#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1f0j n ILE 153 N 0.00 0.00 0.25 0.44 0.13 -1.26 0.18 119.36 119.10 1f0j n ILE 153 Ca 0.00 1.33 0.12 0.00 -1.10 0.00 0.00 62.75 63.11 1f0j n ILE 153 Cb 0.00 -2.24 0.67 0.00 -0.84 0.00 0.00 39.64 37.23 1f0j n ILE 153 CO 0.00 0.00 0.00 0.77 2.80 0.00 0.00 176.55 180.12 1f0j h SER 154 N 0.00 0.00 -0.35 9.51 4.64 -2.01 -2.60 113.55 122.74 1f0j h SER 154 Ca 0.82 0.00 0.10 0.00 -0.47 0.00 0.00 61.79 62.24 1f0j h SER 154 Cb 3.38 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 65.45 1f0j h SER 154 CO -0.01 0.14 0.31 0.03 -0.87 0.00 0.00 176.83 176.43 1f0j h ARG 155 N 0.00 0.00 0.00 4.77 2.47 0.14 -0.84 114.38 120.92 1f0j h ARG 155 Ca -0.00 0.00 -0.02 0.00 -1.26 0.00 0.00 59.98 58.69 1f0j h ARG 155 Cb 0.44 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.76 1f0j h ARG 155 CO 0.02 0.00 -0.28 0.74 0.56 0.00 0.00 179.97 181.01 1f0j h PHE 156 N 0.00 0.00 -3.23 3.04 0.04 -1.63 -3.48 116.94 111.68 1f0j h PHE 156 Ca 0.17 0.00 -0.35 0.00 2.80 0.00 0.00 57.97 60.58 1f0j h PHE 156 Cb 0.78 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.90 1f0j h PHE 156 CO 0.00 0.11 -0.45 0.41 -0.60 0.00 0.00 178.31 177.78 1f0j n GLY 157 N 1.14 -0.40 3.76 -1.45 0.00 -0.32 -4.80 105.19 103.12 1f0j n GLY 157 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 1f0j n GLY 157 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1f0j s VAL 158 N -2.86 2.34 -0.88 1.61 1.01 -1.26 -4.93 120.40 115.42 1f0j s VAL 158 Ca 0.00 0.30 -0.16 0.00 0.00 0.00 0.00 61.98 62.12 1f0j s VAL 158 Cb 0.00 -3.19 0.18 0.00 0.00 0.00 0.00 36.38 33.37 1f0j s VAL 158 CO 0.00 0.06 0.93 0.54 0.00 0.00 0.00 175.10 176.63 1f0j s ASN 159 N 0.15 6.72 0.00 3.32 4.22 -1.26 -4.95 114.94 123.14 1f0j s ASN 159 Ca 0.57 -2.44 0.00 0.00 -2.14 0.00 0.00 52.86 48.86 1f0j s ASN 159 Cb -0.44 -2.29 0.00 0.00 1.28 0.00 0.00 41.25 39.79 1f0j s ASN 159 CO 0.51 -0.78 0.00 0.35 -2.04 0.00 0.00 177.10 175.14 1f0j n THR 160 N 4.60 0.00 0.91 0.54 -2.24 -1.26 -2.07 114.28 114.76 1f0j n THR 160 Ca 0.19 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 62.05 1f0j n THR 160 Cb 0.48 0.00 0.45 0.00 -2.10 0.00 0.00 70.33 69.16 1f0j n THR 160 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 1f0j n GLU 161 N 0.00 0.39 -0.08 -0.78 -0.00 -1.26 -1.34 120.64 117.56 1f0j n GLU 161 Ca 0.00 0.06 0.03 0.00 -0.00 0.00 0.00 57.16 57.25 1f0j n GLU 161 Cb 0.00 -1.50 0.08 0.00 -0.00 0.00 0.00 31.44 30.02 1f0j n GLU 161 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 1f0j n ASN 162 N -1.12 2.33 -0.02 -1.84 3.02 -0.88 -4.57 115.26 112.18 1f0j n ASN 162 Ca 0.10 -1.82 -0.16 0.00 -0.03 0.00 0.00 54.58 52.67 1f0j n ASN 162 Cb 0.09 -0.11 -0.11 0.00 -0.61 0.00 0.00 39.78 39.04 1f0j n ASN 162 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 1f0j h GLU 163 N 1.29 0.28 -0.29 3.52 4.39 -1.44 -1.49 114.58 120.85 1f0j h GLU 163 Ca 0.00 -0.28 -0.14 0.00 0.34 0.00 0.00 59.36 59.27 1f0j h GLU 163 Cb 0.56 0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 29.27 1f0j h GLU 163 CO 0.00 0.97 -0.40 -0.44 -1.16 0.00 0.00 179.01 177.98 1f0j h ASP 164 N -0.30 0.75 0.13 1.42 3.32 -1.81 -0.84 116.42 119.08 1f0j h ASP 164 Ca -0.04 -0.34 -0.01 0.00 0.02 0.00 0.00 57.03 56.66 1f0j h ASP 164 Cb 1.09 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 40.43 1f0j h ASP 164 CO 0.07 1.06 -0.06 0.45 -1.72 0.00 0.00 179.24 179.04 1f0j h HIS 165 N 0.57 -0.16 -0.33 4.55 3.86 -1.80 0.21 115.15 122.04 1f0j h HIS 165 Ca 0.05 -0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.25 1f0j h HIS 165 Cb 0.94 0.05 -0.02 0.00 1.06 0.00 0.00 27.41 29.45 1f0j h HIS 165 CO 0.05 0.02 0.21 1.25 0.86 0.00 0.00 177.93 180.31 1f0j h LEU 166 N -0.31 0.39 -1.51 2.43 5.85 -1.23 0.60 115.31 121.54 1f0j h LEU 166 Ca -0.02 -0.04 0.01 0.00 0.84 0.00 0.00 57.88 58.68 1f0j h LEU 166 Cb 0.25 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 41.15 1f0j h LEU 166 CO 0.03 0.32 0.35 0.00 -0.34 0.00 0.00 178.44 178.79 1f0j h ALA 167 N 1.09 1.66 -0.01 1.25 0.00 -1.04 0.75 119.26 122.97 1f0j h ALA 167 Ca 0.12 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 1f0j h ALA 167 Cb -0.01 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 1f0j h ALA 167 CO -0.02 0.30 0.00 -0.22 0.00 0.00 0.00 179.25 179.31 1f0j h LYS 168 N 0.67 0.02 -0.43 0.00 3.11 0.54 -3.02 116.57 117.46 1f0j h LYS 168 Ca 0.20 -0.01 0.02 0.00 -2.81 0.00 0.00 60.65 58.05 1f0j h LYS 168 Cb -0.03 -0.00 -0.03 0.00 -1.00 0.00 0.00 32.23 31.17 1f0j h LYS 168 CO -0.05 0.29 0.25 0.93 -2.81 0.00 0.00 179.45 178.07 1f0j h GLU 169 N -0.26 0.49 0.00 1.90 4.39 -0.16 -1.91 114.58 119.03 1f0j h GLU 169 Ca 0.00 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.67 1f0j h GLU 169 Cb 0.28 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 28.82 1f0j h GLU 169 CO 0.00 0.32 0.00 1.28 -1.16 0.00 0.00 179.01 179.45 1f0j n LEU 170 N -4.85 0.00 0.27 1.33 4.77 0.19 -1.50 117.00 117.20 1f0j n LEU 170 Ca 0.02 0.30 0.17 0.00 -0.03 0.00 0.00 56.01 56.47 1f0j n LEU 170 Cb 0.07 -0.30 0.70 0.00 -2.33 0.00 0.00 43.42 41.57 1f0j n LEU 170 CO 0.32 -0.27 0.99 -0.33 -1.33 0.00 0.00 177.39 176.78 1f0j h GLU 171 N 0.00 0.00 -0.69 3.23 5.08 -1.22 -1.75 114.58 119.22 1f0j h GLU 171 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1f0j h GLU 171 Cb 0.03 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.28 1f0j h GLU 171 CO 0.00 0.00 0.00 -0.25 -1.00 0.00 0.00 179.01 177.76 1f0j n ASP 172 N -3.02 4.52 -0.32 1.42 8.00 -0.56 -4.62 116.55 121.96 1f0j n ASP 172 Ca 0.00 -2.29 0.19 0.00 0.71 0.00 0.00 54.79 53.41 1f0j n ASP 172 Cb 0.28 -0.56 0.40 0.00 -0.02 0.00 0.00 41.12 41.23 1f0j n ASP 172 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 1f0j h LEU 173 N 4.22 0.30 -2.70 0.64 5.85 -1.48 0.48 115.31 122.63 1f0j h LEU 173 Ca 0.00 0.19 0.00 0.00 0.84 0.00 0.00 57.88 58.91 1f0j h LEU 173 Cb 1.30 0.19 0.00 0.00 0.37 0.00 0.00 40.66 42.52 1f0j h LEU 173 CO 0.15 -0.14 0.00 0.59 -0.34 0.00 0.00 178.44 178.70 1f0j n ASN 174 N -5.12 4.15 -4.47 1.25 3.02 -1.26 -4.80 115.26 108.02 1f0j n ASN 174 Ca 0.27 -2.46 -0.30 0.00 -0.03 0.00 0.00 54.58 52.06 1f0j n ASN 174 Cb 0.86 -0.55 -0.12 0.00 -0.61 0.00 0.00 39.78 39.35 1f0j n ASN 174 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1f0j s LYS 175 N -1.95 1.92 0.48 3.52 1.02 0.17 -4.86 119.74 120.03 1f0j s LYS 175 Ca 0.42 -1.08 0.17 0.00 0.02 0.00 0.00 55.97 55.50 1f0j s LYS 175 Cb 0.28 -2.14 1.15 0.00 -0.52 0.00 0.00 37.83 36.60 1f0j s LYS 175 CO 0.18 0.51 2.04 2.35 -0.92 0.00 0.00 175.35 179.51 1f0j h TRP 176 N 4.17 0.00 0.00 3.18 -0.00 -1.92 -2.59 115.95 118.79 1f0j h TRP 176 Ca -0.49 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 58.40 1f0j h TRP 176 Cb 1.16 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 30.32 1f0j h TRP 176 CO 0.56 0.14 0.00 0.41 -0.00 0.00 0.00 178.44 179.55 1f0j n GLY 177 N -1.07 -0.93 3.70 2.65 0.00 -1.26 -4.89 105.19 103.38 1f0j n GLY 177 Ca -0.02 -0.11 -0.40 0.00 0.00 0.00 0.00 46.02 45.48 1f0j n GLY 177 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1f0j n LEU 178 N -0.81 4.38 -4.18 0.99 0.00 -0.98 -4.95 117.00 111.45 1f0j n LEU 178 Ca 0.14 1.02 -0.40 0.00 0.00 0.00 0.00 56.01 56.77 1f0j n LEU 178 Cb 0.06 -1.50 -0.09 0.00 0.00 0.00 0.00 43.42 41.90 1f0j n LEU 178 CO 0.10 -0.85 0.01 0.21 0.00 0.00 0.00 177.39 