#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dha s SER 144 N 0.00 -0.34 0.46 1.61 1.04 -1.26 -5.15 113.70 110.06 2dha s SER 144 Ca 0.00 0.43 -0.24 0.00 0.48 0.00 0.00 55.95 56.62 2dha s SER 144 Cb 0.00 0.36 -0.08 0.00 0.10 0.00 0.00 66.02 66.40 2dha s SER 144 CO 0.00 -0.28 1.27 -0.24 0.98 0.00 0.00 173.24 174.97 2dha n SER 145 N 0.95 2.48 0.19 7.02 2.88 -1.26 -4.83 113.62 121.06 2dha n SER 145 Ca -0.10 1.06 0.00 0.00 -1.33 0.00 0.00 58.87 58.50 2dha n SER 145 Cb 0.58 -1.51 0.00 0.00 -0.75 0.00 0.00 64.21 62.52 2dha n SER 145 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dha n GLY 146 N 0.82 -1.69 3.68 0.46 0.00 -1.26 -5.11 105.19 102.10 2dha n GLY 146 Ca 0.08 0.39 -0.40 0.00 0.00 0.00 0.00 46.02 46.08 2dha n GLY 146 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dha s SER 147 N -2.00 6.82 -0.03 1.61 0.01 -1.26 -5.06 113.70 113.79 2dha s SER 147 Ca 0.00 0.99 0.07 0.00 1.31 0.00 0.00 55.95 58.32 2dha s SER 147 Cb 0.00 -2.38 -0.02 0.00 0.21 0.00 0.00 66.02 63.83 2dha s SER 147 CO 0.00 -0.24 -0.24 -0.55 0.41 0.00 0.00 173.24 172.62 2dha s SER 148 N 1.04 2.91 0.30 2.44 0.15 -1.26 -5.14 113.70 114.15 2dha s SER 148 Ca 0.33 -0.46 0.08 0.00 0.70 0.00 0.00 55.95 56.60 2dha s SER 148 Cb -0.16 -0.49 -0.06 0.00 -1.71 0.00 0.00 66.02 63.59 2dha s SER 148 CO 0.13 0.28 -0.08 -0.83 1.20 0.00 0.00 173.24 173.93 2dha s GLY 149 N -0.42 1.97 0.00 9.45 0.00 -1.26 -4.94 107.32 112.13 2dha s GLY 149 Ca 0.05 -1.97 0.00 0.00 0.00 0.00 0.00 44.72 42.79 2dha s GLY 149 CO 0.01 -1.92 0.00 0.61 0.00 0.00 0.00 173.10 171.79 2dha n GLY 150 N -0.67 2.20 3.58 0.20 0.00 -1.26 -5.10 105.19 104.14 2dha n GLY 150 Ca -0.05 -0.43 -0.24 0.00 0.00 0.00 0.00 46.02 45.30 2dha n GLY 150 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2dha s GLY 151 N 0.00 1.85 -0.02 -0.02 0.00 -1.26 -5.04 107.32 102.83 2dha s GLY 151 Ca 0.00 -1.82 0.03 0.00 0.00 0.00 0.00 44.72 42.93 2dha s GLY 151 CO 0.00 -1.85 0.04 2.41 0.00 0.00 0.00 173.10 173.69 2dha n THR 152 N -0.82 0.11 -0.27 0.90 -1.04 -1.26 -4.69 114.28 107.20 2dha n THR 152 Ca -0.05 -0.10 0.21 0.00 -2.04 0.00 0.00 64.05 62.07 2dha n THR 152 Cb 0.60 -0.32 0.40 0.00 -1.82 0.00 0.00 70.33 69.19 2dha n THR 152 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 2dha n SER 153 N -1.88 0.16 0.25 8.00 3.41 -1.26 0.27 113.62 122.57 2dha n SER 153 Ca -0.03 1.36 -0.13 0.00 -0.26 0.00 0.00 58.87 59.81 2dha n SER 153 Cb 0.36 -0.61 -0.07 0.00 -0.26 0.00 0.00 64.21 63.64 2dha n SER 153 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 175.04 173.75 2dha h ASN 154 N 0.00 -0.56 -0.56 4.04 -0.00 -1.99 0.65 115.58 117.15 2dha h ASN 154 Ca 0.63 -0.07 0.11 0.00 -0.00 0.00 0.00 56.30 56.97 2dha h ASN 154 Cb 1.56 0.14 -0.09 0.00 -0.00 0.00 0.00 38.32 39.93 2dha h ASN 154 CO -0.67 -0.17 0.04 -0.08 -0.00 0.00 0.00 177.43 176.54 2dha h GLU 155 N -1.02 0.16 -0.41 6.67 4.81 -0.46 -0.48 114.58 123.84 2dha h GLU 155 Ca -0.07 -0.01 -0.09 0.00 -0.13 0.00 0.00 59.36 59.06 2dha h GLU 155 Cb 0.59 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.92 2dha h GLU 155 CO 0.11 0.10 -0.12 0.28 -0.73 0.00 0.00 179.01 178.65 2dha h VAL 156 N 0.16 1.26 -0.75 0.32 2.07 -0.77 -3.12 116.25 115.40 2dha h VAL 156 Ca 0.29 -1.16 0.14 0.00 0.82 0.00 0.00 66.70 66.80 2dha h VAL 156 Cb 0.45 1.07 -0.14 0.00 -1.52 0.00 0.00 31.29 31.15 2dha h VAL 156 CO -0.44 0.39 -0.25 0.00 0.02 0.00 0.00 177.57 177.29 2dha h ALA 157 N 1.21 0.35 0.11 1.67 0.00 0.86 -0.26 119.26 123.19 2dha h ALA 157 Ca 0.11 0.27 -0.01 0.00 0.00 0.00 0.00 54.91 55.29 2dha h ALA 157 Cb 0.58 0.68 0.00 0.00 0.00 0.00 0.00 17.79 19.05 2dha h ALA 157 CO 0.04 -0.49 -0.05 1.96 0.00 0.00 0.00 179.25 180.71 2dha h GLN 158 N -0.04 -0.14 -0.81 0.00 4.20 -1.47 0.53 115.11 117.37 2dha h GLN 158 Ca 0.34 0.01 0.20 0.00 0.06 0.00 0.00 58.65 59.26 2dha h GLN 158 Cb 0.57 0.03 -0.13 0.00 0.30 0.00 0.00 27.48 28.25 2dha h GLN 158 CO -0.79 -0.03 0.12 0.35 -0.67 0.00 0.00 178.83 177.81 2dha h PHE 159 N -0.21 0.15 0.00 2.96 3.57 -1.11 0.51 116.94 122.81 2dha h PHE 159 Ca -0.01 