0.04 0.00 0.00 34.50 32.35 2dnk s PRO 147 CO -0.03 -0.61 1.14 -1.25 0.04 0.00 0.00 177.00 176.29 2dnk s PRO 148 N -3.82 1.58 -0.40 0.56 0.04 -1.26 -5.06 135.00 126.65 2dnk s PRO 148 Ca 0.64 0.30 0.02 0.00 0.04 0.00 0.00 61.00 62.01 2dnk s PRO 148 Cb -0.15 -1.89 0.12 0.00 0.04 0.00 0.00 34.50 32.62 2dnk s PRO 148 CO 0.31 -1.89 0.16 -1.54 0.04 0.00 0.00 177.00 174.07 2dnk s SER 149 N -4.17 4.21 -0.52 6.66 1.04 -1.26 -5.03 113.70 114.63 2dnk s SER 149 Ca 0.63 -2.35 -0.17 0.00 0.48 0.00 0.00 55.95 54.54 2dnk s SER 149 Cb -0.14 -1.30 0.10 0.00 0.10 0.00 0.00 66.02 64.78 2dnk s SER 149 CO 0.52 -0.33 0.52 -1.00 0.98 0.00 0.00 173.24 173.94 2dnk s HIS 150 N 0.66 3.17 0.33 5.02 3.76 -1.26 -4.92 115.29 122.05 2dnk s HIS 150 Ca 0.14 -1.01 0.02 0.00 -0.15 0.00 0.00 55.06 54.06 2dnk s HIS 150 Cb -0.22 -3.60 0.58 0.00 1.11 0.00 0.00 32.58 30.46 2dnk s HIS 150 CO -0.08 -1.00 1.94 0.00 -0.85 0.00 0.00 174.74 174.75 2dnk h ARG 151 N 8.91 0.75 -6.23 1.40 2.47 -1.90 -3.43 114.38 116.36 2dnk h ARG 151 Ca -0.29 -0.09 -0.57 0.00 -1.26 0.00 0.00 59.98 57.77 2dnk h ARG 151 Cb 1.10 -0.14 -0.04 0.00 -1.65 0.00 0.00 29.97 29.24 2dnk h ARG 151 CO 0.99 0.59 -0.24 0.21 0.56 0.00 0.00 179.97 182.08 2dnk s LYS 152 N -5.43 3.71 -0.03 0.04 2.20 -1.26 -0.78 119.74 118.19 2dnk s LYS 152 Ca -0.09 0.08 0.04 0.00 -0.36 0.00 0.00 55.97 55.64 2dnk s LYS 152 Cb 0.17 -2.82 -0.00 0.00 -1.51 0.00 0.00 37.83 33.66 2dnk s LYS 152 CO 0.77 0.44 -0.14 -0.51 -0.36 0.00 0.00 175.35 175.56 2dnk s LEU 153 N -2.53 1.88 -0.13 5.43 1.43 0.27 -1.55 118.68 123.50 2dnk s LEU 153 Ca 0.41 -0.28 -0.15 0.00 -1.03 0.00 0.00 54.13 53.08 2dnk s LEU 153 Cb -0.12 -0.79 -0.05 0.00 0.03 0.00 0.00 46.19 45.26 2dnk s LEU 153 CO 0.22 0.13 0.36 0.12 0.23 0.00 0.00 176.35 177.41 2dnk s PHE 154 N 0.04 3.51 -0.09 0.29 5.36 0.17 -1.35 117.98 125.91 2dnk s PHE 154 Ca -0.02 0.74 0.03 0.00 -0.96 0.00 0.00 56.93 56.72 2dnk s PHE 154 Cb -0.10 -2.39 0.01 0.00 -0.34 0.00 0.00 43.02 40.20 2dnk s PHE 154 CO 0.01 0.28 -0.19 0.08 -1.46 0.00 0.00 175.22 173.94 2dnk s VAL 155 N 0.30 1.67 0.00 3.12 1.01 -0.68 -1.08 120.40 124.73 2dnk s VAL 155 Ca 0.20 -0.79 0.00 0.00 0.00 0.00 0.00 61.98 61.40 2dnk s VAL 155 Cb -0.14 -1.47 0.00 0.00 0.00 0.00 0.00 36.38 34.77 2dnk s VAL 155 CO 0.07 0.47 0.00 0.61 0.00 0.00 0.00 175.10 176.25 2dnk n GLY 156 N 3.70 6.96 2.52 4.51 0.00 0.09 -1.64 105.19 121.32 2dnk n GLY 156 Ca -0.21 -1.84 -0.05 0.00 0.00 0.00 0.00 46.02 43.93 2dnk n GLY 156 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2dnk n MET 157 N 0.00 -2.71 -2.93 1.61 2.81 -1.20 -4.07 117.12 110.62 2dnk n MET 157 Ca 0.00 0.21 -0.28 0.00 -1.81 0.00 0.00 57.70 55.82 2dnk n MET 157 Cb 0.00 -4.75 -0.02 0.00 -0.71 0.00 0.00 33.22 27.74 2dnk n MET 157 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 2dnk s LEU 158 N -5.27 3.82 0.25 4.03 1.43 -0.63 -4.64 118.68 117.68 2dnk s LEU 158 Ca 0.02 0.90 0.05 0.00 -1.03 0.00 0.00 54.13 54.07 2dnk s LEU 158 Cb -0.01 -3.79 -0.03 0.00 0.03 0.00 0.00 46.19 42.39 2dnk s LEU 158 CO 0.02 -0.41 0.34 0.21 0.23 0.00 0.00 176.35 176.74 2dnk s ASN 159 