176.86 1f0j s ASN 179 N -0.76 5.64 0.51 1.96 3.84 -1.26 -4.94 114.94 119.92 1f0j s ASN 179 Ca 0.67 -2.19 0.26 0.00 0.21 0.00 0.00 52.86 51.80 1f0j s ASN 179 Cb -0.47 -1.97 1.35 0.00 -0.55 0.00 0.00 41.25 39.62 1f0j s ASN 179 CO 0.54 -0.60 2.04 -0.29 -2.79 0.00 0.00 177.10 176.00 1f0j h ILE 180 N 5.88 0.63 -0.57 -5.21 6.09 -1.98 -2.47 117.51 119.89 1f0j h ILE 180 Ca -0.13 -0.61 -0.03 0.00 -1.37 0.00 0.00 64.86 62.72 1f0j h ILE 180 Cb 1.04 1.39 -0.03 0.00 0.47 0.00 0.00 36.82 39.70 1f0j h ILE 180 CO 0.80 0.14 0.25 -0.26 -3.07 0.00 0.00 178.15 176.01 1f0j h PHE 181 N 0.00 0.85 -0.40 2.19 0.04 -1.96 -0.77 116.94 116.89 1f0j h PHE 181 Ca -0.00 -0.05 -0.12 0.00 2.80 0.00 0.00 57.97 60.60 1f0j h PHE 181 Cb 0.38 -0.26 -0.01 0.00 2.20 0.00 0.00 35.95 38.25 1f0j h PHE 181 CO 0.00 0.67 -0.23 -0.91 -0.60 0.00 0.00 178.31 177.24 1f0j h ASN 182 N 0.78 0.81 -0.74 2.17 2.35 -1.88 -1.86 115.58 117.22 1f0j h ASN 182 Ca 0.19 -0.30 -0.02 0.00 -0.55 0.00 0.00 56.30 55.63 1f0j h ASN 182 Cb 0.16 -0.22 -0.03 0.00 0.05 0.00 0.00 38.32 38.27 1f0j h ASN 182 CO -0.02 1.01 0.37 0.58 -1.65 0.00 0.00 177.43 177.73 1f0j h VAL 183 N 0.69 1.23 -0.50 2.81 2.07 -1.24 -1.78 116.25 119.54 1f0j h VAL 183 Ca 0.09 -0.63 -0.04 0.00 0.82 0.00 0.00 66.70 66.94 1f0j h VAL 183 Cb 0.75 0.29 -0.02 0.00 -1.52 0.00 0.00 31.29 30.78 1f0j h VAL 183 CO 0.06 0.27 0.16 0.00 0.02 0.00 0.00 177.57 178.08 1f0j h ALA 184 N 1.19 0.65 -0.00 1.67 0.00 -0.94 -2.23 119.26 119.59 1f0j h ALA 184 Ca 0.26 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 1f0j h ALA 184 Cb 0.09 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 1f0j h ALA 184 CO -0.04 0.30 -0.09 0.78 0.00 0.00 0.00 179.25 180.21 1f0j h GLY 185 N 0.67 0.00 -0.40 0.00 0.00 -0.80 0.13 103.07 102.67 1f0j h GLY 185 Ca 0.16 -0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.49 1f0j h GLY 185 CO -0.01 0.00 -0.41 -1.72 0.00 0.00 0.00 176.54 174.41 1f0j n TYR 186 N -4.43 0.00 -1.60 5.60 4.01 -0.72 -4.30 117.16 115.72 1f0j n TYR 186 Ca -0.03 0.00 0.03 0.00 -0.16 0.00 0.00 57.90 57.74 1f0j n TYR 186 Cb 0.17 -0.06 0.20 0.00 -0.31 0.00 0.00 39.34 39.34 1f0j n TYR 186 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 1f0j n SER 187 N -0.38 1.97 -3.83 7.72 3.41 -0.86 -4.74 113.62 116.91 1f0j n SER 187 Ca 0.10 -3.89 -0.25 0.00 -0.26 0.00 0.00 58.87 54.58 1f0j n SER 187 Cb 0.41 -0.54 0.02 0.00 -0.26 0.00 0.00 64.21 63.84 1f0j n SER 187 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1f0j n HIS 188 N -1.10 -1.93 -3.88 7.33 8.25 -1.19 -2.11 115.22 120.59 1f0j n HIS 188 Ca 0.22 0.83 -0.28 0.00 -0.26 0.00 0.00 57.72 58.23 1f0j n HIS 188 Cb 0.75 -4.09 0.02 0.00 1.12 0.00 0.00 29.99 27.79 1f0j n HIS 188 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1f0j n ASN 189 N -2.98 -3.73 -2.70 0.41 5.15 -0.00 -4.92 115.26 106.50 1f0j n ASN 189 Ca -0.21 -0.81 -0.24 0.00 -0.60 0.00 0.00 54.58 52.72 1f0j n ASN 189 Cb 0.64 -3.83 -0.01 0.00 -0.53 0.00 0.00 39.78 36.05 1f0j n ASN 189 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1f0j n ARG 190 N -4.57 2.89 0.11 1.20 5.12 -0.90 -4.89 116.66 115.62 1f0j n ARG 190 Ca -0.05 -4.37 0.03 0.00 -1.93 0.00 0.00 57.85 51.53 1f0j n ARG 190 Cb 0.57 -2.08 0.41 0.00 -1.16 0.00 0.00 32.46 30.20 1f0j n ARG 190 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 1f0j h PRO 191 N 2.79 0.28 -0.04 5.56 0.13 -1.84 -1.83 132.00 137.05 1f0j h PRO 191 Ca 0.18 -0.05 -0.01 0.00 -0.87 0.00 0.00 66.00 65.25 1f0j h PRO 191 Cb 0.83 -0.05 -0.00 0.00 0.13 0.00 0.00 31.00 31.91 1f0j h PRO 191 CO 0.77 0.35 -0.01 1.25 -0.23 0.00 0.00 178.00 180.13 1f0j h LEU 192 N 0.27 0.08 -0.32 1.56 5.85 -1.91 -0.26 115.31 120.58 1f0j h LEU 192 Ca 0.06 -0.38 -0.07 0.00 0.84 0.00 0.00 57.88 58.34 1f0j h LEU 192 Cb 0.28 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.27 1f0j h LEU 192 CO 0.01 0.44 -0.07 0.74 -0.34 0.00 0.00 178.44 179.23 1f0j h THR 193 N -0.28 1.28 -0.01 1.05 2.02 -1.83 -0.97 112.91 114.17 1f0j h THR 193 Ca 0.01 -1.10 -0.00 0.00 0.77 0.00 0.00 66.41 66.09 1f0j h THR 193 Cb 0.41 1.33 -0.00 0.00 -1.74 0.00 0.00 68.15 68.15 1f0j h THR 193 CO 0.00 0.36 0.00 0.00 0.37 0.00 0.00 175.52 176.26 1f0j h ILE 195 N -0.13 1.27 -0.37 0.00 6.09 -1.07 -0.13 117.51 123.17 1f0j h ILE 195 Ca 0.00 -1.32 -0.12 0.00 -1.37 0.00 0.00 64.86 62.06 1f0j h ILE 195 Cb 0.14 1.28 -0.01 0.00 0.47 0.00 0.00 36.82 38.70 1f0j h ILE 195 CO -0.00 0.43 -0.24 0.24 -3.07 0.00 0.00 178.15 175.51 1f0j h MET 196 N 0.56 0.75 -0.11 2.19 2.86 -1.04 0.20 114.93 120.33 1f0j h MET 196 Ca 0.08 -0.31 -0.02 0.00 -2.06 0.00 0.00 59.70 57.40 1f0j h MET 196 Cb 0.71 -0.03 -0.00 0.00 0.06 0.00 0.00 31.60 32.34 1f0j h MET 196 CO 0.05 0.92 0.01 -0.92 1.06 0.00 0.00 176.91 178.03 1f0j h TYR 197 N 0.65 0.20 -0.89 -0.22 3.20 -0.52 -0.06 116.97 119.34 1f0j h TYR 197 Ca 0.09 -0.03 0.03 0.00 3.14 0.00 0.00 58.73 61.96 1f0j h TYR 197 Cb 0.74 -0.05 -0.05 0.00 1.54 0.00 0.00 36.73 38.91 1f0j h TYR 197 CO 0.04 0.41 0.58 0.00 -1.64 0.00 0.00 178.16 177.54 1f0j h ALA 198 N 0.77 1.16 -0.20 1.82 0.00 -0.82 -1.43 119.26 120.57 1f0j h ALA 198 Ca 0.03 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1f0j h ALA 198 Cb 0.32 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1f0j h ALA 198 CO 0.00 0.45 0.06 0.82 0.00 0.00 0.00 179.25 180.58 1f0j h ILE 199 N 1.13 1.20 -0.27 0.00 2.04 -0.37 -1.58 117.51 119.67 1f0j h ILE 199 Ca 0.35 -0.62 -0.07 0.00 1.00 0.00 0.00 64.86 65.51 1f0j h ILE 199 Cb -0.02 1.23 -0.02 0.00 -0.74 0.00 0.00 36.82 37.27 1f0j h ILE 199 CO -0.11 0.20 -0.13 -0.26 0.00 0.00 0.00 178.15 177.84 1f0j h PHE 200 N 0.14 0.49 0.16 1.37 -1.00 -0.71 -0.88 116.94 116.52 1f0j h PHE 200 Ca 0.06 -0.07 -0.01 0.00 2.81 0.00 0.00 57.97 60.76 1f0j h PHE 200 Cb 0.25 -0.13 0.00 0.00 3.61 0.00 0.00 35.95 39.68 1f0j h PHE 200 CO 0.01 0.58 -0.08 1.96 -1.61 0.00 0.00 178.31 179.17 1f0j h GLN 201 N 0.42 -0.20 -0.92 1.51 4.20 -1.19 0.21 115.11 119.13 1f0j h GLN 201 Ca 0.08 0.01 0.19 0.00 0.06 0.00 0.00 58.65 58.99 1f0j h GLN 201 Cb 0.49 0.05 -0.11 0.00 0.30 0.00 0.00 27.48 28.21 1f0j h GLN 201 CO 0.03 0.12 0.50 1.49 -0.67 0.00 0.00 178.83 180.29 1f0j h GLU 202 N -0.55 0.59 -0.14 1.46 4.57 -1.07 0.13 114.58 119.58 1f0j h GLU 202 Ca -0.02 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.12 1f0j h GLU 202 Cb 0.42 -0.13 0.00 0.00 -0.16 0.00 0.00 28.75 28.88 1f0j h GLU 202 CO 0.04 0.39 0.00 0.54 -1.18 0.00 0.00 179.01 178.80 1f0j n ARG 203 N -4.88 2.05 -3.12 1.92 1.74 -0.35 -4.95 116.66 109.06 1f0j n ARG 203 Ca 0.21 -1.55 -0.21 0.00 -0.77 0.00 0.00 57.85 55.53 1f0j n ARG 203 Cb 0.56 -1.46 0.00 0.00 -1.02 0.00 0.00 32.46 30.54 1f0j n ARG 203 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1f0j n ASP 204 N 0.82 -4.30 0.18 0.55 2.03 0.50 -4.86 116.55 111.48 1f0j n ASP 204 Ca 0.17 -0.26 0.04 0.00 0.52 0.00 0.00 54.79 55.26 1f0j n ASP 204 Cb 0.47 -3.55 0.33 0.00 -0.72 0.00 0.00 41.12 37.66 1f0j n ASP 204 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 1f0j h LEU 205 N -0.89 0.00 -0.36 -2.67 3.38 -1.16 -2.61 115.31 111.00 1f0j h LEU 205 Ca -0.43 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.49 1f0j h LEU 205 Cb 1.29 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.03 1f0j h LEU 205 CO 0.51 0.40 0.03 -0.07 0.09 0.00 0.00 178.44 179.41 1f0j h LEU 206 N 0.00 0.60 -0.05 1.67 3.38 -1.83 -1.88 115.31 