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.54 2dha h PHE 159 Cb 0.17 0.06 0.00 0.00 2.79 0.00 0.00 35.95 38.97 2dha h PHE 159 CO -0.05 -0.21 -0.42 -0.07 -2.23 0.00 0.00 178.31 175.33 2dha h LEU 160 N 0.17 0.00 -2.24 0.59 3.38 -1.00 -3.29 115.31 112.92 2dha h LEU 160 Ca 0.47 -0.03 0.05 0.00 0.09 0.00 0.00 57.88 58.46 2dha h LEU 160 Cb 0.89 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.63 2dha h LEU 160 CO -0.65 0.02 0.20 -1.28 0.09 0.00 0.00 178.44 176.81 2dha h SER 161 N 0.00 0.00 -3.21 -0.43 0.87 0.52 -3.41 113.55 107.89 2dha h SER 161 Ca 0.00 0.00 -0.53 0.00 -1.23 0.00 0.00 61.79 60.03 2dha h SER 161 Cb 0.93 0.00 0.02 0.00 -0.44 0.00 0.00 62.40 62.91 2dha h SER 161 CO 0.00 0.00 0.64 -0.54 -0.53 0.00 0.00 176.83 176.40 2dha s LYS 162 N -4.62 4.39 0.21 2.24 -0.14 -1.13 -5.03 119.74 115.67 2dha s LYS 162 Ca -0.05 1.96 0.08 0.00 -1.36 0.00 0.00 55.97 56.60 2dha s LYS 162 Cb 0.15 -3.26 -0.04 0.00 -1.68 0.00 0.00 37.83 33.00 2dha s LYS 162 CO 0.54 -0.30 0.05 -1.83 -0.76 0.00 0.00 175.35 173.05 2dha s GLU 163 N 0.61 2.52 -1.14 1.68 -1.05 -1.26 -4.60 118.70 115.45 2dha s GLU 163 Ca 0.59 -1.15 -0.04 0.00 -0.15 0.00 0.00 54.97 54.22 2dha s GLU 163 Cb -0.34 -2.37 0.00 0.00 -0.44 0.00 0.00 34.13 30.98 2dha s GLU 163 CO 0.33 0.43 0.55 0.09 0.95 0.00 0.00 175.26 177.60 2dha n ASN 164 N -0.53 -5.08 -4.38 0.83 4.13 -1.26 -5.02 115.26 103.96 2dha n ASN 164 Ca -0.08 -0.26 -0.20 0.00 1.68 0.00 0.00 54.58 55.72 2dha n ASN 164 Cb 0.57 -3.88 -0.10 0.00 -1.54 0.00 0.00 39.78 34.83 2dha n ASN 164 CO 0.00 0.00 0.00 -1.10 0.28 0.00 0.00 177.26 176.44 2dha s GLN 165 N -5.53 1.42 -0.27 3.52 -1.52 -1.26 -4.58 119.66 111.44 2dha s GLN 165 Ca 0.27 -1.64 -0.04 0.00 -1.95 0.00 0.00 55.36 52.00 2dha s GLN 165 Cb -0.12 -1.28 0.01 0.00 -0.22 0.00 0.00 33.01 31.40 2dha s GLN 165 CO 0.34 0.22 0.01 0.08 -0.25 0.00 0.00 175.29 175.68 2dha s VAL 166 N -2.86 3.44 0.12 1.09 1.01 0.37 -4.87 120.40 118.70 2dha s VAL 166 Ca 0.24 -0.80 -0.22 0.00 0.00 0.00 0.00 61.98 61.21 2dha s VAL 166 Cb -0.02 -2.74 -0.07 0.00 0.00 0.00 0.00 36.38 33.55 2dha s VAL 166 CO 0.09 0.18 0.66 -0.63 0.00 0.00 0.00 175.10 175.40 2dha s ILE 167 N 1.43 4.58 -0.04 2.22 1.01 -1.23 -1.97 121.20 127.19 2dha s ILE 167 Ca 0.02 1.42 0.06 0.00 0.00 0.00 0.00 60.65 62.15 2dha s ILE 167 Cb -0.17 -3.99 -0.01 0.00 0.01 0.00 0.00 42.46 38.30 2dha s ILE 167 CO -0.01 0.52 -0.23 -0.69 0.00 0.00 0.00 174.94 174.54 2dha s VAL 168 N -1.15 1.83 -0.39 2.92 1.01 -1.05 -0.69 120.40 122.88 2dha s VAL 168 Ca 0.32 -0.96 -0.20 0.00 0.00 0.00 0.00 61.98 61.15 2dha s VAL 168 Cb -0.21 -1.54 0.01 0.00 0.00 0.00 0.00 36.38 34.65 2dha s VAL 168 CO 0.22 0.51 0.60 -0.60 0.00 0.00 0.00 175.10 175.83 2dha s ARG 169 N -0.28 3.46 -0.34 2.72 3.52 0.21 -2.76 118.95 125.49 2dha s ARG 169 Ca 0.02 -0.23 -0.08 0.00 -0.13 0.00 0.00 55.73 55.31 2dha s ARG 169 Cb -0.11 -3.88 0.02 0.00 -1.56 0.00 0.00 34.95 29.42 2dha s ARG 169 CO 0.01 -0.84 0.13 -1.64 -0.81 0.00 0.00 175.30 172.16 2dha s MET 170 N 2.65 2.85 -0.07 5.12 -1.94 0.24 -2.59 119.30 125.56 2dha s MET 170 Ca 0.21 -1.04 0.05 0.00 -1.71 0.00 0.00 55.69 53.21 2dha s MET 170 Cb -0.15 -3.53 -0.01 0.00 2.01 0.00 0.00 34.83 33.15 2dha s MET 170 CO 0.16 -0.60 -0.23 -0.98 -0.01 0.00 0.00 175.02 173.36 2dha s ARG 171 N 1.49 2.74 0.00 2.03 1.70 -1.23 0.85 118.95 126.53 2dha s ARG 171 Ca 0.01 -0.86 0.00 0.00 -0.47 0.00 0.00 55.73 54.41 2dha s ARG 171 Cb -0.19 -2.26 0.00 0.00 -0.57 0.00 0.00 34.95 31.94 2dha s ARG 171 CO 0.04 0.34 0.00 0.41 -1.08 0.00 0.00 175.30 175.01 2dha n GLY 172 N 3.08 1.03 3.73 3.88 0.00 -1.17 -2.84 105.19 112.89 2dha n GLY 172 Ca -0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.43 2dha n GLY 172 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2dha s LEU 173 N 0.00 4.43 0.18 0.99 1.43 -0.93 -4.61 118.68 120.17 2dha s LEU 173 Ca 0.00 2.12 -0.32 0.00 -1.03 0.00 0.00 54.13 54.89 2dha s LEU 173 Cb 0.00 -3.59 -0.16 0.00 0.03 0.00 0.00 46.19 42.47 2dha s LEU 173 CO 0.00 -0.38 1.12 -2.65 0.23 0.00 0.00 176.35 174.67 2dha n PRO 174 N 3.05 1.10 -0.30 1.29 -0.02 -1.26 -4.67 135.00 134.20 2dha n PRO 174 Ca 0.06 0.39 0.23 0.00 -2.02 0.00 0.00 63.50 62.16 2dha n PRO 174 Cb 0.46 -1.86 0.54 0.00 -0.02 0.00 0.00 33.50 32.62 2dha n PRO 174 CO 0.00 0.00 0.00 0.74 1.98 0.00 0.00 175.50 178.22 2dha h PHE 175 N 3.13 0.53 0.07 6.00 -1.00 -1.96 -0.28 116.94 123.43 2dha h PHE 175 Ca -0.42 0.02 -0.18 0.00 2.81 0.00 0.00 57.97 60.19 2dha h PHE 175 Cb 1.35 -0.16 0.02 0.00 3.61 0.00 0.00 35.95 40.77 2dha h PHE 175 CO 0.53 0.07 -0.75 1.79 -1.61 0.00 0.00 178.31 178.34 2dha h THR 176 N 0.34 1.45 -0.78 -1.55 1.35 -2.03 -3.46 112.91 108.22 2dha h THR 176 Ca 0.55 -2.30 -0.62 0.00 -0.55 0.00 0.00 66.41 63.50 2dha h THR 176 Cb 1.51 2.85 0.04 0.00 -1.73 0.00 0.00 68.15 70.82 2dha h THR 176 CO -0.22 0.66 0.10 0.00 -0.25 0.00 0.00 175.52 175.81 2dha n ALA 177 N -2.63 -2.76 -4.56 6.62 0.00 -0.12 -4.95 120.51 112.12 2dha n ALA 177 Ca -0.12 0.46 -0.28 0.00 0.00 0.00 0.00 53.44 53.50 2dha n ALA 177 Cb 0.76 -1.38 -0.06 0.00 0.00 0.00 0.00 19.45 18.77 2dha n ALA 177 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2dha n THR 178 N 1.37 0.00 -0.31 0.00 -2.24 -1.26 -4.88 114.28 106.96 2dha n THR 178 Ca 0.16 -2.17 0.01 0.00 -2.27 0.00 0.00 64.05 59.78 2dha n THR 178 Cb 0.05 0.58 0.15 0.00 -2.10 0.00 0.00 70.33 69.01 2dha n THR 178 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2dha h ALA 179 N 1.40 1.19 -0.56 6.98 0.00 -1.96 -1.05 119.26 125.26 2dha h ALA 179 Ca -0.34 -0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.60 2dha h ALA 179 Cb 1.14 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.68 2dha h ALA 179 CO 0.56 0.25 0.37 0.93 0.00 0.00 0.00 179.25 181.36 2dha h GLU 180 N 0.94 0.62 -0.30 0.00 5.08 -1.96 -0.97 114.58 118.00 2dha h GLU 180 Ca 0.38 -0.04 -0.14 0.00 -1.00 0.00 0.00 59.36 58.56 2dha h GLU 180 Cb 0.21 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 2dha h GLU 180 CO -0.19 0.41 -0.39 0.93 -1.00 0.00 0.00 179.01 178.78 2dha h GLU 181 N 0.64 0.71 -0.13 2.33 5.08 -1.60 -3.22 114.58 118.39 2dha h GLU 181 Ca 0.23 -0.36 -0.04 0.00 -1.00 0.00 0.00 59.36 58.18 2dha h GLU 181 Cb 0.10 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.36 2dha h GLU 181 CO -0.06 0.97 -0.09 0.28 -1.00 0.00 0.00 179.01 179.12 2dha h VAL 182 N 0.58 1.33 -0.90 3.13 2.07 -0.85 -2.61 116.25 119.01 2dha h VAL 182 Ca 0.05 -1.17 0.19 0.00 0.82 0.00 0.00 66.70 66.59 2dha h VAL 182 Cb 0.92 1.82 -0.17 0.00 -1.52 0.00 0.00 31.29 32.35 2dha h VAL 182 CO 0.08 0.34 -0.18 0.52 0.02 0.00 0.00 177.57 178.35 2dha n VAL 183 N -4.64 -0.38 -0.02 2.57 0.31 -0.46 0.12 118.33 115.84 2dha n VAL 183 Ca -0.06 2.04 -0.16 0.00 -0.01 0.00 0.00 64.34 66.15 2dha n VAL 183 Cb 0.31 -2.85 -0.10 0.00 -0.91 0.00 0.00 33.84 30.29 2dha n VAL 183 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2dha h ALA 184 N 1.79 0.13 -0.50 3.52 0.00 -1.64 0.23 119.26 122.79 2dha h ALA 184 Ca 0.45 -0.50 0.05 0.00 0.00 0.00 0.00 54.91 54.91 2dha h ALA 184 Cb 0.74 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.47 2dha h ALA 184 CO -0.91 0.28 -0.30 0.34 0.00 0.00 0.00 179.25 178.67 2dha n PHE 185 N -4.31 -0.22 0.09 0.00 -0.00 0.12 -1.10 117.46 112.04 2dha n PHE 185 Ca -0.09 0.63 0.08 0.00 -0.00 0.00 0.00 57.45 58.07 2dha n PHE 185 Cb 0.58 -0.51 -0.01 0.00 -0.00 0.00 0.00 39.48 39.54 2dha n PHE 185 CO 0.00 0.00 0.00 0.74 -0.00 0.00 0.00 176.76 177.50 2dha h PHE 186 N 0.00 0.00 -0.64 -5.13 0.04 -1.57 -3.35 116.94 106.29 2dha h PHE 186 Ca 0.08 0.00 0.19 0.00 2.80 0.00 0.00 57.97 61.04 2dha h PHE 186 Cb 0.21 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.33 2dha h PHE 186 CO -0.84 0.16 0.66 0.78 -0.60 0.00 0.00 178.31 178.47 2dha h GLY 187 N 3.91 0.00 0.00 -1.45 0.00 0.11 1.34 103.07 106.98 2dha h GLY 187 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.29 2dha h GLY 187 CO 0.01 0.00 0.00 -0.18 0.00 0.00 0.00 176.54 176.37 2dha n GLN 188 N -3.67 0.00 -0.00 4.80 7.27 -0.95 -4.28 117.38 120.55 2dha n GLN 188 Ca 0.13 0.73 0.01 0.00 0.07 0.00 0.00 57.00 57.94 2dha n GLN 188 Cb 0.89 -1.45 -0.01 0.00 2.41 0.00 0.00 30.24 