N -3.60 6.15 -0.12 2.29 3.84 -1.26 -4.30 114.94 117.94 2dnk s ASN 159 Ca 0.47 -0.01 -0.00 0.00 0.21 0.00 0.00 52.86 53.53 2dnk s ASN 159 Cb -0.10 -1.73 0.10 0.00 -0.55 0.00 0.00 41.25 38.97 2dnk s ASN 159 CO 0.36 -0.10 1.81 0.29 -2.79 0.00 0.00 177.10 176.67 2dnk n LYS 160 N -1.39 1.31 0.00 0.43 5.02 -1.26 -3.72 118.16 118.56 2dnk n LYS 160 Ca -0.08 -0.64 0.00 0.00 -2.02 0.00 0.00 58.31 55.57 2dnk n LYS 160 Cb 0.57 -1.25 0.00 0.00 -0.02 0.00 0.00 35.03 34.33 2dnk n LYS 160 CO 0.00 0.00 0.00 0.94 -0.52 0.00 0.00 177.40 177.82 2dnk n GLN 161 N 0.81 0.00 -1.53 1.97 -0.06 -1.26 -5.03 117.38 112.29 2dnk n GLN 161 Ca 0.12 0.00 -0.37 0.00 -2.00 0.00 0.00 57.00 54.76 2dnk n GLN 161 Cb 0.58 -0.59 0.07 0.00 -4.06 0.00 0.00 30.24 26.23 2dnk n GLN 161 CO 0.00 0.00 0.00 1.04 -0.20 0.00 0.00 177.06 177.90 2dnk n GLN 162 N -2.71 0.74 -4.43 3.69 6.02 -1.24 -5.03 117.38 114.42 2dnk n GLN 162 Ca 0.00 0.30 -0.21 0.00 -0.01 0.00 0.00 57.00 57.08 2dnk n GLN 162 Cb 0.42 -2.20 -0.10 0.00 1.02 0.00 0.00 30.24 29.38 2dnk n GLN 162 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 2dnk s SER 163 N -1.41 2.64 0.26 1.08 0.15 -1.26 -5.01 113.70 110.15 2dnk s SER 163 Ca 0.76 -1.24 -0.05 0.00 0.70 0.00 0.00 55.95 56.11 2dnk s SER 163 Cb -0.39 -0.14 0.51 0.00 -1.71 0.00 0.00 66.02 64.29 2dnk s SER 163 CO 0.48 -0.42 1.61 -0.33 1.20 0.00 0.00 173.24 175.77 2dnk h GLU 164 N 2.24 0.07 0.54 5.44 5.08 -1.99 -0.61 114.58 125.34 2dnk h GLU 164 Ca -0.40 -0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 57.94 2dnk h GLU 164 Cb 1.23 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.46 2dnk h GLU 164 CO 0.68 0.04 -0.36 -0.44 -1.00 0.00 0.00 179.01 177.94 2dnk h ASP 165 N 0.07 -0.92 -0.70 1.42 3.32 -1.98 0.21 116.42 117.83 2dnk h ASP 165 Ca 0.46 0.06 0.10 0.00 0.02 0.00 0.00 57.03 57.67 2dnk h ASP 165 Cb 0.84 0.28 -0.12 0.00 0.22 0.00 0.00 39.33 40.55 2dnk h ASP 165 CO -0.76 -0.55 -0.46 0.44 -1.72 0.00 0.00 179.24 176.18 2dnk h ASP 166 N -0.86 -1.63 -0.14 6.45 3.32 -1.53 -0.66 116.42 121.36 2dnk h ASP 166 Ca -0.06 0.27 -0.00 0.00 0.02 0.00 0.00 57.03 57.26 2dnk h ASP 166 Cb 0.72 0.75 -0.01 0.00 0.22 0.00 0.00 39.33 41.01 2dnk h ASP 166 CO 0.04 -0.32 0.07 0.58 -1.72 0.00 0.00 179.24 177.90 2dnk h VAL 167 N -0.17 1.10 -0.13 -1.35 2.07 -1.25 -1.27 116.25 115.26 2dnk h VAL 167 Ca 0.19 -0.27 0.01 0.00 0.82 0.00 0.00 66.70 67.45 2dnk h VAL 167 Cb 0.54 1.03 -0.02 0.00 -1.52 0.00 0.00 31.29 31.33 2dnk h VAL 167 CO -0.77 0.09 -0.08 0.03 0.02 0.00 0.00 177.57 176.85 2dnk h ARG 168 N 0.12 -0.01 0.26 1.57 3.08 0.92 0.23 114.38 120.56 2dnk h ARG 168 Ca 0.05 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.10 2dnk h ARG 168 Cb 0.08 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.12 2dnk h ARG 168 CO -0.01 -0.01 -0.20 0.00 -1.07 0.00 0.00 179.97 178.69 2dnk h ARG 169 N -0.01 -0.44 -0.29 0.04 3.08 -1.39 -1.50 114.38 113.86 2dnk h ARG 169 Ca 0.02 0.03 0.03 0.00 0.07 0.00 0.00 59.98 60.13 2dnk h ARG 169 Cb 0.07 0.10 -0.04 0.00 0.08 0.00 0.00 29.97 30.18 2dnk h ARG 169 CO -0.13 -0.30 -0.19 1.25 -1.07 0.00 0.00 179.97 