117.19 1f0j h LEU 206 Ca -0.00 -0.28 -0.01 0.00 0.09 0.00 0.00 57.88 57.67 1f0j h LEU 206 Cb 0.86 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 41.45 1f0j h LEU 206 CO 0.05 0.73 -0.02 0.11 0.09 0.00 0.00 178.44 179.40 1f0j h LYS 207 N 0.45 0.11 -0.77 1.13 1.57 -1.79 0.38 116.57 117.66 1f0j h LYS 207 Ca 0.11 -0.05 0.13 0.00 -1.87 0.00 0.00 60.65 58.97 1f0j h LYS 207 Cb 0.40 -0.00 -0.09 0.00 0.08 0.00 0.00 32.23 32.62 1f0j h LYS 207 CO 0.01 0.49 0.35 1.15 -0.57 0.00 0.00 179.45 180.89 1f0j h THR 208 N -0.27 0.74 -0.42 -0.16 2.02 -1.44 -2.24 112.91 111.14 1f0j h THR 208 Ca 0.01 -0.19 0.00 0.00 0.77 0.00 0.00 66.41 67.01 1f0j h THR 208 Cb 0.45 0.15 0.00 0.00 -1.74 0.00 0.00 68.15 67.01 1f0j h THR 208 CO 0.01 0.10 0.00 0.49 0.37 0.00 0.00 175.52 176.49 1f0j n PHE 209 N -4.92 1.41 -3.93 3.16 3.72 -0.71 -4.97 117.46 111.22 1f0j n PHE 209 Ca 0.14 -0.78 -0.27 0.00 -0.05 0.00 0.00 57.45 56.49 1f0j n PHE 209 Cb 0.38 -0.37 -0.01 0.00 -0.94 0.00 0.00 39.48 38.53 1f0j n PHE 209 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 1f0j n ARG 210 N 0.12 -2.84 -3.71 -1.08 1.74 -0.57 -4.60 116.66 105.72 1f0j n ARG 210 Ca 0.24 0.39 -0.37 0.00 -0.77 0.00 0.00 57.85 57.33 1f0j n ARG 210 Cb 0.99 -4.37 -0.12 0.00 -1.02 0.00 0.00 32.46 27.94 1f0j n ARG 210 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1f0j s ILE 211 N -3.90 4.35 0.58 0.55 1.01 0.12 -4.71 121.20 119.21 1f0j s ILE 211 Ca 0.08 -0.39 -0.18 0.00 0.00 0.00 0.00 60.65 60.16 1f0j s ILE 211 Cb -0.03 -3.16 -0.04 0.00 0.01 0.00 0.00 42.46 39.24 1f0j s ILE 211 CO 0.89 0.17 1.12 -0.94 0.00 0.00 0.00 174.94 176.17 1f0j s SER 212 N 1.59 5.56 0.37 3.58 1.04 -1.26 -4.55 113.70 120.03 1f0j s SER 212 Ca 0.05 2.09 0.05 0.00 0.48 0.00 0.00 55.95 58.61 1f0j s SER 212 Cb -0.16 -2.57 0.72 0.00 0.10 0.00 0.00 66.02 64.11 1f0j s SER 212 CO 0.04 -1.32 2.00 0.28 0.98 0.00 0.00 173.24 175.22 1f0j h SER 213 N 0.81 0.58 -0.24 7.02 0.02 -1.98 -1.56 113.55 118.20 1f0j h SER 213 Ca -0.49 -0.03 -0.01 0.00 -0.84 0.00 0.00 61.79 60.42 1f0j h SER 213 Cb 1.25 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 63.64 1f0j h SER 213 CO 0.56 0.46 0.10 0.44 -1.14 0.00 0.00 176.83 177.26 1f0j h ASP 214 N 0.67 0.32 -0.52 3.07 3.32 -1.98 -0.04 116.42 121.26 1f0j h ASP 214 Ca 0.17 -0.15 -0.08 0.00 0.02 0.00 0.00 57.03 56.99 1f0j h ASP 214 Cb 0.00 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 39.45 1f0j h ASP 214 CO -0.03 0.38 0.01 0.74 -1.72 0.00 0.00 179.24 178.63 1f0j h THR 215 N 0.24 1.26 -0.03 0.35 2.02 -1.70 -0.98 112.91 114.07 1f0j h THR 215 Ca 0.08 -1.07 -0.00 0.00 0.77 0.00 0.00 66.41 66.18 1f0j h THR 215 Cb 0.16 0.92 -0.00 0.00 -1.74 0.00 0.00 68.15 67.48 1f0j h THR 215 CO -0.01 0.38 0.01 0.15 0.37 0.00 0.00 175.52 176.42 1f0j h PHE 216 N 0.79 0.05 -0.27 3.16 3.57 -1.15 -0.82 116.94 122.27 1f0j h PHE 216 Ca 0.15 -0.01 -0.09 0.00 3.53 0.00 0.00 57.97 61.56 1f0j h PHE 216 Cb 0.51 -0.02 -0.01 0.00 2.79 0.00 0.00 35.95 39.22 1f0j h PHE 216 CO 0.04 0.23 -0.20 0.82 -2.23 0.00 0.00 178.31 176.96 1f0j h ILE 217 N -0.14 1.25 -0.19 1.41 2.04 -1.00 0.03 117.51 120.92 1f0j h ILE 217 Ca 0.01 -1.17 -0.02 0.00 1.00 0.00 0.00 64.86 64.67 1f0j h ILE 217 Cb 0.20 1.26 -0.01 0.00 -0.74 0.00 0.00 36.82 37.53 1f0j h ILE 217 CO -0.00 0.38 0.03 0.74 0.00 0.00 0.00 178.15 179.29 1f0j h THR 218 N 0.45 1.23 -0.04 -0.27 2.02 -1.03 0.30 112.91 115.56 1f0j h THR 218 Ca 0.07 -0.74 -0.00 0.00 0.77 0.00 0.00 66.41 66.51 1f0j h THR 218 Cb 0.60 1.36 -0.00 0.00 -1.74 0.00 0.00 68.15 68.37 1f0j h THR 218 CO 0.04 0.23 0.01 0.22 0.37 0.00 0.00 175.52 176.39 1f0j h TYR 219 N 0.10 0.07 -0.79 3.16 3.20 -0.97 -2.05 116.97 119.69 1f0j h TYR 219 Ca 0.06 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 61.93 1f0j h TYR 219 Cb 0.32 -0.02 -0.04 0.00 1.54 0.00 0.00 36.73 38.53 1f0j h TYR 219 CO 0.02 0.25 0.52 0.52 -1.64 0.00 0.00 178.16 177.83 1f0j h MET 220 N -0.13 1.01 -0.33 1.82 2.86 -0.94 0.30 114.93 119.52 1f0j h MET 220 Ca 0.01 -0.06 -0.07 0.00 -2.06 0.00 0.00 59.70 57.53 1f0j h MET 220 Cb 0.21 -0.23 -0.02 0.00 0.06 0.00 0.00 31.60 31.63 1f0j h MET 220 CO -0.00 0.67 -0.08 0.52 1.06 0.00 0.00 176.91 179.08 1f0j h MET 221 N 1.04 0.54 -0.09 1.72 2.86 -0.90 0.33 114.93 120.44 1f0j h MET 221 Ca 0.30 -0.15 -0.03 0.00 -2.06 0.00 0.00 59.70 57.76 1f0j h MET 221 Cb -0.08 -0.06 -0.00 0.00 0.06 0.00 0.00 31.60 31.51 1f0j h MET 221 CO -0.08 0.63 -0.07 1.15 1.06 0.00 0.00 176.91 179.60 1f0j h THR 222 N 0.51 1.35 -0.03 2.22 2.02 -0.61 -1.64 112.91 116.73 1f0j h THR 222 Ca 0.10 -1.20 -0.00 0.00 0.77 0.00 0.00 66.41 66.08 1f0j h THR 222 Cb 0.45 1.96 -0.00 0.00 -1.74 0.00 0.00 68.15 68.81 1f0j h THR 222 CO 0.02 0.34 0.02 0.25 0.37 0.00 0.00 175.52 176.52 1f0j h LEU 223 N -0.20 0.04 -1.36 2.58 5.85 -0.13 -2.53 115.31 119.57 1f0j h LEU 223 Ca 0.02 -0.04 0.05 0.00 0.84 0.00 0.00 57.88 58.74 1f0j h LEU 223 Cb 0.57 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.55 1f0j h LEU 223 CO 0.02 0.07 0.47 -0.08 -0.34 0.00 0.00 178.44 178.58 1f0j h GLU 224 N 0.01 0.79 0.00 1.25 4.81 -0.37 0.59 114.58 121.67 1f0j h GLU 224 Ca 0.01 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 1f0j h GLU 224 Cb 0.03 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.24 1f0j h GLU 224 CO -0.00 0.52 0.00 -3.47 -0.73 0.00 0.00 179.01 175.33 1f0j n ASP 225 N -4.47 0.00 -0.70 1.04 2.03 -0.62 -1.74 116.55 112.09 1f0j n ASP 225 Ca 0.10 0.45 0.13 0.00 0.52 0.00 0.00 54.79 55.98 1f0j n ASP 225 Cb 0.17 -0.47 0.35 0.00 -0.72 0.00 0.00 41.12 40.44 1f0j n ASP 225 CO 0.00 0.00 0.00 1.41 -1.92 0.00 0.00 177.20 176.69 1f0j n HIS 226 N -1.47 0.06 -3.32 -0.67 8.25 0.20 -4.81 115.22 113.45 1f0j n HIS 226 Ca 0.04 -0.03 -0.33 0.00 -0.26 0.00 0.00 57.72 57.14 1f0j n HIS 226 Cb 0.17 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.23 1f0j n HIS 226 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 1f0j s TYR 227 N -1.94 3.47 -0.45 4.41 1.51 -0.71 -1.04 117.35 122.60 1f0j s TYR 227 Ca 0.34 1.02 -0.21 0.00 -1.01 0.00 0.00 57.07 57.21 1f0j s TYR 227 Cb 0.20 -2.37 0.03 0.00 -0.11 0.00 0.00 41.96 39.72 1f0j s TYR 227 CO 0.31 0.28 0.68 -1.01 -1.11 0.00 0.00 175.55 174.70 1f0j s HIS 228 N -1.75 3.04 0.08 2.71 3.76 -1.26 -4.84 115.29 117.03 1f0j s HIS 228 Ca 0.46 -0.07 0.32 0.00 -0.15 0.00 0.00 55.06 55.62 1f0j s HIS 228 Cb -0.12 -3.45 1.57 0.00 1.11 0.00 0.00 32.58 31.68 1f0j s HIS 228 CO 0.20 -0.93 1.96 0.66 -0.85 0.00 0.00 174.74 175.78 1f0j h SER 229 N 8.93 0.00 -0.07 1.40 4.64 -1.94 -1.82 113.55 124.69 1f0j h SER 229 Ca -0.25 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.07 1f0j h SER 229 Cb 1.