32.07 2dha n GLN 188 CO 0.00 0.00 0.00 0.72 0.07 0.00 0.00 177.06 177.85 2dha n HIS 189 N -2.39 0.00 -3.92 3.69 8.25 -1.04 -4.87 115.22 114.93 2dha n HIS 189 Ca 0.00 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.17 2dha n HIS 189 Cb 0.00 -0.03 -0.13 0.00 1.12 0.00 0.00 29.99 30.95 2dha n HIS 189 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2dha s PRO 191 N -0.84 4.34 0.30 0.00 0.04 -1.18 -2.92 135.00 134.73 2dha s PRO 191 Ca 0.21 2.03 -0.27 0.00 0.04 0.00 0.00 61.00 63.01 2dha s PRO 191 Cb -0.16 -3.26 -0.10 0.00 0.04 0.00 0.00 34.50 31.03 2dha s PRO 191 CO -0.08 -0.41 0.97 0.42 0.04 0.00 0.00 177.00 177.94 2dha s ILE 192 N 1.09 4.06 -0.61 0.56 1.01 -1.26 -4.63 121.20 121.41 2dha s ILE 192 Ca 0.64 1.82 -0.26 0.00 0.00 0.00 0.00 60.65 62.85 2dha s ILE 192 Cb -0.36 -4.06 -0.04 0.00 0.01 0.00 0.00 42.46 38.01 2dha s ILE 192 CO 0.30 0.25 2.04 -0.89 0.00 0.00 0.00 174.94 176.64 2dha s THR 193 N -1.46 3.25 0.00 2.92 2.01 -1.11 -1.93 115.64 119.32 2dha s THR 193 Ca 0.48 0.09 0.00 0.00 0.31 0.00 0.00 61.69 62.56 2dha s THR 193 Cb -0.22 -3.65 0.00 0.00 0.01 0.00 0.00 72.50 68.63 2dha s THR 193 CO 0.28 -0.63 0.00 0.61 -0.69 0.00 0.00 174.62 174.19 2dha n GLY 194 N 5.94 1.10 7.00 4.40 0.00 -1.26 -2.86 105.19 119.51 2dha n GLY 194 Ca 0.28 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.30 2dha n GLY 194 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dha n GLY 195 N -2.00 3.49 0.52 -0.02 0.00 -0.81 -1.78 105.19 104.59 2dha n GLY 195 Ca 0.00 0.24 0.33 0.00 0.00 0.00 0.00 46.02 46.59 2dha n GLY 195 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2dha h LYS 196 N 0.00 0.00 0.00 1.61 2.10 -1.91 1.17 116.57 119.54 2dha h LYS 196 Ca 0.00 0.00 -0.19 0.00 -2.00 0.00 0.00 60.65 58.46 2dha h LYS 196 Cb 0.00 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 31.30 2dha h LYS 196 CO 0.00 0.00 -0.91 0.93 -2.00 0.00 0.00 179.45 177.47 2dha h GLU 197 N 0.00 0.00 -1.33 0.07 4.39 -1.63 -3.28 114.58 112.80 2dha h GLU 197 Ca 0.52 0.00 -0.55 0.00 0.34 0.00 0.00 59.36 59.67 2dha h GLU 197 Cb 2.26 0.00 -0.23 0.00 -0.10 0.00 0.00 28.75 30.68 2dha h GLU 197 CO -0.01 0.91 0.70 0.41 -1.16 0.00 0.00 179.01 179.86 2dha n GLY 198 N 1.13 5.13 2.88 -3.84 0.00 0.40 -4.86 105.19 106.03 2dha n GLY 198 Ca -0.00 -1.87 -0.13 0.00 0.00 0.00 0.00 46.02 44.02 2dha n GLY 198 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2dha s ILE 199 N -3.79 -0.01 -0.17 -0.61 1.01 -1.18 -0.90 121.20 115.55 2dha s ILE 199 Ca 0.52 0.04 -0.02 0.00 0.00 0.00 0.00 60.65 61.18 2dha s ILE 199 Cb 0.40 -0.06 0.05 0.00 0.01 0.00 0.00 42.46 42.87 2dha s ILE 199 CO -0.05 0.01 0.00 -0.22 0.00 0.00 0.00 174.94 174.69 2dha s LEU 200 N 0.20 1.25 -0.41 2.97 2.96 0.80 -5.00 118.68 121.45 2dha s LEU 200 Ca -0.02 -0.67 -0.17 0.00 -0.22 0.00 0.00 54.13 53.05 2dha s LEU 200 Cb -0.02 -0.67 0.02 0.00 0.50 0.00 0.00 46.19 46.01 2dha s LEU 200 CO -0.01 -0.25 0.43 -0.36 -1.32 0.00 0.00 176.35 174.85 2dha s PHE 201 N 1.80 3.17 0.08 5.38 0.08 -1.26 -0.09 117.98 127.14 2dha s PHE 201 Ca 0.00 -0.31 -0.31 0.00 0.12 0.00 0.00 56.93 56.43 2dha s PHE 201 Cb -0.16 -2.88 -0.08 0.00 -0.57 0.00 0.00 43.02 39.34 2dha s PHE 201 CO -0.07 -0.67 1.50 0.08 -0.10 0.00 0.00 175.22 175.96 2dha s VAL 202 N 2.15 3.21 0.00 -0.44 1.01 -1.02 -5.01 120.40 120.29 2dha s VAL 202 Ca 0.12 0.76 0.03 0.00 0.00 0.00 0.00 61.98 62.90 2dha s VAL 202 Cb -0.17 -3.49 -0.01 0.00 0.00 0.00 0.00 36.38 32.71 2dha s VAL 202 CO 0.13 0.03 -0.10 0.42 0.00 0.00 0.00 175.10 175.58 2dha s THR 203 N 1.88 0.79 0.90 3.92 -4.23 -1.26 -2.95 115.64 114.69 2dha s THR 203 Ca 0.68 -0.54 -0.16 0.00 -1.18 0.00 0.00 61.69 60.49 2dha s THR 203 Cb -0.38 -0.69 -0.07 0.00 1.34 0.00 0.00 72.50 72.71 2dha s THR 203 CO 0.30 0.14 -0.14 -1.22 -0.54 0.00 0.00 174.62 173.16 2dha n TYR 204 N 2.60 -3.11 0.98 3.99 4.01 0.13 -4.77 117.16 121.01 2dha n TYR 204 Ca -0.15 0.15 0.05 0.00 -0.16 0.00 0.00 57.90 57.80 2dha n TYR 204 Cb 0.56 -1.64 0.32 0.00 -0.31 0.00 0.00 39.34 38.26 2dha n TYR 204 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 