179.54 2dnk h LEU 170 N -0.46 -0.70 0.00 3.04 5.85 -0.60 0.88 115.31 123.32 2dnk h LEU 170 Ca -0.02 0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.81 2dnk h LEU 170 Cb 0.40 0.30 0.00 0.00 0.37 0.00 0.00 40.66 41.74 2dnk h LEU 170 CO -0.00 -0.09 0.00 0.49 -0.34 0.00 0.00 178.44 178.50 2dnk n PHE 171 N -3.71 0.00 -0.47 1.25 3.01 0.76 -1.94 117.46 116.35 2dnk n PHE 171 Ca 0.00 0.00 0.40 0.00 1.01 0.00 0.00 57.45 58.87 2dnk n PHE 171 Cb 0.09 -0.34 0.62 0.00 -0.01 0.00 0.00 39.48 39.85 2dnk n PHE 171 CO 0.00 0.00 0.00 -0.85 1.01 0.00 0.00 176.76 176.92 2dnk n GLU 172 N -1.67 0.01 -0.20 -1.08 -0.00 -0.57 -0.39 120.64 116.74 2dnk n GLU 172 Ca 0.00 1.02 0.28 0.00 -0.00 0.00 0.00 57.16 58.45 2dnk n GLU 172 Cb 0.00 -2.43 0.45 0.00 -0.00 0.00 0.00 31.44 29.46 2dnk n GLU 172 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2dnk h ALA 173 N 0.75 2.94 -0.22 -1.84 0.00 0.15 -2.89 119.26 118.15 2dnk h ALA 173 Ca 0.71 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.58 2dnk h ALA 173 Cb 3.28 0.08 0.00 0.00 0.00 0.00 0.00 17.79 21.14 2dnk h ALA 173 CO -0.01 -1.70 0.00 1.19 0.00 0.00 0.00 179.25 178.73 2dnk n PHE 174 N -3.26 0.00 -2.45 0.00 3.72 0.48 -5.10 117.46 110.85 2dnk n PHE 174 Ca 0.22 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.62 2dnk n PHE 174 Cb 1.49 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 40.03 2dnk n PHE 174 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2dnk n GLY 175 N 2.23 2.42 3.96 1.37 0.00 -1.09 -5.07 105.19 109.01 2dnk n GLY 175 Ca 0.00 -2.07 -0.22 0.00 0.00 0.00 0.00 46.02 43.72 2dnk n GLY 175 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2dnk s ASN 176 N -0.86 6.23 0.10 1.61 -0.87 -1.26 -4.31 114.94 115.58 2dnk s ASN 176 Ca 0.00 0.23 0.06 0.00 -1.57 0.00 0.00 52.86 51.58 2dnk s ASN 176 Cb 0.00 -1.84 -0.03 0.00 -0.02 0.00 0.00 41.25 39.35 2dnk s ASN 176 CO 0.00 -0.26 -0.16 -0.63 -2.57 0.00 0.00 177.10 173.47 2dnk s ILE 177 N -2.20 1.38 -0.06 0.60 1.01 -1.26 -3.61 121.20 117.05 2dnk s ILE 177 Ca 0.39 -1.50 -0.00 0.00 0.00 0.00 0.00 60.65 59.54 2dnk s ILE 177 Cb -0.09 -1.36 -0.04 0.00 0.01 0.00 0.00 42.46 40.98 2dnk s ILE 177 CO 0.33 -0.22 -0.06 -0.62 0.00 0.00 0.00 174.94 174.37 2dnk n GLU 178 N 1.01 0.14 -3.63 2.79 -0.58 -1.09 -4.84 120.64 114.43 2dnk n GLU 178 Ca -0.19 0.04 -0.16 0.00 -0.42 0.00 0.00 57.16 56.43 2dnk n GLU 178 Cb 0.55 -1.02 -0.07 0.00 -0.57 0.00 0.00 31.44 30.33 2dnk n GLU 178 CO 0.00 0.00 0.00 -1.21 -0.48 0.00 0.00 177.13 175.44 2dnk s GLU 179 N -2.12 0.87 0.01 3.49 8.01 -1.26 -5.03 118.70 122.68 2dnk s GLU 179 Ca -0.08 0.08 0.01 0.00 0.01 0.00 0.00 54.97 54.99 2dnk s GLU 179 Cb 0.02 0.40 -0.01 0.00 -4.31 0.00 0.00 34.13 30.24 2dnk s GLU 179 CO 0.13 -0.26 -0.04 0.00 0.01 0.00 0.00 175.26 175.11 2dnk s THR 181 N -0.60 0.05 -0.15 0.00 2.01 -0.12 -5.03 115.64 111.79 2dnk s THR 181 Ca -0.05 -0.41 -0.00 0.00 0.31 0.00 0.00 61.69 61.54 2dnk s THR 181 Cb -0.05 -0.62 -0.01 0.00 0.01 0.00 0.00 72.50 71.83 2dnk s THR 181 CO -0.00 -0.23 -0.14 -0.63 -0.69 0.00 0.00 174.62 172.93 2dnk s ILE 182 N -1.20 2.81 0.29 1.82 -1.09 -1.26 -0.34 121.20 122.24 2dnk s ILE 182 Ca -0.12 -0.72 -0.29 0.00 -2.23 0.00 0.00 60.65 57.28 2dnk s ILE 182 Cb -0.05 -2.19 -0.10 0.00 -1.58 0.00 0.00 42.46 38.54 2dnk s ILE 182 CO 0.04 0.51 1.16 -0.76 -1.23 0.00 0.00 174.94 174.66 2dnk s LEU 183 N 0.75 4.52 -0.11 2.97 1.43 -0.48 -4.97 118.68 122.79 2dnk s LEU 183 Ca -0.06 2.38 -0.05 0.00 -1.03 0.00 0.00 54.13 55.38 2dnk s LEU 183 Cb -0.15 -3.63 0.05 0.00 0.03 0.00 0.00 46.19 42.49 2dnk s LEU 183 CO 0.01 -0.25 0.25 -0.13 0.23 0.00 0.00 176.35 176.46 2dnk s ARG 184 N -1.53 0.17 0.00 1.70 0.52 -1.26 -3.30 118.95 115.25 2dnk s ARG 184 Ca 0.46 0.61 0.00 0.00 -0.52 0.00 0.00 55.73 56.28 2dnk s ARG 184 Cb -0.34 -0.10 0.00 0.00 0.52 0.00 0.00 34.95 35.03 2dnk s ARG 184 CO 0.44 -0.21 0.00 0.41 0.02 0.00 0.00 175.30 175.96 2dnk n GLY 185 N 4.69 -3.43 0.10 -3.53 0.00 -0.60 -4.86 105.19 97.56 2dnk n GLY 185 Ca -0.17 -1.14 -0.16 0.00 0.00 0.00 0.00 46.02 44.55 2dnk n GLY 185 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dnk h PRO 186 N 0.00 0.19 -0.92 1.61 0.13 -2.02 -3.31 132.00 127.68 2dnk h PRO 186 Ca 0.00 -0.24 0.25 0.00 -0.87 0.00 0.00 66.00 65.15 2dnk h PRO 186 Cb 0.00 0.07 -0.14 0.00 0.13 0.00 0.00 31.00 31.06 2dnk h PRO 186 CO 0.00 1.00 0.36 -0.44 -0.23 0.00 0.00 178.00 178.69 2dnk h ASP 187 N -0.51 0.21 0.00 1.44 3.32 -2.06 -3.44 116.42 115.38 2dnk h ASP 187 Ca -0.05 0.19 0.00 0.00 0.02 0.00 0.00 57.03 57.19 2dnk h ASP 187 Cb 1.14 0.20 0.00 0.00 0.22 0.00 0.00 39.33 40.90 2dnk h ASP 187 CO 0.07 -0.12 0.00 0.61 -1.72 0.00 0.00 179.24 178.08 2dnk n GLY 188 N -1.35 0.98 3.11 2.75 0.00 -1.25 -5.16 105.19 104.28 2dnk n GLY 188 Ca 0.24 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.18 2dnk n GLY 188 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2dnk s ASN 189 N -1.47 0.33 -0.02 1.61 2.47 -1.26 -5.00 114.94 111.60 2dnk s ASN 189 Ca 0.00 -0.80 -0.30 0.00 0.42 0.00 0.00 52.86 52.18 2dnk s ASN 189 Cb 0.00 0.23 -0.04 0.00 -1.45 0.00 0.00 41.25 39.99 2dnk s ASN 189 CO 0.00 -0.59 1.19 -0.94 -3.72 0.00 0.00 177.10 173.04 2dnk s SER 190 N -2.67 7.07 -0.10 -4.21 1.04 -1.26 -1.55 113.70 112.02 2dnk s SER 190 Ca 0.03 1.87 0.02 0.00 0.48 0.00 0.00 55.95 58.34 2dnk s SER 190 Cb 0.04 -2.56 0.18 0.00 0.10 0.00 0.00 66.02 63.78 2dnk s SER 190 CO -0.09 -0.54 1.09 0.29 0.98 0.00 0.00 173.24 174.97 2dnk n LYS 191 N 4.81 1.54 -2.58 4.02 5.02 -1.21 -4.81 118.16 124.95 2dnk n LYS 191 Ca 0.10 -0.77 -0.20 0.00 -2.02 0.00 0.00 58.31 55.42 2dnk n LYS 191 Cb 0.46 -1.43 0.01 0.00 -0.02 0.00 0.00 35.03 34.05 2dnk n LYS 191 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2dnk n GLY 192 N 0.11 -0.46 3.09 0.72 0.00 -1.26 -4.91 105.19 102.48 2dnk n GLY 192 Ca 0.12 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.04 2dnk n GLY 192 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dnk s ALA 194 N -1.59 -0.56 -0.06 0.00 0.00 -0.65 -1.38 121.76 117.51 2dnk s ALA 194 Ca -0.14 -0.72 0.02 0.00 0.00 0.00 0.00 51.96 51.13 2dnk s ALA 194 Cb -0.07 0.94 0.01 0.00 0.00 0.00 0.00 23.12 24.00 2dnk s ALA 194 CO 0.00 -0.93 -0.13 -0.06 0.00 0.00 0.00 