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.18 1f0j h SER 229 CO 0.92 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.98 1f0j n ASP 230 N -2.70 1.97 -4.68 4.97 5.75 -1.26 -4.78 116.55 115.83 1f0j n ASP 230 Ca -0.01 -1.68 -0.39 0.00 -0.01 0.00 0.00 54.79 52.71 1f0j n ASP 230 Cb 0.15 -0.04 -0.06 0.00 -1.03 0.00 0.00 41.12 40.14 1f0j n ASP 230 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1f0j s VAL 231 N -1.93 5.12 0.23 2.12 1.01 -0.69 -4.99 120.40 121.27 1f0j s VAL 231 Ca 0.35 1.00 -0.07 0.00 0.00 0.00 0.00 61.98 63.26 1f0j s VAL 231 Cb 0.20 -3.85 0.18 0.00 0.00 0.00 0.00 36.38 32.91 1f0j s VAL 231 CO 0.31 0.22 1.83 0.00 0.00 0.00 0.00 175.10 177.46 1f0j h ALA 232 N 7.22 1.05 0.00 5.51 0.00 -1.86 -3.39 119.26 127.79 1f0j h ALA 232 Ca -0.36 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.50 1f0j h ALA 232 Cb 1.16 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 1f0j h ALA 232 CO 0.75 0.17 -0.80 0.98 0.00 0.00 0.00 179.25 180.34 1f0j n TYR 233 N -4.70 0.00 -0.95 0.00 9.36 -1.25 -4.80 117.16 114.82 1f0j n TYR 233 Ca 0.11 0.00 -0.27 0.00 3.32 0.00 0.00 57.90 61.06 1f0j n TYR 233 Cb 0.18 -0.28 -0.03 0.00 -0.63 0.00 0.00 39.34 38.58 1f0j n TYR 233 CO 0.00 0.00 0.00 0.72 0.22 0.00 0.00 176.86 177.80 1f0j n HIS 234 N -3.79 1.62 -3.90 2.98 8.25 -1.26 -4.28 115.22 114.83 1f0j n HIS 234 Ca -0.11 -2.30 -0.10 0.00 -0.26 0.00 0.00 57.72 54.95 1f0j n HIS 234 Cb 0.36 -1.94 -0.01 0.00 1.12 0.00 0.00 29.99 29.52 1f0j n HIS 234 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 1f0j n ASN 235 N 3.82 1.97 0.29 0.41 0.23 -1.26 -4.51 115.26 116.21 1f0j n ASN 235 Ca 0.56 -1.67 0.18 0.00 -0.53 0.00 0.00 54.58 53.11 1f0j n ASN 235 Cb 0.22 0.05 0.87 0.00 -2.08 0.00 0.00 39.78 38.83 1f0j n ASN 235 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 1f0j h SER 236 N 0.30 0.00 -0.54 0.53 4.64 -1.87 -2.16 113.55 114.45 1f0j h SER 236 Ca -0.13 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.09 1f0j h SER 236 Cb 0.42 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.49 1f0j h SER 236 CO 0.20 0.04 -0.04 0.25 -0.87 0.00 0.00 176.83 176.41 1f0j h LEU 237 N 0.00 0.99 -0.33 5.97 5.85 -1.95 0.28 115.31 126.11 1f0j h LEU 237 Ca -0.00 -0.29 -0.07 0.00 0.84 0.00 0.00 57.88 58.36 1f0j h LEU 237 Cb 0.30 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 1f0j h LEU 237 CO 0.01 1.06 -0.07 -0.74 -0.34 0.00 0.00 178.44 178.36 1f0j h HIS 238 N 0.91 0.70 -0.69 1.25 2.76 -1.58 -0.66 115.15 117.84 1f0j h HIS 238 Ca 0.16 -0.15 -0.02 0.00 -2.20 0.00 0.00 60.37 58.16 1f0j h HIS 238 Cb 0.58 -0.17 -0.03 0.00 1.55 0.00 0.00 27.41 29.34 1f0j h HIS 238 CO 0.04 0.79 0.35 0.00 -1.30 0.00 0.00 177.93 177.81 1f0j h ALA 239 N 0.81 0.89 -0.45 5.26 0.00 -1.19 -0.33 119.26 124.26 1f0j h ALA 239 Ca 0.08 -0.13 0.01 0.00 0.00 0.00 0.00 54.91 54.87 1f0j h ALA 239 Cb 0.56 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 1f0j h ALA 239 CO 0.03 0.44 0.29 0.00 0.00 0.00 0.00 179.25 180.01 1f0j h ALA 240 N 1.17 0.57 -0.32 0.00 0.00 -0.29 -0.58 119.26 119.81 1f0j h ALA 240 Ca 0.24 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1f0j h ALA 240 Cb 0.09 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1f0j h ALA 240 CO -0.03 0.01 0.21 0.22 0.00 0.00 0.00 179.25 179.65 1f0j h ASP 241 N 0.60 0.37 -0.50 0.00 3.58 -0.62 -0.24 116.42 119.61 1f0j h ASP 241 Ca 0.17 -0.02 -0.06 0.00 0.42 0.00 0.00 57.03 57.54 1f0j h ASP 241 Cb -0.06 -0.09 -0.02 0.00 1.72 0.00 0.00 39.33 40.88 1f0j h ASP 241 CO -0.04 0.28 0.10 0.58 -2.88 0.00 0.00 179.24 177.27 1f0j h VAL 242 N 0.43 1.24 -0.16 2.25 2.07 -0.75 0.87 116.25 122.21 1f0j h VAL 242 Ca 0.12 -0.91 -0.03 0.00 0.82 0.00 0.00 66.70 66.70 1f0j h VAL 242 Cb -0.04 0.71 -0.01 0.00 -1.52 0.00 0.00 31.29 30.43 1f0j h VAL 242 CO -0.02 0.33 -0.01 0.00 0.02 0.00 0.00 177.57 177.89 1f0j h ALA 243 N 1.27 0.21 -0.39 1.67 0.00 -0.78 -0.01 119.26 121.23 1f0j h ALA 243 Ca 0.18 -0.20 -0.07 0.00 0.00 0.00 0.00 54.91 54.81 1f0j h ALA 243 Cb 0.36 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1f0j h ALA 243 CO 0.01 -0.07 -0.07 0.37 0.00 0.00 0.00 179.25 179.49 1f0j h GLN 244 N 0.02 0.65 -0.29 0.00 -0.00 -0.87 0.62 115.11 115.24 1f0j h GLN 244 Ca 0.04 -0.18 -0.13 0.00 -0.00 0.00 0.00 58.65 58.38 1f0j h GLN 244 Cb 0.39 -0.07 -0.01 0.00 0.00 0.00 0.00 27.48 27.79 1f0j h GLN 244 CO 0.01 0.72 -0.37 0.77 0.00 0.00 0.00 178.83 179.96 1f0j h SER 245 N 0.61 0.70 -0.06 -0.69 0.02 -0.70 -1.66 113.55 111.76 1f0j h SER 245 Ca 0.11 -0.30 -0.13 0.00 -0.84 0.00 0.00 61.79 60.63 1f0j h SER 245 Cb 0.48 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.82 1f0j h SER 245 CO 0.03 1.00 -0.41 0.74 -1.14 0.00 0.00 176.83 177.05 1f0j h THR 246 N 0.55 1.30 -0.51 -2.27 2.02 -0.47 -0.87 112.91 112.65 1f0j h THR 246 Ca 0.05 -1.57 -0.01 0.00 0.77 0.00 0.00 66.41 65.65 1f0j h THR 246 Cb 0.89 1.55 -0.02 0.00 -1.74 0.00 0.00 68.15 68.82 1f0j h THR 246 CO 0.08 0.50 0.29 -0.74 0.37 0.00 0.00 175.52 176.02 1f0j h HIS 247 N 0.48 0.69 -0.28 3.16 6.17 -0.57 -0.47 115.15 124.34 1f0j h HIS 247 Ca 0.04 -0.01 -0.06 0.00 0.71 0.00 0.00 60.37 61.05 1f0j h HIS 247 Cb 0.91 -0.22 -0.01 0.00 2.52 0.00 0.00 27.41 30.61 1f0j h HIS 247 CO 0.04 0.50 -0.08 0.28 0.71 0.00 0.00 177.93 179.38 1f0j h VAL 248 N 0.68 1.29 -0.19 5.26 2.07 -1.13 -3.07 116.25 121.16 1f0j h VAL 248 Ca 0.18 -1.12 -0.03 0.00 0.82 0.00 0.00 66.70 66.55 1f0j h VAL 248 Cb 0.03 1.45 -0.01 0.00 -1.52 0.00 0.00 31.29 31.23 1f0j h VAL 248 CO -0.03 0.35 -0.02 -0.07 0.02 0.00 0.00 177.57 177.82 1f0j h LEU 249 N 0.29 0.25 -1.45 2.57 3.38 -0.94 -1.90 115.31 117.51 1f0j h LEU 249 Ca 0.07 -0.03 -0.05 0.00 0.09 0.00 0.00 57.88 57.96 1f0j h LEU 249 Cb 0.56 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 1f0j h LEU 249 CO 0.03 0.32 -0.23 -0.07 0.09 0.00 0.00 178.44 178.58 1f0j h LEU 250 N 0.27 0.00 -3.60 1.67 3.38 -1.00 -2.64 115.31 113.38 1f0j h LEU 250 Ca 0.06 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.99 1f0j h LEU 250 Cb 0.23 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.95 1f0j h LEU 250 CO 0.01 0.23 0.05 -1.54 0.09 0.00 0.00 178.44 177.28 1f0j n SER 251 N -3.65 5.56 -4.75 -0.43 3.41 -0.72 -4.77 113.62 108.27 1f0j n SER 251 Ca -0.01 -3.00 -0.41 0.00 -0.26 0.00 0.00 58.87 55.19 1f0j n SER 251 Cb 0.36 -0.70 -0.03 0.00 -0.26 0.00 0.00 64.21 63.58 1f0j n SER 251 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1f0j s THR 252 N -2.83 3.02 0.28 6.66 -1.32 -1.00 -4.91 115.64 115.54 1f0j s THR 252 Ca 0.55 0.89 -0.02 0.00 -1.21 0.00 0.00 61.69 61.90 1f0j s THR 252 Cb 0.42 -3.57 0.32 0.00 -1.51 0.00 0.00 72.50 68.17 1f0j s THR 252 CO 0.15 0.16 1.62 -0.65 -2.21 0.00 0.00 174.62 173.70 1f0j h PRO 253 N 4.73 0.11 0.00 7.08 0.11 -1.92 -0.62 132.00 141.49 1f0j h PRO 253 Ca -0.46 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1f0j h PRO 253 Cb 1.22 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1f0j h PRO 253 CO 0.74 0.07 0.00 0.00 -0.21 0.00 0.00 178.00 178.61 1f0j h ALA 254 N 1.80 1.00 -0.24 -0.75 0.00 -1.91 -2.19 119.26 116.98 1f0j h ALA 254 Ca 0.51 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.42 1f0j h ALA 254 Cb 0.99 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.78 1f0j h ALA 254 CO -0.73 -0.00 0.00 1.28 0.00 0.00 0.00 179.25 179.80 1f0j n LEU 255 N -2.72 3.14 -4.68 0.00 4.77 -0.25 -0.97 117.00 116.30 1f0j n LEU 255 Ca -0.02 -2.52 -0.45 0.00 -0.03 0.00 0.00 56.01 52.99 1f0j n LEU 255 Cb 0.06 -0.35 -0.03 0.00 -2.33 0.00 0.00 43.42 40.77 1f0j n LEU 255 CO 0.15 0.68 1.06 -0.67 -1.33 0.00 0.00 177.39 177.28 1f0j n ASP 256 N -0.21 2.90 -0.79 -1.43 2.03 -0.83 -1.94 116.55 116.28 1f0j n ASP 256 Ca 0.15 1.13 -0.10 0.00 0.52 0.00 0.00 54.79 56.49 1f0j n ASP 256 Cb 0.61 -1.44 -0.04 0.00 -0.72 0.00 0.00 41.12 39.53 1f0j n ASP 256 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1f0j n ALA 257 N 2.14 -0.15 0.11 -1.67 0.00 -1.26 -4.86 120.51 114.83 1f0j n ALA 257 Ca 0.12 0.16 -0.24 0.00 0.00 0.00 0.00 53.44 53.48 1f0j n ALA 257 Cb 0.31 -1.67 -0.15 0.00 0.00 0.00 0.00 19.45 17.94 1f0j n ALA 257 