2dha n PRO 205 N 0.54 0.49 -0.00 -0.72 -0.04 -1.26 -1.89 135.00 132.11 2dha n PRO 205 Ca 0.04 0.00 0.04 0.00 -0.04 0.00 0.00 63.50 63.53 2dha n PRO 205 Cb 0.53 -1.34 -0.06 0.00 -0.04 0.00 0.00 33.50 32.60 2dha n PRO 205 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2dha n ASP 206 N -0.84 2.07 0.00 3.54 -0.08 -1.26 -5.04 116.55 114.94 2dha n ASP 206 Ca 0.08 -0.27 0.00 0.00 -1.51 0.00 0.00 54.79 53.09 2dha n ASP 206 Cb 0.04 1.22 0.00 0.00 2.34 0.00 0.00 41.12 44.72 2dha n ASP 206 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2dha n GLY 207 N 1.71 0.73 3.30 0.27 0.00 -0.79 -5.15 105.19 105.24 2dha n GLY 207 Ca -0.00 -0.79 -0.14 0.00 0.00 0.00 0.00 46.02 45.09 2dha n GLY 207 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2dha s ARG 208 N -1.31 0.78 -0.04 1.61 0.52 -1.26 -4.93 118.95 114.32 2dha s ARG 208 Ca 0.00 -0.18 -0.30 0.00 -0.52 0.00 0.00 55.73 54.73 2dha s ARG 208 Cb 0.00 0.35 -0.05 0.00 0.52 0.00 0.00 34.95 35.77 2dha s ARG 208 CO 0.00 -0.23 1.48 -1.25 0.02 0.00 0.00 175.30 175.32 2dha s PRO 209 N -1.59 4.23 0.15 3.54 0.04 -1.26 0.23 135.00 140.34 2dha s PRO 209 Ca -0.11 2.01 0.21 0.00 0.04 0.00 0.00 61.00 63.15 2dha s PRO 209 Cb -0.03 -3.75 -0.06 0.00 0.04 0.00 0.00 34.50 30.70 2dha s PRO 209 CO 0.03 -0.71 0.94 0.25 0.04 0.00 0.00 177.00 177.56 2dha n THR 210 N 5.08 0.72 0.00 1.26 -2.24 -1.15 -4.84 114.28 113.10 2dha n THR 210 Ca 0.15 -0.58 0.00 0.00 -2.27 0.00 0.00 64.05 61.35 2dha n THR 210 Cb 0.43 -0.41 0.00 0.00 -2.10 0.00 0.00 70.33 68.25 2dha n THR 210 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2dha n GLY 211 N 1.24 2.80 3.86 3.38 0.00 -1.26 -4.93 105.19 110.28 2dha n GLY 211 Ca -0.03 -0.52 -0.31 0.00 0.00 0.00 0.00 46.02 45.16 2dha n GLY 211 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2dha s ASP 212 N 0.25 6.47 0.30 1.61 -4.77 -1.26 -2.18 116.67 117.10 2dha s ASP 212 Ca 0.00 1.47 -0.20 0.00 -3.30 0.00 0.00 52.55 50.52 2dha s ASP 212 Cb 0.00 -2.47 0.04 0.00 -1.09 0.00 0.00 42.92 39.39 2dha s ASP 212 CO 0.00 -0.67 0.77 0.00 0.70 0.00 0.00 175.17 175.97 2dha s ALA 213 N -2.80 -1.12 0.02 2.11 0.00 0.25 -2.45 121.76 117.77 2dha s ALA 213 Ca 0.57 -0.41 -0.00 0.00 0.00 0.00 0.00 51.96 52.11 2dha s ALA 213 Cb -0.10 0.78 -0.02 0.00 0.00 0.00 0.00 23.12 23.78 2dha s ALA 213 CO 0.39 -1.03 -0.02 -0.06 0.00 0.00 0.00 175.76 175.05 2dha s PHE 214 N -3.34 0.23 0.14 0.00 0.08 0.87 -0.59 117.98 115.37 2dha s PHE 214 Ca 0.13 -0.46 0.05 0.00 0.12 0.00 0.00 56.93 56.76 2dha s PHE 214 Cb -0.05 -0.17 -0.04 0.00 -0.57 0.00 0.00 43.02 42.19 2dha s PHE 214 CO 0.08 -0.18 -0.10 0.08 -0.10 0.00 0.00 175.22 175.00 2dha s VAL 215 N -1.33 1.17 -0.02 -0.44 1.01 -1.11 -0.14 120.40 119.54 2dha s VAL 215 Ca -0.15 -2.01 0.01 0.00 0.00 0.00 0.00 61.98 59.83 2dha s VAL 215 Cb -0.09 -1.80 -0.03 0.00 0.00 0.00 0.00 36.38 34.46 2dha s VAL 215 CO -0.01 -0.71 -0.02 -0.76 0.00 0.00 0.00 175.10 173.60 2dha s LEU 216 N -3.08 3.39 0.02 3.92 1.43 -0.08 -2.51 118.68 121.78 2dha s LEU 216 Ca 0.15 -0.02 0.02 0.00 -1.03 0.00 0.00 54.13 53.25 2dha s LEU 216 Cb 0.02 -1.89 -0.01 0.00 0.03 0.00 0.00 46.19 44.33 2dha s LEU 216 CO 0.01 0.31 -0.06 -0.36 0.23 0.00 0.00 176.35 176.47 2dha s PHE 217 N -0.99 0.53 0.05 0.29 0.08 -0.83 -2.76 117.98 114.34 2dha s PHE 217 Ca 0.17 -0.30 -0.29 0.00 0.12 0.00 0.00 56.93 56.63 2dha s PHE 217 Cb -0.11 -0.33 -0.16 0.00 -0.57 0.00 0.00 43.02 41.85 2dha s PHE 217 CO 0.07 -0.05 1.43 0.00 -0.10 0.00 0.00 175.22 176.57 2dha h ALA 218 N 5.23 -1.24 -2.91 5.36 0.00 -1.85 0.11 119.26 123.95 2dha h ALA 218 Ca -0.32 -0.21 -0.45 0.00 0.00 0.00 0.00 54.91 53.93 2dha h ALA 218 Cb 1.20 0.45 -0.12 0.00 0.00 0.00 0.00 17.79 19.31 2dha h ALA 218 CO 0.45 -1.18 -0.45 0.00 0.00 0.00 0.00 179.25 178.07 2dha h GLU 220 N 2.13 0.77 -1.00 0.00 5.08 -1.96 -2.41 114.58 117.19 2dha h GLU 220 Ca -0.25 -0.05 0.29 0.00 -1.00 0.00 0.00 59.36 58.35 2dha h GLU 220 Cb 1.23 -0.17 -0.19 0.00 0.50 0.00 0.00 28.75 30.12 2dha h GLU 220 CO 0.37 0.51 0.09 1.49 -1.00 0.00 0.00 179.01 180.46 2dha h GLU 221 N 0.79 0.00 0.00 2.33 