175.76 174.64 2dnk s PHE 195 N -3.64 1.49 -0.05 0.00 0.08 0.54 -1.69 117.98 114.70 2dnk s PHE 195 Ca 0.18 -0.54 0.03 0.00 0.12 0.00 0.00 56.93 56.72 2dnk s PHE 195 Cb -0.03 -1.08 0.00 0.00 -0.57 0.00 0.00 43.02 41.34 2dnk s PHE 195 CO 0.10 -0.27 -0.14 0.08 -0.10 0.00 0.00 175.22 174.88 2dnk s VAL 196 N 0.61 1.24 0.08 -0.44 1.01 -0.46 -0.95 120.40 121.49 2dnk s VAL 196 Ca -0.14 -0.58 0.03 0.00 0.00 0.00 0.00 61.98 61.29 2dnk s VAL 196 Cb -0.15 -1.09 -0.04 0.00 0.00 0.00 0.00 36.38 35.09 2dnk s VAL 196 CO 0.04 0.37 0.10 -0.54 0.00 0.00 0.00 175.10 175.07 2dnk s LYS 197 N 0.33 2.98 0.44 2.72 1.02 -0.00 0.96 119.74 128.19 2dnk s LYS 197 Ca -0.09 -0.65 0.03 0.00 0.02 0.00 0.00 55.97 55.29 2dnk s LYS 197 Cb -0.13 -2.78 -0.04 0.00 -0.52 0.00 0.00 37.83 34.36 2dnk s LYS 197 CO 0.03 0.57 0.04 0.71 -0.92 0.00 0.00 175.35 175.78 2dnk s TYR 198 N -1.41 2.01 -0.02 3.18 1.51 0.04 -2.68 117.35 119.98 2dnk s TYR 198 Ca 0.30 -0.96 0.00 0.00 -1.01 0.00 0.00 57.07 55.41 2dnk s TYR 198 Cb -0.12 -1.52 -0.26 0.00 -0.11 0.00 0.00 41.96 39.95 2dnk s TYR 198 CO 0.23 0.15 0.75 0.77 -1.11 0.00 0.00 175.55 176.34 2dnk h SER 199 N 1.63 0.29 -4.21 2.29 0.02 -1.88 -3.42 113.55 108.26 2dnk h SER 199 Ca -0.42 -0.46 -0.32 0.00 -0.84 0.00 0.00 61.79 59.75 2dnk h SER 199 Cb 1.28 -0.09 -0.08 0.00 0.14 0.00 0.00 62.40 63.65 2dnk h SER 199 CO 0.72 1.40 -0.21 -1.20 -1.14 0.00 0.00 176.83 176.39 2dnk n SER 200 N -3.36 -1.28 0.09 3.07 7.64 -1.26 -5.09 113.62 113.43 2dnk n SER 200 Ca -0.18 -3.00 -0.04 0.00 1.01 0.00 0.00 58.87 56.66 2dnk n SER 200 Cb 1.04 2.45 -0.02 0.00 -1.01 0.00 0.00 64.21 66.67 2dnk n SER 200 CO 0.00 0.00 0.00 -0.74 -3.01 0.00 0.00 175.04 171.29 2dnk h HIS 201 N 2.05 -0.25 -0.62 1.43 2.76 -1.94 -3.15 115.15 115.43 2dnk h HIS 201 Ca -0.27 -0.01 0.06 0.00 -2.20 0.00 0.00 60.37 57.95 2dnk h HIS 201 Cb 1.22 0.08 -0.07 0.00 1.55 0.00 0.00 27.41 30.19 2dnk h HIS 201 CO 0.00 -0.16 -0.37 0.00 -1.30 0.00 0.00 177.93 176.11 2dnk n ALA 202 N -2.45 -0.40 -0.28 5.26 0.00 -1.26 0.16 120.51 121.54 2dnk n ALA 202 Ca -0.03 0.53 0.10 0.00 0.00 0.00 0.00 53.44 54.03 2dnk n ALA 202 Cb 0.11 -0.03 0.25 0.00 0.00 0.00 0.00 19.45 19.77 2dnk n ALA 202 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2dnk h GLU 203 N 0.00 0.33 0.62 0.00 4.39 -1.99 -0.76 114.58 117.18 2dnk h GLU 203 Ca 0.10 -0.02 -0.03 0.00 0.34 0.00 0.00 59.36 59.75 2dnk h GLU 203 Cb 0.25 -0.07 0.01 0.00 -0.10 0.00 0.00 28.75 28.84 2dnk h GLU 203 CO -0.58 0.22 -0.30 0.00 -1.16 0.00 0.00 179.01 177.19 2dnk h ALA 204 N 1.67 -0.83 -0.68 3.43 0.00 0.16 -2.28 119.26 120.72 2dnk h ALA 204 Ca 0.49 -0.18 0.14 0.00 0.00 0.00 0.00 54.91 55.35 2dnk h ALA 204 Cb 0.89 0.32 -0.10 0.00 0.00 0.00 0.00 17.79 18.91 2dnk h ALA 204 CO -0.53 -0.96 0.16 0.37 0.00 0.00 0.00 179.25 178.29 2dnk h GLN 205 N -0.84 0.27 -0.29 0.00 5.75 -0.08 -0.66 115.11 119.26 2dnk h GLN 205 Ca -0.09 -0.02 0.05 0.00 -0.15 0.00 0.00 58.65 58.45 2dnk h GLN 205 Cb 0.64 -0.06 -0.05 0.00 1.07 0.00 0.00 27.48 29.08 2dnk h GLN 205 CO 0.14 0.18 -0.04 0.00 -2.65 0.00 0.00 178.83 176.47 2dnk h ALA 206 N 1.54 