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1f0j h VAL 258 N 0.00 1.11 -2.86 0.00 2.07 -1.72 -3.47 116.25 111.37 1f0j h VAL 258 Ca -0.20 -2.61 -0.63 0.00 0.82 0.00 0.00 66.70 64.08 1f0j h VAL 258 Cb 1.10 2.91 -0.05 0.00 -1.52 0.00 0.00 31.29 33.73 1f0j h VAL 258 CO 0.30 0.84 -0.47 -0.36 0.02 0.00 0.00 177.57 177.89 1f0j s PHE 259 N -2.59 3.54 0.81 1.57 0.08 -1.26 -4.94 117.98 115.20 1f0j s PHE 259 Ca -0.13 0.36 -0.12 0.00 0.12 0.00 0.00 56.93 57.17 1f0j s PHE 259 Cb 0.05 -1.84 0.08 0.00 -0.57 0.00 0.00 43.02 40.74 1f0j s PHE 259 CO 0.90 0.62 1.12 0.95 -0.10 0.00 0.00 175.22 178.71 1f0j s THR 260 N -1.39 2.70 0.39 0.64 -4.23 -1.26 -4.85 115.64 107.64 1f0j s THR 260 Ca 0.30 0.23 0.26 0.00 -1.18 0.00 0.00 61.69 61.30 1f0j s THR 260 Cb -0.13 -3.05 0.28 0.00 1.34 0.00 0.00 72.50 70.94 1f0j s THR 260 CO 0.21 -0.30 2.04 0.44 -0.54 0.00 0.00 174.62 176.47 1f0j h ASP 261 N -1.12 0.00 -0.12 3.99 3.32 -1.99 -1.46 116.42 119.04 1f0j h ASP 261 Ca -0.47 0.00 -0.22 0.00 0.02 0.00 0.00 57.03 56.36 1f0j h ASP 261 Cb 1.29 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.85 1f0j h ASP 261 CO 0.62 0.14 -0.77 0.25 -1.72 0.00 0.00 179.24 177.76 1f0j h LEU 262 N 0.00 0.88 -0.88 1.55 5.85 -1.99 -0.60 115.31 120.13 1f0j h LEU 262 Ca -0.00 -0.65 -0.11 0.00 0.84 0.00 0.00 57.88 57.95 1f0j h LEU 262 Cb 0.38 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.14 1f0j h LEU 262 CO 0.02 1.40 -0.43 -0.33 -0.34 0.00 0.00 178.44 178.75 1f0j h GLU 263 N 0.44 0.28 -0.27 1.25 5.08 -1.82 -0.28 114.58 119.26 1f0j h GLU 263 Ca -0.06 -0.14 -0.14 0.00 -1.00 0.00 0.00 59.36 58.02 1f0j h GLU 263 Cb 1.41 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.66 1f0j h GLU 263 CO 0.16 0.67 -0.39 0.82 -1.00 0.00 0.00 179.01 179.27 1f0j h ILE 264 N 0.24 1.30 -0.39 3.13 2.04 -1.24 -1.79 117.51 120.80 1f0j h ILE 264 Ca 0.02 -1.58 -0.02 0.00 1.00 0.00 0.00 64.86 64.28 1f0j h ILE 264 Cb 0.86 1.67 -0.02 0.00 -0.74 0.00 0.00 36.82 38.58 1f0j h ILE 264 CO 0.07 0.50 0.17 0.25 0.00 0.00 0.00 178.15 179.14 1f0j h LEU 265 N 0.47 0.52 -0.58 1.44 5.85 -0.88 -2.37 115.31 119.76 1f0j h LEU 265 Ca 0.03 -0.15 -0.01 0.00 0.84 0.00 0.00 57.88 58.58 1f0j h LEU 265 Cb 0.98 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.84 1f0j h LEU 265 CO 0.09 0.53 0.32 0.00 -0.34 0.00 0.00 178.44 179.04 1f0j h ALA 266 N 1.01 0.75 -0.35 1.25 0.00 -1.00 -0.86 119.26 120.07 1f0j h ALA 266 Ca 0.13 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 1f0j h ALA 266 Cb 0.16 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1f0j h ALA 266 CO -0.01 0.27 0.11 0.00 0.00 0.00 0.00 179.25 179.61 1f0j h ALA 267 N 1.15 0.45 -0.38 0.00 0.00 -1.21 0.88 119.26 120.15 1f0j h ALA 267 Ca 0.20 -0.16 -0.15 0.00 0.00 0.00 0.00 54.91 54.81 1f0j h ALA 267 Cb 0.05 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1f0j h ALA 267 CO -0.03 0.09 -0.35 0.82 0.00 0.00 0.00 179.25 179.78 1f0j h ILE 268 N 0.41 1.28 -0.08 0.00 2.04 -1.35 -1.86 117.51 117.94 1f0j h ILE 268 Ca 0.11 -1.52 -0.00 0.00 1.00 0.00 0.00 64.86 64.45 1f0j h ILE 268 Cb 0.25 1.38 -0.00 0.00 -0.74 0.00 0.00 36.82 37.71 1f0j h ILE 268 CO -0.00 0.51 0.04 0.15 0.00 0.00 0.00 178.15 178.84 1f0j h PHE 269 N 0.72 0.11 -0.49 1.37 3.57 -1.08 -0.85 116.94 120.29 1f0j h PHE 269 Ca 0.06 -0.00 0.09 0.00 3.53 0.00 0.00 57.97 61.65 1f0j h PHE 269 Cb 0.94 -0.03 -0.07 0.00 2.79 0.00 0.00 35.95 39.57 1f0j h PHE 269 CO 0.06 0.17 0.07 0.00 -2.23 0.00 0.00 178.31 176.39 1f0j h ALA 270 N 0.93 0.52 -0.91 2.41 0.00 -0.75 -0.95 119.26 120.51 1f0j h ALA 270 Ca 0.03 0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 1f0j h ALA 270 Cb 0.10 0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.02 1f0j h ALA 270 CO -0.00 -0.33 0.56 0.00 0.00 0.00 0.00 179.25 179.48 1f0j h ALA 271 N 1.40 1.16 -0.70 0.00 0.00 -1.05 0.58 119.26 120.65 1f0j h ALA 271 Ca 0.25 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 1f0j h ALA 271 Cb 0.34 -0.37 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 1f0j h ALA 271 CO -0.34 0.60 0.24 0.00 0.00 0.00 0.00 179.25 179.74 1f0j h ALA 272 N 1.31 1.10 -0.01 0.00 0.00 0.10 -3.19 119.26 118.57 1f0j h ALA 272 Ca 0.33 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1f0j h ALA 272 Cb -0.08 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.44 1f0j h ALA 272 CO -0.06 0.62 -0.49 0.44 0.00 0.00 0.00 179.25 179.76 1f0j n ILE 273 N -4.27 0.00 0.24 0.00 -5.35 -0.54 -4.65 119.36 104.79 1f0j n ILE 273 Ca 0.06 -0.20 0.18 0.00 -0.27 0.00 0.00 62.75 62.51 1f0j n ILE 273 Cb 0.21 1.05 0.84 0.00 -1.74 0.00 0.00 39.64 39.99 1f0j n ILE 273 CO 0.00 0.00 0.00 1.12 -1.76 0.00 0.00 176.55 175.91 1f0j h HIS 274 N 1.90 0.00 0.00 4.28 2.07 -0.87 -2.22 115.15 120.31 1f0j h HIS 274 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 1f0j h HIS 274 Cb 0.68 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.66 1f0j h HIS 274 CO 0.00 0.00 -0.15 -0.25 -3.07 0.00 0.00 177.93 174.46 1f0j n ASP 275 N -3.32 1.57 -4.76 3.10 8.00 -1.26 -4.84 116.55 115.04 1f0j n ASP 275 Ca 0.01 -2.63 -0.41 0.00 0.71 0.00 0.00 54.79 52.47 1f0j n ASP 275 Cb 0.41 -0.32 -0.01 0.00 -0.02 0.00 0.00 41.12 41.18 1f0j n ASP 275 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1f0j s VAL 276 N -1.83 2.14 -1.29 2.53 0.11 -0.84 -2.36 120.40 118.86 1f0j s VAL 276 Ca 0.20 0.13 0.00 0.00 -2.93 0.00 0.00 61.98 59.38 1f0j s VAL 276 Cb 0.17 -3.08 0.00 0.00 -1.53 0.00 0.00 36.38 31.94 1f0j s VAL 276 CO 0.02 0.03 0.00 -0.67 -3.33 0.00 0.00 175.10 171.14 1f0j n ASP 277 N 1.35 -4.51 -4.70 3.54 2.03 -0.21 -4.35 116.55 109.70 1f0j n ASP 277 Ca 0.04 0.02 -0.42 0.00 0.52 0.00 0.00 54.79 54.95 1f0j n ASP 277 Cb 0.39 -3.63 -0.03 0.00 -0.72 0.00 0.00 41.12 37.13 1f0j n ASP 277 CO 0.00 0.00 0.00 -2.28 -1.92 0.00 0.00 177.20 173.00 1f0j s HIS 278 N -2.72 3.10 -1.44 -0.67 5.65 -1.00 -4.92 115.29 113.29 1f0j s HIS 278 Ca 0.00 1.00 0.29 0.00 0.25 0.00 0.00 55.06 56.60 1f0j s HIS 278 Cb 0.00 -3.58 1.44 0.00 -1.18 0.00 0.00 32.58 29.27 1f0j s HIS 278 CO 0.00 -2.02 1.99 -0.35 -0.65 0.00 0.00 174.74 173.71 1f0j n PRO 279 N 4.78 0.42 -0.63 2.88 -0.04 -1.26 -4.45 135.00 136.69 1f0j n PRO 279 Ca 0.12 0.02 0.00 0.00 -0.04 0.00 0.00 63.50 63.59 1f0j n PRO 279 Cb 0.44 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.40 1f0j n PRO 279 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1f0j n GLY 280 N 1.13 0.66 3.16 0.55 0.00 -1.26 -4.98 105.19 104.45 1f0j n GLY 280 Ca 0.14 -0.26 -0.11 0.00 0.00 0.00 0.00 46.02 45.79 1f0j n GLY 280 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1f0j s VAL 281 N -2.00 0.69 0.74 1.61 -7.23 -1.26 -4.49 120.40 108.46 1f0j s VAL 281 Ca 0.00 -1.87 -0.11 0.00 -1.81 0.00 0.00 61.98 58.19 1f0j s VAL 281 Cb 0.00 -1.60 0.04 0.00 0.56 0.00 0.00 36.38 35.38 1f0j s VAL 281 CO 0.00 -0.83 1.10 -0.94 -0.31 0.00 0.00 175.10 174.12 1f0j s SER 282 N -2.93 5.05 0.29 4.85 1.04 -1.26 -4.92 113.70 115.82 1f0j s SER 282 Ca 0.10 1.20 -0.01 0.00 0.48 0.00 0.00 55.95 57.72 1f0j s SER 282 Cb 0.04 -1.96 0.46 0.00 0.10 0.00 0.00 66.02 64.65 1f0j s SER 282 CO -0.04 -1.60 1.92 0.78 0.98 0.00 0.00 173.24 175.28 1f0j h ASN 283 N -0.84 0.97 -0.81 7.02 2.35 -2.01 -1.70 115.58 120.56 1f0j h ASN 283 Ca -0.46 -0.01 -0.02 0.00 -0.55 0.00 0.00 56.30 55.26 1f0j h ASN 283 Cb 1.26 -0.22 -0.04 0.00 0.05 0.00 0.00 38.32 39.38 1f0j h ASN 283 CO 0.62 