4.57 -1.98 0.84 114.58 121.13 2dha h GLU 221 Ca 0.31 -0.00 -0.11 0.00 -1.18 0.00 0.00 59.36 58.38 2dha h GLU 221 Cb 0.21 -0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.79 2dha h GLU 221 CO -0.10 0.00 -0.58 1.88 -1.18 0.00 0.00 179.01 179.03 2dha h TYR 222 N 0.00 0.01 0.24 0.92 0.05 -1.79 -3.18 116.97 113.22 2dha h TYR 222 Ca 0.63 -0.01 -0.00 0.00 0.05 0.00 0.00 58.73 59.41 2dha h TYR 222 Cb 1.37 -0.00 -0.02 0.00 1.01 0.00 0.00 36.73 39.09 2dha h TYR 222 CO -0.45 1.23 -0.35 0.00 -1.05 0.00 0.00 178.16 177.54 2dha h ALA 223 N -0.22 -0.96 -0.41 3.88 0.00 -0.84 0.23 119.26 120.93 2dha h ALA 223 Ca -0.16 -0.11 0.09 0.00 0.00 0.00 0.00 54.91 54.73 2dha h ALA 223 Cb 1.15 0.65 -0.09 0.00 0.00 0.00 0.00 17.79 19.50 2dha h ALA 223 CO -0.09 -1.01 -0.24 1.96 0.00 0.00 0.00 179.25 179.87 2dha h GLN 224 N -0.62 -0.16 -0.05 0.00 1.08 0.44 0.37 115.11 116.16 2dha h GLN 224 Ca -0.03 0.01 0.02 0.00 -1.45 0.00 0.00 58.65 57.20 2dha h GLN 224 Cb 0.56 0.04 -0.00 0.00 -0.05 0.00 0.00 27.48 28.03 2dha h GLN 224 CO -0.10 -0.11 0.05 -0.91 -0.95 0.00 0.00 178.83 176.81 2dha h ASN 225 N -0.17 0.00 0.88 1.46 2.35 -1.49 -0.17 115.58 118.44 2dha h ASN 225 Ca 0.19 0.00 -0.14 0.00 -0.55 0.00 0.00 56.30 55.81 2dha h ASN 225 Cb 0.48 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.83 2dha h ASN 225 CO -0.51 0.00 -0.65 0.00 -1.65 0.00 0.00 177.43 174.62 2dha h ALA 226 N 1.94 0.78 0.00 -0.83 0.00 0.31 -3.12 119.26 118.35 2dha h ALA 226 Ca 0.02 -0.59 -0.02 0.00 0.00 0.00 0.00 54.91 54.32 2dha h ALA 226 Cb 0.13 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 2dha h ALA 226 CO -0.00 0.81 -0.11 -0.07 0.00 0.00 0.00 179.25 179.88 2dha h LEU 227 N 0.00 0.00 -2.73 0.00 3.38 0.10 -1.29 115.31 114.77 2dha h LEU 227 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2dha h LEU 227 Cb 1.26 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.01 2dha h LEU 227 CO 0.08 0.11 0.00 0.03 0.09 0.00 0.00 178.44 178.76 2dha h ARG 228 N 0.00 0.00 -0.01 1.13 3.08 -1.57 0.13 114.38 117.14 2dha h ARG 228 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2dha h ARG 228 Cb 0.20 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.25 2dha h ARG 228 CO 0.01 0.00 0.00 1.63 -1.07 0.00 0.00 179.97 180.54 2dha n LYS 229 N -3.00 1.20 -0.97 0.04 5.02 -0.49 -4.94 118.16 115.02 2dha n LYS 229 Ca -0.03 -0.30 -0.36 0.00 -2.02 0.00 0.00 58.31 55.61 2dha n LYS 229 Cb 0.09 -1.47 -0.04 0.00 -0.02 0.00 0.00 35.03 33.59 2dha n LYS 229 CO 0.00 0.00 0.00 1.58 -0.52 0.00 0.00 177.40 178.46 2dha n HIS 230 N -0.61 0.04 -2.64 2.13 -0.00 0.45 0.46 115.22 115.05 2dha n HIS 230 Ca 0.21 0.68 -0.21 0.00 -0.00 0.00 0.00 57.72 58.40 2dha n HIS 230 Cb 0.18 -1.36 0.01 0.00 -0.00 0.00 0.00 29.99 28.82 2dha n HIS 230 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.34 177.97 2dha n LYS 231 N 0.83 -2.95 -0.44 1.57 5.02 0.25 -4.93 118.16 117.52 2dha n LYS 231 Ca 0.13 0.94 -0.27 0.00 -2.02 0.00 0.00 58.31 57.09 2dha n LYS 231 Cb 0.11 -5.64 0.23 0.00 -0.02 0.00 0.00 35.03 29.71 2dha n LYS 231 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 2dha n ASP 232 N -2.07 -3.05 -3.80 4.39 2.03 0.17 -4.27 116.55 109.96 2dha n ASP 232 Ca -0.19 -0.46 -0.29 0.00 0.52 0.00 0.00 54.79 54.37 2dha n ASP 232 Cb 0.65 -0.98 -0.16 0.00 -0.72 0.00 0.00 41.12 39.92 2dha n ASP 232 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2dha s LEU 233 N -4.34 2.00 -0.26 -2.67 1.43 -1.26 -0.59 118.68 112.99 2dha s LEU 233 Ca 0.57 -1.22 -0.02 0.00 -1.03 0.00 0.00 54.13 52.43 2dha s LEU 233 Cb -0.13 -0.87 0.03 0.00 0.03 0.00 0.00 46.19 45.24 2dha s LEU 233 CO 0.54 -0.32 -0.04 -0.22 0.23 0.00 0.00 176.35 176.54 2dha s LEU 234 N 1.63 3.38 -1.40 1.79 0.20 -0.74 -4.67 118.68 118.86 2dha s LEU 234 Ca 0.01 -0.92 -0.08 0.00 0.69 0.00 0.00 54.13 53.83 2dha s LEU 234 Cb -0.18 -1.69 0.04 0.00 -0.43 0.00 0.00 46.19 43.93 2dha s LEU 234 CO -0.13 -0.16 1.02 0.61 -0.29 0.00 0.00 176.35 177.40 2dha n GLY 235 N 4.68 -0.47 2.76 7.98 0.00 -1.26 -2.60 105.19 116.28 2dha n GLY 235 Ca -0.16 0.20 -0.12 0.00 0.00 0.00 0.00 