0.22 0.00 3.38 0.00 -1.01 -0.28 119.26 123.12 2dnk h ALA 206 Ca 0.37 0.10 -0.03 0.00 0.00 0.00 0.00 54.91 55.35 2dnk h ALA 206 Cb 0.58 0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.55 2dnk h ALA 206 CO -0.45 -0.44 -0.12 0.00 0.00 0.00 0.00 179.25 178.24 2dnk h ALA 207 N 1.27 1.45 0.27 0.00 0.00 -0.65 -0.46 119.26 121.15 2dnk h ALA 207 Ca 0.14 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 2dnk h ALA 207 Cb 0.20 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2dnk h ALA 207 CO -0.27 0.15 -0.13 0.82 0.00 0.00 0.00 179.25 179.83 2dnk h ILE 208 N 0.00 0.00 -0.94 0.00 2.04 0.33 -0.67 117.51 118.28 2dnk h ILE 208 Ca -0.00 -0.31 0.04 0.00 1.00 0.00 0.00 64.86 65.59 2dnk h ILE 208 Cb 0.28 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 36.31 2dnk h ILE 208 CO 0.02 0.00 0.61 -1.13 0.00 0.00 0.00 178.15 177.65 2dnk h ASN 209 N -0.67 1.00 -0.12 1.72 -0.73 -1.25 1.87 115.58 117.40 2dnk h ASN 209 Ca -0.04 -0.01 -0.09 0.00 1.87 0.00 0.00 56.30 58.03 2dnk h ASN 209 Cb 0.28 -0.23 -0.01 0.00 0.27 0.00 0.00 38.32 38.63 2dnk h ASN 209 CO 0.06 0.68 -0.21 0.00 -0.37 0.00 0.00 177.43 177.59 2dnk h ALA 210 N 1.46 1.09 -1.36 1.57 0.00 -1.17 -3.40 119.26 117.45 2dnk h ALA 210 Ca 0.38 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2dnk h ALA 210 Cb 0.04 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.70 2dnk h ALA 210 CO -0.12 0.56 0.00 1.28 0.00 0.00 0.00 179.25 180.97 2dnk n LEU 211 N -4.14 0.00 -4.59 0.00 4.77 -0.26 -4.62 117.00 108.16 2dnk n LEU 211 Ca 0.00 0.00 -0.49 0.00 -0.03 0.00 0.00 56.01 55.49 2dnk n LEU 211 Cb 0.39 -0.24 -0.04 0.00 -2.33 0.00 0.00 43.42 41.20 2dnk n LEU 211 CO 0.42 -0.27 0.77 1.57 -1.33 0.00 0.00 177.39 178.55 2dnk n HIS 212 N -2.02 1.42 -0.71 -1.77 -0.00 0.63 0.56 115.22 113.33 2dnk n HIS 212 Ca 0.00 0.64 0.00 0.00 0.46 0.00 0.00 57.72 58.82 2dnk n HIS 212 Cb 0.00 -2.31 0.00 0.00 -0.12 0.00 0.00 29.99 27.56 2dnk n HIS 212 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 2dnk n GLY 213 N 2.09 0.56 0.00 1.57 0.00 -0.92 -4.33 105.19 104.16 2dnk n GLY 213 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 2dnk n GLY 213 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2dnk n SER 214 N 0.00 0.00 -4.56 1.61 2.88 0.19 -4.93 113.62 108.80 2dnk n SER 214 Ca 0.00 0.15 -0.17 0.00 -1.33 0.00 0.00 58.87 57.52 2dnk n SER 214 Cb 0.00 -0.45 0.06 0.00 -0.75 0.00 0.00 64.21 63.07 2dnk n SER 214 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2dnk n GLN 215 N -2.22 0.65 -3.68 -1.46 10.64 -1.15 -4.94 117.38 115.23 2dnk n GLN 215 Ca 0.00 -2.73 -0.27 0.00 -1.83 0.00 0.00 57.00 52.18 2dnk n GLN 215 Cb 0.00 -0.21 -0.17 0.00 -0.86 0.00 0.00 30.24 29.00 2dnk n GLN 215 CO 0.00 0.00 0.00 0.99 -1.83 0.00 0.00 177.06 176.22 2dnk s THR 216 N -2.14 0.25 0.96 -0.39 2.01 -1.26 -0.68 115.64 114.39 2dnk s THR 216 Ca 0.53 -0.37 -0.16 0.00 0.31 0.00 0.00 61.69 62.00 2dnk s THR 216 Cb -0.04 -0.82 -0.14 0.00 0.01 0.00 0.00 72.50 71.51 2dnk s THR 216 CO 0.34 -0.23 -0.78 0.23 -0.69 0.00 0.00 174.62 173.48 2dnk n MET 217 N 5.15 0.00 -2.23 4.92 2.81 -1.26 -4.74 117.12 