0.65 0.41 -0.61 -1.65 0.00 0.00 177.43 176.86 1f0j h GLN 284 N 1.12 1.15 -0.63 0.81 5.75 -1.97 0.20 115.11 121.53 1f0j h GLN 284 Ca 0.37 -0.15 0.01 0.00 -0.15 0.00 0.00 58.65 58.73 1f0j h GLN 284 Cb 0.07 -0.21 -0.03 0.00 1.07 0.00 0.00 27.48 28.37 1f0j h GLN 284 CO -0.12 0.87 0.41 0.35 -2.65 0.00 0.00 178.83 177.69 1f0j h PHE 285 N 1.14 0.78 -0.78 3.99 3.04 -1.70 0.17 116.94 123.58 1f0j h PHE 285 Ca 0.28 0.02 -0.04 0.00 3.98 0.00 0.00 57.97 62.21 1f0j h PHE 285 Cb 0.08 -0.26 -0.04 0.00 2.56 0.00 0.00 35.95 38.29 1f0j h PHE 285 CO 0.01 0.48 0.34 -0.07 -2.02 0.00 0.00 178.31 177.06 1f0j h LEU 286 N 0.83 1.05 -0.24 0.59 3.38 -0.73 -1.78 115.31 118.42 1f0j h LEU 286 Ca 0.23 -0.15 -0.07 0.00 0.09 0.00 0.00 57.88 57.98 1f0j h LEU 286 Cb -0.08 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.39 1f0j h LEU 286 CO -0.06 0.92 -0.12 0.40 0.09 0.00 0.00 178.44 179.67 1f0j h ILE 287 N 1.12 1.30 0.00 1.22 2.04 -0.42 -0.63 117.51 122.14 1f0j h ILE 287 Ca 0.27 -1.20 -0.04 0.00 1.00 0.00 0.00 64.86 64.88 1f0j h ILE 287 Cb 0.17 1.57 -0.01 0.00 -0.74 0.00 0.00 36.82 37.82 1f0j h ILE 287 CO -0.03 0.37 -0.20 0.78 0.00 0.00 0.00 178.15 179.08 1f0j h ASN 288 N 0.23 0.00 -0.27 1.72 2.35 -0.48 -2.34 115.58 116.78 1f0j h ASN 288 Ca 0.05 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.80 1f0j h ASN 288 Cb 0.63 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.00 1f0j h ASN 288 CO 0.04 0.20 0.00 0.35 -1.65 0.00 0.00 177.43 176.37 1f0j n THR 289 N -3.98 0.35 -3.59 2.81 -2.24 -0.68 -4.93 114.28 102.02 1f0j n THR 289 Ca -0.02 -0.49 -0.23 0.00 -2.27 0.00 0.00 64.05 61.04 1f0j n THR 289 Cb 0.28 0.50 0.08 0.00 -2.10 0.00 0.00 70.33 69.09 1f0j n THR 289 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1f0j n ASN 290 N 0.69 -5.59 -4.73 3.42 3.02 -0.88 -4.94 115.26 106.26 1f0j n ASN 290 Ca 0.17 -0.57 -0.39 0.00 -0.03 0.00 0.00 54.58 53.76 1f0j n ASN 290 Cb 0.40 -4.98 0.04 0.00 -0.61 0.00 0.00 39.78 34.63 1f0j n ASN 290 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 1f0j n SER 291 N -3.03 2.49 -0.36 6.41 2.88 -0.25 -4.88 113.62 116.88 1f0j n SER 291 Ca -0.04 0.98 0.00 0.00 -1.33 0.00 0.00 58.87 58.48 1f0j n SER 291 Cb 0.58 -1.55 0.15 0.00 -0.75 0.00 0.00 64.21 62.64 1f0j n SER 291 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 1f0j h GLU 292 N 1.41 1.22 -0.56 -1.46 4.81 -1.92 -1.98 114.58 116.10 1f0j h GLU 292 Ca -0.50 -0.07 0.02 0.00 -0.13 0.00 0.00 59.36 58.68 1f0j h GLU 292 Cb 1.31 -0.27 -0.04 0.00 0.63 0.00 0.00 28.75 30.38 1f0j h GLU 292 CO 0.57 0.81 0.34 -0.07 -0.73 0.00 0.00 179.01 179.92 1f0j h LEU 293 N 1.25 0.55 -0.96 1.64 3.38 -1.93 -0.77 115.31 118.48 1f0j h LEU 293 Ca 0.39 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.32 1f0j h LEU 293 Cb 0.00 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.61 1f0j h LEU 293 CO -0.12 0.39 0.22 0.00 0.09 0.00 0.00 178.44 179.02 1f0j h ALA 294 N 1.25 1.17 -0.25 1.53 0.00 -1.66 -1.28 119.26 120.01 1f0j h ALA 294 Ca 0.22 -0.19 -0.15 0.00 0.00 0.00 0.00 54.91 54.80 1f0j h ALA 294 Cb 0.02 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1f0j h ALA 294 CO -0.10 0.59 -0.45 1.25 0.00 0.00 0.00 179.25 180.54 1f0j h LEU 295 N 0.95 0.69 -0.45 0.00 6.46 -0.93 -0.70 115.31 121.33 1f0j h LEU 295 Ca 0.22 -0.33 -0.02 0.00 -0.12 0.00 0.00 57.88 57.63 1f0j h LEU 295 Cb 0.24 -0.19 -0.02 0.00 -0.73 0.00 0.00 40.66 39.95 1f0j h LEU 295 CO -0.01 1.04 0.19 -0.03 -0.62 0.00 0.00 178.44 179.01 1f0j h MET 296 N 0.51 0.67 -0.62 1.25 4.05 -0.76 -3.11 114.93 116.93 1f0j h MET 296 Ca 0.03 -0.11 0.00 0.00 -0.28 0.00 0.00 59.70 59.34 1f0j h MET 296 Cb 0.98 -0.11 0.00 0.00 -0.80 0.00 0.00 31.60 31.67 1f0j h MET 296 CO 0.09 0.60 0.00 0.66 0.23 0.00 0.00 176.91 178.49 1f0j n TYR 297 N -4.61 1.86 -4.02 1.39 4.01 -0.52 -4.95 117.16 110.31 1f0j n TYR 297 Ca 0.01 -0.67 -0.30 0.00 -0.16 0.00 0.00 57.90 56.79 1f0j n TYR 297 Cb 0.14 -0.42 -0.01 0.00 -0.31 0.00 0.00 39.34 38.74 1f0j n TYR 297 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1f0j n ASN 298 N 0.77 -2.29 0.00 7.72 3.02 -0.60 -1.73 115.26 122.14 1f0j n ASN 298 Ca 0.26 -0.95 0.00 0.00 -0.03 0.00 0.00 54.58 53.87 1f0j n ASN 298 Cb 1.08 -3.20 0.00 0.00 -0.61 0.00 0.00 39.78 37.06 1f0j n ASN 298 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1f0j n ASP 299 N -2.85 -3.78 -4.41 6.41 8.00 -0.37 -4.94 116.55 114.61 1f0j n ASP 299 Ca -0.11 0.00 -0.36 0.00 0.71 0.00 0.00 54.79 55.03 1f0j n ASP 299 Cb 0.59 -2.78 -0.13 0.00 -0.02 0.00 0.00 41.12 38.78 1f0j n ASP 299 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1f0j s GLU 300 N -1.47 3.56 -1.53 -1.24 0.41 -0.71 -4.55 118.70 113.17 1f0j s GLU 300 Ca 0.00 -0.54 -0.05 0.00 -0.41 0.00 0.00 54.97 53.97 1f0j s GLU 300 Cb 0.00 -3.27 0.05 0.00 -1.78 0.00 0.00 34.13 29.13 1f0j s GLU 300 CO 0.00 -0.21 0.38 0.43 -0.49 0.00 0.00 175.26 175.37 1f0j n SER 301 N 4.90 -0.63 0.05 -0.19 7.64 -1.26 -4.82 113.62 119.31 1f0j n SER 301 Ca -0.16 -1.10 -0.14 0.00 1.01 0.00 0.00 58.87 58.48 1f0j n SER 301 Cb 0.51 -2.50 -0.09 0.00 -1.01 0.00 0.00 64.21 61.12 1f0j n SER 301 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 1f0j h VAL 302 N -1.70 0.00 -0.70 0.44 2.07 -1.86 -0.29 116.25 114.21 1f0j h VAL 302 Ca -0.63 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 66.82 1f0j h VAL 302 Cb 1.38 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 31.13 1f0j h VAL 302 CO 0.70 0.00 0.17 -0.07 0.02 0.00 0.00 177.57 178.39 1f0j h LEU 303 N -0.60 1.06 -0.62 2.57 3.38 -1.95 -2.23 115.31 116.92 1f0j h LEU 303 Ca 0.01 -0.22 -0.02 0.00 0.09 0.00 0.00 57.88 57.74 1f0j h LEU 303 Cb 0.63 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.08 1f0j h LEU 303 CO -0.31 1.01 0.32 -0.33 0.09 0.00 0.00 178.44 179.23 1f0j h GLU 304 N 1.06 0.88 -0.75 1.13 3.07 -1.85 0.27 114.58 118.40 1f0j h GLU 304 Ca 0.22 -0.11 -0.03 0.00 -0.50 0.00 0.00 59.36 58.94 1f0j h GLU 304 Cb 0.36 -0.17 -0.03 0.00 -0.84 0.00 0.00 28.75 28.07 1f0j h GLU 304 CO 0.00 0.69 0.34 -0.91 -1.40 0.00 0.00 179.01 177.73 1f0j h ASN 305 N 0.85 0.98 -0.44 1.42 2.35 -0.93 -2.56 115.58 117.25 1f0j h ASN 305 Ca 0.22 -0.12 -0.10 0.00 -0.55 0.00 0.00 56.30 55.75 1f0j h ASN 305 Cb 0.08 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.18 1f0j h ASN 305 CO -0.03 0.84 -0.10 -0.74 -1.65 0.00 0.00 177.43 175.75 1f0j h HIS 306 N 1.07 0.94 -0.76 1.19 2.76 -0.70 -1.09 115.15 118.55 1f0j h HIS 306 Ca 0.26 -0.20 0.05 0.00 -2.20 0.00 0.00 60.37 58.27 1f0j h HIS 306 Cb 0.13 -0.23 -0.05 0.00 1.55 0.00 0.00 27.41 28.81 1f0j h HIS 306 CO 0.01 0.94 0.47 0.45 -1.30 0.00 0.00 177.93 178.50 1f0j h HIS 307 N 0.67 0.87 -0.15 5.26 3.86 -0.24 -0.38 115.15 125.04 1f0j h HIS 307 Ca 0.11 0.03 -0.03 0.00 -1.16 0.00 0.00 60.37 59.32 1f0j h HIS 307 Cb 0.63 -0.28 -0.00 0.00 1.06 0.00 0.00 27.41 28.82 1f0j h HIS 307 CO 0.05 0.46 -0.03 -0.07 0.86 0.00 0.00 177.93 179.20 1f0j h LEU 308 N 0.88 0.28 -0.60 2.43 3.38 -1.30 -0.25 115.31 120.14 1f0j h LEU 308 Ca 0.32 -0.36 0.05 0.00 0.09 0.00 0.00 57.88 57.98 1f0j h LEU 308 Cb 0.11 -0.08 -0.05 0.00 0.09 0.00 0.00 40.66 40.73 1f0j h LEU 308 CO -0.15 0.58 0.34 0.00 0.09 0.00 0.00 178.44 179.30 1f0j h ALA 309 N 0.72 0.79 -0.10 1.53 0.00 -0.81 -1.25 119.26 120.13 1f0j h ALA 309 Ca 0.04 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 1f0j h ALA 309 Cb 0.45 