46.02 45.94 2dha n GLY 235 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2dha n LYS 236 N -4.68 -3.99 -3.46 1.61 4.76 -1.26 -5.04 118.16 106.11 2dha n LYS 236 Ca -0.06 0.62 -0.03 0.00 -2.87 0.00 0.00 58.31 55.97 2dha n LYS 236 Cb 0.58 -4.86 -0.05 0.00 -1.84 0.00 0.00 35.03 28.85 2dha n LYS 236 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 2dha s ARG 237 N -4.73 0.47 0.15 1.97 1.81 -1.07 -5.14 118.95 112.40 2dha s ARG 237 Ca 0.08 1.05 -0.31 0.00 -1.72 0.00 0.00 55.73 54.84 2dha s ARG 237 Cb -0.01 0.39 -0.08 0.00 -0.45 0.00 0.00 34.95 34.79 2dha s ARG 237 CO 0.53 -0.41 1.39 0.71 -0.68 0.00 0.00 175.30 176.84 2dha s TYR 238 N 2.75 3.21 -0.07 -0.53 2.02 -1.26 -1.79 117.35 121.68 2dha s TYR 238 Ca 0.06 0.99 0.02 0.00 -0.37 0.00 0.00 57.07 57.77 2dha s TYR 238 Cb -0.13 -3.70 0.02 0.00 -0.40 0.00 0.00 41.96 37.75 2dha s TYR 238 CO -0.17 -2.38 -0.11 0.42 -1.57 0.00 0.00 175.55 171.74 2dha s ILE 239 N 0.78 1.09 0.46 2.71 1.01 0.24 -4.77 121.20 122.71 2dha s ILE 239 Ca 0.63 -0.43 -0.05 0.00 0.00 0.00 0.00 60.65 60.80 2dha s ILE 239 Cb -0.38 -1.02 -0.04 0.00 0.01 0.00 0.00 42.46 41.04 2dha s ILE 239 CO 0.33 0.35 0.75 -1.61 0.00 0.00 0.00 174.94 174.77 2dha s GLU 240 N 0.85 3.55 0.00 2.79 2.02 -1.13 -0.41 118.70 126.37 2dha s GLU 240 Ca -0.11 0.14 -0.02 0.00 0.02 0.00 0.00 54.97 54.99 2dha s GLU 240 Cb -0.15 -2.42 -0.01 0.00 0.10 0.00 0.00 34.13 31.66 2dha s GLU 240 CO 0.01 -0.15 0.04 -0.51 0.02 0.00 0.00 175.26 174.68 2dha s LEU 241 N -4.63 1.91 0.06 1.80 1.43 -1.26 -3.58 118.68 114.40 2dha s LEU 241 Ca 0.47 -0.20 -0.25 0.00 -1.03 0.00 0.00 54.13 53.11 2dha s LEU 241 Cb -0.10 0.27 0.06 0.00 0.03 0.00 0.00 46.19 46.45 2dha s LEU 241 CO 0.43 -0.21 0.59 -0.36 0.23 0.00 0.00 176.35 177.02 2dha s PHE 242 N -0.89 -0.52 0.23 0.29 0.08 -1.07 -4.88 117.98 111.21 2dha s PHE 242 Ca -0.10 0.59 -0.30 0.00 0.12 0.00 0.00 56.93 57.24 2dha s PHE 242 Cb -0.06 0.43 -0.09 0.00 -0.57 0.00 0.00 43.02 42.73 2dha s PHE 242 CO -0.00 -0.70 1.30 1.03 -0.10 0.00 0.00 175.22 176.75 2dha s ARG 243 N -2.57 4.39 0.16 0.44 0.52 -1.26 -0.61 118.95 120.02 2dha s ARG 243 Ca -0.05 2.07 0.02 0.00 -0.52 0.00 0.00 55.73 57.26 2dha s ARG 243 Cb -0.01 -3.17 -0.05 0.00 0.52 0.00 0.00 34.95 32.25 2dha s ARG 243 CO -0.03 -0.22 -0.01 0.45 0.02 0.00 0.00 175.30 175.51 2dha s SER 244 N 0.14 1.22 0.04 0.23 0.15 0.13 -4.67 113.70 110.94 2dha s SER 244 Ca 0.55 -1.15 -0.01 0.00 0.70 0.00 0.00 55.95 56.05 2dha s SER 244 Cb -0.37 0.11 -0.03 0.00 -1.71 0.00 0.00 66.02 64.02 2dha s SER 244 CO 0.41 -0.55 -0.03 0.42 1.20 0.00 0.00 173.24 174.69 2dha s THR 245 N -3.64 0.21 0.21 6.45 -4.23 -1.26 -3.56 115.64 109.81 2dha s THR 245 Ca 0.22 -1.51 -0.11 0.00 -1.18 0.00 0.00 61.69 59.11 2dha s THR 245 Cb 0.06 -1.10 0.28 0.00 1.34 0.00 0.00 72.50 73.08 2dha s THR 245 CO 0.03 -0.82 1.26 0.00 -0.54 0.00 0.00 174.62 174.55 2dha n ALA 246 N 0.61 0.04 0.08 3.99 0.00 -1.26 0.50 120.51 124.47 2dha n ALA 246 Ca -0.17 0.85 -0.12 0.00 0.00 0.00 0.00 53.44 54.00 2dha n ALA 246 Cb 0.59 -0.44 -0.05 0.00 0.00 0.00 0.00 19.45 19.55 2dha n ALA 246 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dha h ALA 247 N 1.35 -0.22 -0.52 0.00 0.00 -2.01 -2.66 119.26 115.21 2dha h ALA 247 Ca 0.33 -0.01 0.10 0.00 0.00 0.00 0.00 54.91 55.34 2dha h ALA 247 Cb 0.53 0.25 -0.10 0.00 0.00 0.00 0.00 17.79 18.48 2dha h ALA 247 CO -0.82 -0.66 -0.12 1.49 0.00 0.00 0.00 179.25 179.14 2dha h GLU 248 N -0.28 0.01 -0.02 0.00 4.57 -0.34 -2.44 114.58 116.08 2dha h GLU 248 Ca 0.03 -0.00 0.01 0.00 -1.18 0.00 0.00 59.36 58.22 2dha h GLU 248 Cb 0.31 -0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.88 2dha h GLU 248 CO -0.11 0.00 -0.19 0.28 -1.18 0.00 0.00 179.01 177.81 2dha h VAL 249 N 0.01 0.00 -0.99 0.32 2.07 -0.87 0.13 116.25 116.92 2dha h VAL 249 Ca 0.25 0.00 0.34 0.00 0.82 0.00 0.00 66.70 68.11 2dha h VAL 249 Cb 0.38 0.00 -0.18 0.00 -1.52 0.00 0.00 31.29 29.97 2dha h VAL 249 CO -0.53 0.00 0.31 1.56 0.02 0.00 0.00 177.57 178.94 2dha h GLN 250 N -0.23 0.03 -0.14 1.57 4.20 -1.20 0.62 115.11 119.95 2dha h GLN 