121.77 2dnk n MET 217 Ca -0.08 0.00 -0.40 0.00 -1.81 0.00 0.00 57.70 55.41 2dnk n MET 217 Cb 0.48 -0.96 -0.03 0.00 -0.71 0.00 0.00 33.22 32.00 2dnk n MET 217 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 2dnk s PRO 218 N -1.93 3.03 0.00 0.03 0.04 -1.26 -3.44 135.00 131.47 2dnk s PRO 218 Ca 0.38 0.53 0.00 0.00 0.04 0.00 0.00 61.00 61.96 2dnk s PRO 218 Cb -0.17 -4.24 0.00 0.00 0.04 0.00 0.00 34.50 30.13 2dnk s PRO 218 CO 0.80 -2.26 0.00 0.41 0.04 0.00 0.00 177.00 175.98 2dnk n GLY 219 N 5.46 3.54 3.75 0.56 0.00 -1.26 -4.88 105.19 112.36 2dnk n GLY 219 Ca 0.15 -0.96 -0.36 0.00 0.00 0.00 0.00 46.02 44.86 2dnk n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dnk s ALA 220 N 0.00 2.52 -0.35 4.61 0.00 -1.22 -4.95 121.76 122.36 2dnk s ALA 220 Ca 0.00 0.99 0.22 0.00 0.00 0.00 0.00 51.96 53.17 2dnk s ALA 220 Cb 0.00 -3.45 -0.10 0.00 0.00 0.00 0.00 23.12 19.57 2dnk s ALA 220 CO 0.00 -1.20 0.85 0.43 0.00 0.00 0.00 175.76 175.84 2dnk n SER 221 N -1.67 0.50 -4.90 0.00 7.64 -1.26 -4.71 113.62 109.21 2dnk n SER 221 Ca 0.14 -0.06 -0.33 0.00 1.01 0.00 0.00 58.87 59.63 2dnk n SER 221 Cb 0.50 1.11 -0.05 0.00 -1.01 0.00 0.00 64.21 64.76 2dnk n SER 221 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2dnk s SER 222 N -4.41 6.38 0.71 6.43 0.15 -1.26 -5.08 113.70 116.62 2dnk s SER 222 Ca -0.01 0.36 -0.16 0.00 0.70 0.00 0.00 55.95 56.84 2dnk s SER 222 Cb 0.13 -2.01 0.03 0.00 -1.71 0.00 0.00 66.02 62.46 2dnk s SER 222 CO 0.84 0.26 1.23 -0.94 1.20 0.00 0.00 173.24 175.83 2dnk s SER 223 N -1.94 4.27 0.60 5.45 1.04 -1.26 -4.50 113.70 117.37 2dnk s SER 223 Ca 0.28 2.44 -0.17 0.00 0.48 0.00 0.00 55.95 58.98 2dnk s SER 223 Cb -0.13 -2.60 -0.14 0.00 0.10 0.00 0.00 66.02 63.26 2dnk s SER 223 CO 0.19 -2.22 -0.30 -0.11 0.98 0.00 0.00 173.24 171.78 2dnk n LEU 224 N -2.51 -4.07 -3.92 2.42 7.94 0.15 -4.54 117.00 112.46 2dnk n LEU 224 Ca 0.14 0.49 -0.30 0.00 -1.11 0.00 0.00 56.01 55.22 2dnk n LEU 224 Cb 0.50 -0.77 -0.15 0.00 0.53 0.00 0.00 43.42 43.52 2dnk n LEU 224 CO 0.47 -4.82 -0.37 -0.69 -1.11 0.00 0.00 177.39 170.87 2dnk s VAL 225 N -1.87 1.64 -0.29 1.96 1.01 -1.26 -2.16 120.40 119.43 2dnk s VAL 225 Ca 0.49 -1.64 0.00 0.00 0.00 0.00 0.00 61.98 60.83 2dnk s VAL 225 Cb -0.38 -2.07 0.09 0.00 0.00 0.00 0.00 36.38 34.01 2dnk s VAL 225 CO 0.66 -0.40 0.05 -0.69 0.00 0.00 0.00 175.10 174.73 2dnk s VAL 226 N 1.28 1.27 0.37 2.92 1.01 -1.26 -0.73 120.40 125.25 2dnk s VAL 226 Ca 0.03 -1.48 0.08 0.00 0.00 0.00 0.00 61.98 60.61 2dnk s VAL 226 Cb -0.19 -1.85 -0.07 0.00 0.00 0.00 0.00 36.38 34.28 2dnk s VAL 226 CO -0.11 -0.50 -0.04 -1.59 0.00 0.00 0.00 175.10 172.86 2dnk s LYS 227 N 1.44 1.85 0.37 2.72 -2.85 -0.24 -4.85 119.74 118.19 2dnk s LYS 227 Ca 0.06 -2.00 -0.26 0.00 -1.00 0.00 0.00 55.97 52.77 2dnk s LYS 227 Cb -0.18 -1.60 -0.09 0.00 -2.06 0.00 0.00 37.83 33.90 2dnk s LYS 227 CO -0.16 0.04 1.14 -0.06 0.10 0.00 0.00 175.35 176.41 2dnk s PHE 228 N -2.71 3.19 -0.40 1.78 0.08 -1.26 0.43 117.98 119.09 2dnk s PHE 228 Ca 0.34 1.59 -0.23 0.00 0.12 0.00 0.00 56.93 58.74 2dnk s PHE 228 Cb 0.06 -3.34 0.02 0.00 -0.57 