250 Ca 0.01 -0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 2dha h GLN 250 Cb 0.25 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.02 2dha h GLN 250 CO -0.14 0.02 0.05 1.96 -0.67 0.00 0.00 178.83 180.05 2dha h GLN 251 N 0.03 0.22 -0.46 1.46 4.20 -0.80 -2.16 115.11 117.61 2dha h GLN 251 Ca 0.72 -0.05 0.03 0.00 0.06 0.00 0.00 58.65 59.42 2dha h GLN 251 Cb 1.73 -0.03 -0.04 0.00 0.30 0.00 0.00 27.48 29.44 2dha h GLN 251 CO -0.82 0.34 0.24 0.28 -0.67 0.00 0.00 178.83 178.21 2dha h VAL 252 N 0.06 0.98 -0.17 -0.54 2.07 0.21 -0.27 116.25 118.59 2dha h VAL 252 Ca 0.05 -0.17 0.03 0.00 0.82 0.00 0.00 66.70 67.43 2dha h VAL 252 Cb 0.21 0.46 -0.03 0.00 -1.52 0.00 0.00 31.29 30.41 2dha h VAL 252 CO -0.00 0.09 -0.01 -0.07 0.02 0.00 0.00 177.57 177.60 2dha h LEU 253 N 0.48 -0.08 0.12 2.57 3.38 -0.95 -2.86 115.31 117.98 2dha h LEU 253 Ca 0.20 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.20 2dha h LEU 253 Cb 0.09 0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.91 2dha h LEU 253 CO -0.13 -0.02 -0.06 0.78 0.09 0.00 0.00 178.44 179.11 2dha h ASN 254 N 0.05 -0.14 -0.95 -0.43 2.35 -1.05 -1.40 115.58 114.02 2dha h ASN 254 Ca 0.08 0.00 0.17 0.00 -0.55 0.00 0.00 56.30 56.00 2dha h ASN 254 Cb 0.10 0.04 -0.17 0.00 0.05 0.00 0.00 38.32 38.34 2dha h ASN 254 CO -0.14 -0.09 -0.30 -1.14 -1.65 0.00 0.00 177.43 174.10 2dha n ARG 255 N -5.16 -0.15 -0.00 0.81 0.63 -0.14 -0.58 116.66 112.07 2dha n ARG 255 Ca -0.08 1.46 -0.13 0.00 -0.92 0.00 0.00 57.85 58.18 2dha n ARG 255 Cb 0.09 -2.18 -0.10 0.00 0.45 0.00 0.00 32.46 30.72 2dha n ARG 255 CO 0.00 0.00 0.00 0.74 -2.51 0.00 0.00 177.63 175.86 2dha h PHE 256 N 0.00 -0.03 -3.07 -0.14 0.04 -1.36 -3.44 116.94 108.96 2dha h PHE 256 Ca 0.39 -0.00 -0.53 0.00 2.80 0.00 0.00 57.97 60.63 2dha h PHE 256 Cb 0.63 0.01 0.22 0.00 2.20 0.00 0.00 35.95 39.01 2dha h PHE 256 CO -0.78 0.45 -0.83 0.43 -0.60 0.00 0.00 178.31 176.97 2dha n SER 257 N -4.87 -2.66 -4.34 2.17 7.64 0.26 -2.67 113.62 109.15 2dha n SER 257 Ca -0.08 0.25 -0.32 0.00 1.01 0.00 0.00 58.87 59.73 2dha n SER 257 Cb 0.25 -1.11 -0.10 0.00 -1.01 0.00 0.00 64.21 62.24 2dha n SER 257 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2dha n SER 258 N -0.65 0.67 -4.33 6.43 2.88 -1.26 -4.86 113.62 112.50 2dha n SER 258 Ca 0.05 -1.27 -0.47 0.00 -1.33 0.00 0.00 58.87 55.85 2dha n SER 258 Cb 0.55 -1.61 -0.03 0.00 -0.75 0.00 0.00 64.21 62.37 2dha n SER 258 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2dha s ALA 259 N -4.27 3.95 -0.02 -1.46 0.00 -1.09 -5.03 121.76 113.85 2dha s ALA 259 Ca 0.08 -3.12 -0.30 0.00 0.00 0.00 0.00 51.96 48.63 2dha s ALA 259 Cb -0.05 -3.49 -0.08 0.00 0.00 0.00 0.00 23.12 19.50 2dha s ALA 259 CO 1.00 -2.25 2.02 0.45 0.00 0.00 0.00 175.76 176.98 2dha s SER 260 N 2.55 6.24 0.00 0.00 0.15 -1.26 -4.86 113.70 116.51 2dha s SER 260 Ca 0.15 2.51 0.00 0.00 0.70 0.00 0.00 55.95 59.32 2dha s SER 260 Cb -0.14 -2.53 0.00 0.00 -1.71 0.00 0.00 66.02 61.64 2dha s SER 260 CO -0.06 -1.24 0.00 0.61 1.20 0.00 0.00 173.24 173.74 2dha n GLY 261 N 4.80 1.05 3.63 9.45 0.00 -1.26 -4.04 105.19 118.83 2dha n GLY 261 Ca 0.22 -0.75 -0.43 0.00 0.00 0.00 0.00 46.02 45.06 2dha n GLY 261 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dha s PRO 262 N -0.55 3.82 -0.08 1.61 0.04 -1.26 -5.16 135.00 133.42 2dha s PRO 262 Ca 0.00 1.67 -0.18 0.00 0.04 0.00 0.00 61.00 62.53 2dha s PRO 262 Cb 0.00 -4.03 0.04 0.00 0.04 0.00 0.00 34.50 30.55 2dha s PRO 262 CO 0.00 -1.26 0.43 -1.12 0.04 0.00 0.00 177.00 175.08 2dha s SER 263 N 4.13 -0.38 0.51 6.66 0.01 -1.26 -5.18 113.70 118.20 2dha s SER 263 Ca 0.71 0.51 0.08 0.00 1.31 0.00 0.00 55.95 58.57 2dha s SER 263 Cb -0.25 0.59 0.05 0.00 0.21 0.00 0.00 66.02 66.62 2dha s SER 263 CO 0.29 -0.36 0.63 -0.55 0.41 0.00 0.00 173.24 173.66 2dha s SER 264 N -0.69 5.18 0.00 2.44 0.15 -1.26 -5.02 113.70 114.50 2dha s SER 264 Ca -0.08 -0.78 0.00 0.00 0.70 0.00 0.00 55.95 55.79 2dha s SER 264 Cb -0.04 -0.04 0.00 0.00 -1.71 0.00 0.00 66.02 64.23 2dha s SER 264 CO 0.04 -1.07 0.00 0.61 1.20 0.00 0.00 173.24 174.01