0.00 0.00 43.02 39.18 2dnk s PHE 228 CO 0.17 -1.10 0.77 0.00 -0.10 0.00 0.00 175.22 174.96 2dnk s ALA 229 N -1.40 3.37 -0.09 5.36 0.00 -0.59 -4.56 121.76 123.85 2dnk s ALA 229 Ca 0.54 -0.82 -0.03 0.00 0.00 0.00 0.00 51.96 51.65 2dnk s ALA 229 Cb -0.30 -3.39 -0.10 0.00 0.00 0.00 0.00 23.12 19.33 2dnk s ALA 229 CO 0.38 -1.66 2.87 -3.47 0.00 0.00 0.00 175.76 173.89 2dnk n ASP 230 N 6.51 5.56 -2.65 0.00 2.03 -1.26 -4.74 116.55 122.00 2dnk n ASP 230 Ca 0.02 -2.62 -0.10 0.00 0.52 0.00 0.00 54.79 52.62 2dnk n ASP 230 Cb 0.48 -1.27 -0.02 0.00 -0.72 0.00 0.00 41.12 39.59 2dnk n ASP 230 CO 0.00 0.00 0.00 1.07 -1.92 0.00 0.00 177.20 176.35 2dnk n THR 231 N 1.77 0.00 -1.81 5.18 5.66 -1.26 -4.73 114.28 119.09 2dnk n THR 231 Ca 0.30 0.00 -0.30 0.00 -3.05 0.00 0.00 64.05 60.99 2dnk n THR 231 Cb 0.71 -0.11 0.04 0.00 -1.55 0.00 0.00 70.33 69.42 2dnk n THR 231 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 175.07 172.49 2dnk n ASP 232 N -1.40 6.27 -0.25 1.09 8.00 -1.26 -4.82 116.55 124.17 2dnk n ASP 232 Ca 0.03 -3.77 -0.04 0.00 0.71 0.00 0.00 54.79 51.71 2dnk n ASP 232 Cb 0.40 -0.69 0.01 0.00 -0.02 0.00 0.00 41.12 40.82 2dnk n ASP 232 CO 0.00 0.00 0.00 0.50 -0.39 0.00 0.00 177.20 177.31 2dnk h LYS 233 N 2.27 -0.12 -7.25 -1.24 3.64 -1.98 -3.40 116.57 108.49 2dnk h LYS 233 Ca 0.48 0.01 -0.50 0.00 -1.27 0.00 0.00 60.65 59.37 2dnk h LYS 233 Cb 1.00 0.03 0.06 0.00 -0.41 0.00 0.00 32.23 32.90 2dnk h LYS 233 CO 1.17 -0.08 0.31 -1.83 -2.27 0.00 0.00 179.45 176.75 2dnk s GLU 234 N -5.98 3.29 -0.02 1.90 4.04 -1.26 -5.04 118.70 115.63 2dnk s GLU 234 Ca -0.14 0.42 -0.06 0.00 0.04 0.00 0.00 54.97 55.23 2dnk s GLU 234 Cb 0.17 -2.17 -0.02 0.00 0.02 0.00 0.00 34.13 32.13 2dnk s GLU 234 CO 0.70 -0.62 -0.11 0.45 -1.84 0.00 0.00 175.26 173.83 2dnk n SER 235 N -2.67 1.07 -4.00 0.83 2.88 -1.26 -5.11 113.62 105.35 2dnk n SER 235 Ca 0.05 0.16 -0.09 0.00 -1.33 0.00 0.00 58.87 57.65 2dnk n SER 235 Cb 0.56 -0.44 -0.08 0.00 -0.75 0.00 0.00 64.21 63.50 2dnk n SER 235 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2dnk s GLY 236 N -4.01 0.56 0.26 0.46 0.00 -1.26 -5.15 107.32 98.18 2dnk s GLY 236 Ca -0.09 -1.00 -0.30 0.00 0.00 0.00 0.00 44.72 43.33 2dnk s GLY 236 CO 0.14 -0.96 1.02 2.56 0.00 0.00 0.00 173.10 175.86 2dnk s PRO 237 N -3.98 4.74 0.04 2.90 0.04 -1.26 -4.99 135.00 132.50 2dnk s PRO 237 Ca 0.18 1.65 -0.28 0.00 0.04 0.00 0.00 61.00 62.59 2dnk s PRO 237 Cb 0.04 -3.24 -0.17 0.00 0.04 0.00 0.00 34.50 31.18 2dnk s PRO 237 CO -0.01 0.35 1.43 1.03 0.04 0.00 0.00 177.00 179.85 2dnk h SER 238 N 4.03 -0.47 -3.13 6.66 0.87 -2.07 -3.42 113.55 116.02 2dnk h SER 238 Ca -0.46 -0.07 -0.60 0.00 -1.23 0.00 0.00 61.79 59.43 2dnk h SER 238 Cb 1.21 0.12 -0.07 0.00 -0.44 0.00 0.00 62.40 63.22 2dnk h SER 238 CO 0.68 -0.20 -0.20 -0.44 -0.53 0.00 0.00 176.83 176.13 2dnk s SER 239 N -4.83 6.74 0.00 6.23 0.01 -1.26 -5.32 113.70 115.27 2dnk s SER 239 Ca -0.15 0.87 0.00 0.00 1.31 0.00 0.00 55.95 57.98 2dnk s SER 239 Cb 0.03 -2.25 0.00 0.00 0.21 0.00 0.00 66.02 64.01 2dnk s SER 239 CO 0.58 0.22 0.00 0.61 0.41 0.00 0.00 173.24 175.06