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 1f0j h ALA 309 CO 0.01 0.02 -0.00 0.28 0.00 0.00 0.00 179.25 179.56 1f0j h VAL 310 N 0.64 1.26 -0.73 0.00 2.07 -1.04 0.64 116.25 119.09 1f0j h VAL 310 Ca 0.26 -0.83 0.11 0.00 0.82 0.00 0.00 66.70 67.07 1f0j h VAL 310 Cb 0.12 1.61 -0.08 0.00 -1.52 0.00 0.00 31.29 31.42 1f0j h VAL 310 CO -0.15 0.24 0.34 1.23 0.02 0.00 0.00 177.57 179.24 1f0j h GLY 311 N -0.10 1.10 1.48 2.17 0.00 -0.64 -1.04 103.07 106.04 1f0j h GLY 311 Ca 0.03 -0.20 -0.28 0.00 0.00 0.00 0.00 47.33 46.88 1f0j h GLY 311 CO 0.01 -0.00 -1.22 0.74 0.00 0.00 0.00 176.54 176.07 1f0j h PHE 312 N 0.54 0.70 -0.80 5.60 0.04 -1.21 -3.30 116.94 118.51 1f0j h PHE 312 Ca 0.38 -0.47 -0.02 0.00 2.80 0.00 0.00 57.97 60.66 1f0j h PHE 312 Cb 0.47 -0.05 -0.04 0.00 2.20 0.00 0.00 35.95 38.54 1f0j h PHE 312 CO -0.13 1.34 0.44 -0.22 -0.60 0.00 0.00 178.31 179.14 1f0j h LYS 313 N 0.16 1.11 0.00 1.51 1.63 -0.45 -2.05 116.57 118.48 1f0j h LYS 313 Ca -0.15 -0.13 0.00 0.00 -0.85 0.00 0.00 60.65 59.52 1f0j h LYS 313 Cb 1.91 -0.22 0.00 0.00 -0.60 0.00 0.00 32.23 33.32 1f0j h LYS 313 CO 0.21 0.82 0.00 -0.07 -3.45 0.00 0.00 179.45 176.96 1f0j h LEU 314 N 1.12 0.00 -1.87 5.20 3.38 -1.28 -0.82 115.31 121.05 1f0j h LEU 314 Ca 0.28 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.24 1f0j h LEU 314 Cb 0.03 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.78 1f0j h LEU 314 CO -0.05 0.00 -0.06 -0.07 0.09 0.00 0.00 178.44 178.36 1f0j h LEU 315 N 0.00 0.00 0.00 1.67 3.38 -1.50 -2.67 115.31 116.19 1f0j h LEU 315 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1f0j h LEU 315 Cb 0.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.89 1f0j h LEU 315 CO 0.00 0.06 -0.13 0.00 0.09 0.00 0.00 178.44 178.45 1f0j n GLN 316 N -3.27 0.04 -1.48 1.13 6.02 -0.31 -2.49 117.38 117.02 1f0j n GLN 316 Ca -0.01 0.02 -0.29 0.00 -0.01 0.00 0.00 57.00 56.71 1f0j n GLN 316 Cb 0.25 -1.54 0.12 0.00 1.02 0.00 0.00 30.24 30.09 1f0j n GLN 316 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 1f0j s GLU 317 N -3.02 1.59 -0.06 -1.09 2.02 -1.01 -4.90 118.70 112.23 1f0j s GLU 317 Ca 0.13 0.55 -0.36 0.00 0.02 0.00 0.00 54.97 55.31 1f0j s GLU 317 Cb 0.18 -1.87 -0.14 0.00 0.10 0.00 0.00 34.13 32.40 1f0j s GLU 317 CO 0.58 -1.94 1.72 -1.91 0.02 0.00 0.00 175.26 173.72 1f0j n GLU 318 N -3.64 1.80 -2.76 1.61 4.07 -1.26 -2.07 120.64 118.38 1f0j n GLU 318 Ca 0.07 0.66 -0.22 0.00 -0.06 0.00 0.00 57.16 57.61 1f0j n GLU 318 Cb 0.57 -2.42 0.02 0.00 -0.06 0.00 0.00 31.44 29.54 1f0j n GLU 318 CO 0.00 0.00 0.00 0.72 -0.06 0.00 0.00 177.13 177.79 1f0j n HIS 319 N 5.13 -1.57 0.37 4.31 8.25 -1.26 -4.90 115.22 125.56 1f0j n HIS 319 Ca 0.22 0.30 0.04 0.00 -0.26 0.00 0.00 57.72 58.02 1f0j n HIS 319 Cb 0.24 -4.20 0.03 0.00 1.12 0.00 0.00 29.99 27.18 1f0j n HIS 319 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1f0j s ASP 321 N -0.86 6.80 0.00 0.00 2.15 -1.04 -4.53 116.67 119.19 1f0j s ASP 321 Ca 0.09 -2.33 0.13 0.00 0.43 0.00 0.00 52.55 50.88 1f0j s ASP 321 Cb 0.07 -2.54 0.62 0.00 -0.30 0.00 0.00 42.92 40.77 1f0j s ASP 321 CO 0.14 -1.16 1.37 2.30 -0.17 0.00 0.00 175.17 177.64 1f0j n ILE 322 N 6.18 0.82 -0.29 4.11 -5.35 -1.26 -2.07 119.36 121.50 1f0j n ILE 322 Ca 0.43 0.21 0.06 0.00 -0.27 0.00 0.00 62.75 63.18 1f0j n ILE 322 Cb 0.47 -0.99 0.17 0.00 -1.74 0.00 0.00 39.64 37.55 1f0j n ILE 322 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 1f0j n PHE 323 N -1.37 0.55 -0.31 4.28 3.72 -1.26 -4.68 117.46 118.39 1f0j n PHE 323 Ca 0.05 -0.55 0.04 0.00 -0.05 0.00 0.00 57.45 56.94 1f0j n PHE 323 Cb 0.12 -0.07 0.19 0.00 -0.94 0.00 0.00 39.48 38.79 1f0j n PHE 323 CO 0.00 0.00 0.00 1.98 -0.05 0.00 0.00 176.76 178.69 1f0j h MET 324 N 2.08 0.82 -0.24 -1.08 1.85 -1.79 -2.43 114.93 114.15 1f0j h MET 324 Ca 0.00 -0.05 0.00 0.00 -0.61 0.00 0.00 59.70 59.04 1f0j h MET 324 Cb 0.84 -0.19 0.00 0.00 0.43 0.00 0.00 31.60 32.69 1f0j h MET 324 CO 0.03 0.54 0.00 0.09 -0.40 0.00 0.00 176.91 177.18 1f0j n ASN 325 N -4.71 1.65 -4.87 1.39 3.02 -1.26 -4.87 115.26 105.60 1f0j n ASN 325 Ca 0.15 -1.84 -0.31 0.00 -0.03 0.00 0.00 54.58 52.56 1f0j n ASN 325 Cb 0.31 -0.16 -0.01 0.00 -0.61 0.00 0.00 39.78 39.31 1f0j n ASN 325 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1f0j s LEU 326 N -1.29 3.51 0.93 3.41 1.43 -0.92 -4.91 118.68 120.84 1f0j s LEU 326 Ca 0.27 1.35 -0.12 0.00 -1.03 0.00 0.00 54.13 54.60 1f0j s LEU 326 Cb 0.14 -4.33 0.15 0.00 0.03 0.00 0.00 46.19 42.19 1f0j s LEU 326 CO 0.21 -0.66 1.11 0.42 0.23 0.00 0.00 176.35 177.65 1f0j s THR 327 N -2.81 2.25 0.19 5.49 -4.23 -1.26 -4.79 115.64 110.47 1f0j s THR 327 Ca 0.55 0.08 -0.11 0.00 -1.18 0.00 0.00 61.69 61.02 1f0j s THR 327 Cb -0.10 -2.69 0.11 0.00 1.34 0.00 0.00 72.50 71.15 1f0j s THR 327 CO 0.42 -0.11 1.80 0.50 -0.54 0.00 0.00 174.62 176.69 1f0j h LYS 328 N -1.62 0.93 -0.42 3.99 3.64 -1.97 -1.25 116.57 119.89 1f0j h LYS 328 Ca -0.52 -0.12 0.01 0.00 -1.27 0.00 0.00 60.65 58.76 1f0j h LYS 328 Cb 1.32 -0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 32.93 1f0j h LYS 328 CO 0.59 0.71 0.26 -0.22 -2.27 0.00 0.00 179.45 178.52 1f0j h LYS 329 N 0.91 0.52 -0.67 1.90 1.63 -2.00 -1.60 116.57 117.27 1f0j h LYS 329 Ca 0.23 -0.03 -0.02 0.00 -0.85 0.00 0.00 60.65 59.98 1f0j h LYS 329 Cb 0.06 -0.12 -0.03 0.00 -0.60 0.00 0.00 32.23 31.54 1f0j h LYS 329 CO -0.04 0.35 0.32 1.96 -3.45 0.00 0.00 179.45 178.59 1f0j h GLN 330 N 0.54 0.96 -0.54 1.90 4.20 -1.82 -1.25 115.11 119.10 1f0j h GLN 330 Ca 0.16 -0.14 -0.03 0.00 0.06 0.00 0.00 58.65 58.69 1f0j h GLN 330 Cb -0.04 -0.17 -0.02 0.00 0.30 0.00 0.00 27.48 27.54 1f0j h GLN 330 CO -0.05 0.76 0.21 0.00 -0.67 0.00 0.00 178.83 179.08 1f0j h ARG 331 N 0.92 0.81 -0.52 1.46 3.08 -0.93 0.16 114.38 119.36 1f0j h ARG 331 Ca 0.23 -0.15 -0.01 0.00 0.07 0.00 0.00 59.98 60.12 1f0j h ARG 331 Cb 0.11 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.01 1f0j h ARG 331 CO -0.03 0.71 0.30 1.96 -1.07 0.00 0.00 179.97 181.84 1f0j h GLN 332 N 0.73 0.71 -0.22 0.04 4.20 -1.06 0.50 115.11 120.00 1f0j h GLN 332 Ca 0.18 -0.07 -0.03 0.00 0.06 0.00 0.00 58.65 58.78 1f0j h GLN 332 Cb 0.21 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 27.84 1f0j h GLN 332 CO -0.01 0.53 0.01 1.15 -0.67 0.00 0.00 178.83 179.84 1f0j h THR 333 N 0.69 1.25 -0.41 -0.54 2.02 -0.97 -1.66 112.91 113.28 1f0j h THR 333 Ca 0.18 -0.84 -0.02 0.00 0.77 0.00 0.00 66.41 66.50 1f0j h THR 333 Cb 0.01 1.37 -0.02 0.00 -1.74 0.00 0.00 68.15 67.78 1f0j h THR 333 CO -0.03 0.26 0.19 0.25 0.37 0.00 0.00 175.52 176.55 1f0j h LEU 334 N 0.15 0.55 -0.73 2.58 6.46 -0.51 -1.65 115.31 122.16 1f0j h LEU 334 Ca 0.06 -0.14 0.04 0.00 -0.12 0.00 0.00 57.88 57.72 1f0j h LEU 334 Cb 0.38 -0.14 -0.05 0.00 -0.73 0.00 0.00 40.66 40.11 1f0j h LEU 334 CO 0.01 0.54 0.45 -0.09 -0.62 0.00 0.00 178.44 178.73 1f0j h ARG 335 N 0.52 0.83 -0.41 1.25 2.43 -0.84 0.98 114.38 119.14 1f0j h ARG 335 Ca 0.14 -0.05 -0.00 0.00 -0.81 0.00 0.00 59.98 59.26 1f0j h ARG 335 Cb 0.14 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 29.49 1f0j h ARG 335 CO -0.02 0.55 0.25 -0.22 -1.51 0.00 0.00 179.97 179.02 1f0j h LYS 336 N 0.86 0.56 -0.43 0.20 3.64 -0.98 -1.95 116.57 118.46 1f0j h LYS 336 Ca 0.31 -0.05 -0.09 0.00 -1.27 0.00 0.00 60.65 59.55 1f0j h LYS 336 Cb 0.08 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 31.77 1f0j h LYS 336 CO -0.14 0.42 -0.08 0.52 -2.27 0.00 0.00 179.45 177.91 1f0j h MET 337 N 0.54 0.81 -0.41 1.90 2.86 -0.63 -2.41 114.93 117.58 1f0j h MET 337 Ca 0.15 -0.30 -0.03 0.00 -2.06 0.00 0.00 59.70 57.46 1f0j h MET 337 Cb 0.00 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 31.59 1f0j h MET 337 CO -0.03 0.92 0.13 0.28 1.06 0.00 0.00 176.91 179.27 1f0j h VAL 338 N 0.64 1.22 -0.50 -2.22 2.07 -0.71 -0.94 116.25 115.80 1f0j h VAL 338 Ca 0.11 -0.72 0.02 0.00 0.82 0.00 0.00 66.70 66.93 1f0j h VAL 338 Cb 0.60 0.91 -0.03 0.00 -1.52 0.00 0.00 31.29 31.25 1f0j h VAL 338 CO 0.04 0.25 0.31 0.40 0.02 0.00 0.00 177.57 178.59 1f0j h ILE 339 N 0.52 1.08 -0.09 4.57 2.04 -1.35 -0.61 117.51 123.66 1f0j h ILE 339 Ca 0.13 -0.21 0.02 0.00 1.00 0.00 0.00 64.86 65.80 1f0j h ILE 339 Cb 0.26 0.40 -0.02 0.00 -0.74 0.00 0.00 36.82 36.72 1f0j h ILE 339 CO -0.00 0.11 -0.04 -0.78 0.00 0.00 0.00 178.15 177.44 1f0j h ASP 340 N 0.63 -0.15 -0.55 1.72 1.82 -1.13 -1.02 116.42 117.73 1f0j h ASP 340 Ca 0.20 0.04 -0.05 0.00 -0.39 0.00 0.00 57.03 56.82 1f0j h ASP 340 Cb -0.01 0.08 -0.02 0.00 0.68 0.00 0.00 39.33 40.06 1f0j h ASP 340 CO -0.07 -0.06 0.13 0.24 -1.61 0.00 0.00 179.24 177.86 1f0j h MET 341 N -0.04 0.88 -0.26 0.28 2.86 -0.84 -2.46 114.93 115.36 1f0j h MET 341 Ca 0.05 -0.22 -0.13 0.00 -2.06 0.00 0.00 59.70 57.35 1f0j h MET 341 Cb 0.11 -0.11 -0.00 0.00 0.06 0.00 0.00 31.60 31.66 1f0j h MET 341 CO -0.12 0.83 -0.34 0.28 1.06 0.00 0.00 176.91 178.63 1f0j h VAL 342 N 0.78 1.31 0.00 -2.22 2.07 -1.00 -2.76 116.25 114.43 1f0j h VAL 342 Ca 0.17 -1.53 -0.01 0.00 0.82 0.00 0.00 66.70 66.16 1f0j h VAL 342 Cb 0.35 1.68 -0.00 0.00 -1.52 0.00 0.00 31.29 31.80 1f0j h VAL 342 CO 0.00 0.48 -0.05 -0.07 0.02 0.00 0.00 177.57 177.96 1f0j h LEU 343 N 0.41 0.00 -0.20 2.57 3.38 -1.17 -0.28 115.31 120.02 1f0j h LEU 343 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1f0j h LEU 343 Cb 0.92 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.67 1f0j h LEU 343 CO 0.08 0.05 0.00 0.00 0.09 0.00 0.00 178.44 178.66 1f0j n ALA 344 N -2.37 1.91 1.54 1.53 0.00 -0.93 -2.68 120.51 119.51 1f0j n ALA 344 Ca -0.03 -0.02 0.15 0.00 0.00 0.00 0.00 53.44 53.54 1f0j n ALA 344 Cb 0.13 -1.37 0.78 0.00 0.00 0.00 0.00 19.45 19.00 1f0j n ALA 344 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1f0j n THR 345 N -1.83 0.00 -2.10 0.00 -2.24 -0.12 -4.73 114.28 103.26 1f0j n THR 345 Ca 0.04 -0.01 -0.42 0.00 -2.27 0.00 0.00 64.05 61.39 1f0j n THR 345 Cb 0.27 -0.46 -0.03 0.00 -2.10 0.00 0.00 70.33 68.01 1f0j n THR 345 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1f0j s ASP 346 N -2.45 6.71 0.63 3.42 -1.08 -1.09 -4.85 116.67 117.95 1f0j s ASP 346 Ca 0.32 2.10 0.33 0.00 -0.52 0.00 0.00 52.55 54.79 1f0j s ASP 346 Cb 0.21 -2.53 1.89 0.00 -1.46 0.00 0.00 42.92 41.02 1f0j s ASP 346 CO 0.44 -0.91 2.16 0.24 0.52 0.00 0.00 175.17 177.63 1f0j h MET 347 N 9.31 0.00 0.00 4.34 2.86 -1.91 0.00 114.93 129.53 1f0j h MET 347 Ca -0.36 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.28 1f0j h MET 347 Cb 1.16 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.82 1f0j h MET 347 CO 0.96 0.00 0.00 -1.13 1.06 0.00 0.00 176.91 177.80 1f0j n SER 348 N -3.44 0.55 -0.68 1.22 3.41 -1.26 -1.78 113.62 111.63 1f0j n SER 348 Ca -0.01 0.67 0.11 0.00 -0.26 0.00 0.00 58.87 59.37 1f0j n SER 348 Cb 0.24 -0.77 0.05 0.00 -0.26 0.00 0.00 64.21 63.46 1f0j n SER 348 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1f0j n LYS 349 N -2.14 1.72 -0.07 4.33 4.76 -0.01 -4.68 118.16 122.07 1f0j n LYS 349 Ca 0.01 -1.40 -0.14 0.00 -2.87 0.00 0.00 58.31 53.92 1f0j n LYS 349 Cb 0.17 -1.42 -0.09 0.00 -1.84 0.00 0.00 35.03 31.85 1f0j n LYS 349 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 1f0j h HIS 350 N 3.33 -1.56 -0.95 2.13 -0.00 -1.42 -1.67 115.15 115.00 1f0j h HIS 350 Ca 0.00 0.07 0.16 0.00 -0.00 0.00 0.00 60.37 60.60 1f0j h HIS 350 Cb 0.81 0.72 -0.08 0.00 -0.00 0.00 0.00 27.41 28.85 1f0j h HIS 350 CO 0.00 -0.51 0.60 0.52 -0.00 0.00 0.00 177.93 178.54 1f0j h MET 351 N -0.48 0.72 -0.18 5.26 2.86 -1.83 -0.51 114.93 120.76 1f0j h MET 351 Ca 0.06 -0.04 -0.16 0.00 -2.06 0.00 0.00 59.70 57.51 1f0j h MET 351 Cb 0.64 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 32.13 1f0j h MET 351 CO -0.51 0.48 -0.53 0.77 1.06 0.00 0.00 176.91 178.18 1f0j h SER 352 N 0.74 0.59 -0.05 1.22 0.02 -1.74 -1.64 113.55 112.69 1f0j h SER 352 Ca 0.50 -0.31 -0.00 0.00 -0.84 0.00 0.00 61.79 61.14 1f0j h SER 352 Cb 0.79 -0.17 -0.00 0.00 0.14 0.00 0.00 62.40 63.16 1f0j h SER 352 CO -0.27 1.01 0.01 -0.07 -1.14 0.00 0.00 176.83 176.37 1f0j h LEU 353 N 0.41 0.07 -0.30 5.07 3.38 -0.25 -2.39 115.31 121.31 1f0j h LEU 353 Ca 0.01 -0.22 0.03 0.00 0.09 0.00 0.00 57.88 57.79 1f0j h LEU 353 Cb 1.06 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 41.76 1f0j h LEU 353 CO 0.10 0.28 0.10 0.25 0.09 0.00 0.00 178.44 179.25 1f0j h LEU 354 N -0.13 0.10 -0.48 1.67 5.85 -1.12 0.11 115.31 121.31 1f0j h LEU 354 Ca 0.02 0.03 0.08 0.00 0.84 0.00 0.00 57.88 58.85 1f0j h LEU 354 Cb 0.23 0.03 -0.07 0.00 0.37 0.00 0.00 40.66 41.22 1f0j h LEU 354 CO 0.00 0.09 0.10 0.00 -0.34 0.00 0.00 178.44 178.29 1f0j h ALA 355 N 1.20 0.54 -0.65 1.25 0.00 -1.25 -0.21 119.26 120.13 1f0j h ALA 355 Ca 0.13 0.10 -0.06 0.00 0.00 0.00 0.00 54.91 55.08 1f0j h ALA 355 Cb 0.11 0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 1f0j h ALA 355 CO -0.15 -0.30 0.19 -0.44 0.00 0.00 0.00 179.25 178.55 1f0j h ASP 356 N 0.24 0.97 -0.48 0.00 5.19 -0.89 -2.26 116.42 119.19 1f0j h ASP 356 Ca 0.24 -0.22 -0.05 0.00 -0.62 0.00 0.00 57.03 56.38 1f0j h ASP 356 Cb 0.31 -0.25 -0.03 0.00 0.18 0.00 0.00 39.33 39.54 1f0j h ASP 356 CO -0.30 0.93 0.15 0.25 -3.12 0.00 0.00 179.24 177.14 1f0j h LEU 357 N 0.96 0.75 -0.23 1.55 5.85 0.08 -0.88 115.31 123.39 1f0j h LEU 357 Ca 0.21 -0.12 -0.04 0.00 0.84 0.00 0.00 57.88 58.77 1f0j h LEU 357 Cb 0.32 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.15 1f0j h LEU 357 CO -0.00 0.73 0.00 0.11 -0.34 0.00 0.00 178.44 178.94 1f0j h LYS 358 N 0.79 0.40 -0.62 1.25 1.57 -0.83 -1.39 116.57 117.74 1f0j h LYS 358 Ca 0.18 -0.13 0.03 0.00 -1.87 0.00 0.00 60.65 58.86 1f0j h LYS 358 Cb 0.26 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.50 1f0j h LYS 358 CO -0.01 0.58 0.41 1.15 -0.57 0.00 0.00 179.45 181.02 1f0j h THR 359 N 0.17 1.09 -0.02 -0.16 2.02 -1.11 -1.68 112.91 113.22 1f0j h THR 359 Ca 0.06 -0.25 -0.00 0.00 0.77 0.00 0.00 66.41 66.99 1f0j h THR 359 Cb 0.40 0.28 -0.00 0.00 -1.74 0.00 0.00 68.15 67.09 1f0j h THR 359 CO 0.01 0.13 0.01 -0.03 0.37 0.00 0.00 175.52 176.02 1f0j h MET 360 N 0.74 0.03 -0.95 6.66 1.85 -0.67 -3.01 114.93 119.57 1f0j h MET 360 Ca 0.25 -0.00 0.04 0.00 -0.61 0.00 0.00 59.70 59.37 1f0j h MET 360 Cb 0.07 -0.01 -0.06 0.00 0.43 0.00 0.00 31.60 32.04 1f0j h MET 360 CO -0.07 0.10 0.62 0.28 -0.40 0.00 0.00 176.91 177.44 1f0j h VAL 361 N -0.05 1.15 -0.77 -5.77 2.07 -0.38 -2.55 116.25 109.96 1f0j h VAL 361 Ca 0.01 -0.41 0.04 0.00 0.82 0.00 0.00 66.70 67.15 1f0j h VAL 361 Cb 0.08 -0.15 -0.04 0.00 -1.52 0.00 0.00 31.29 29.66 1f0j h VAL 361 CO -0.00 0.22 0.50 -0.33 0.02 0.00 0.00 177.57 177.98 1f0j h GLU 362 N 1.20 0.91 -0.40 1.57 5.08 -1.25 -2.73 114.58 118.96 1f0j h GLU 362 Ca 0.38 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.69 1f0j h GLU 362 Cb 0.02 -0.20 -0.00 0.00 0.50 0.00 0.00 28.75 29.06 1f0j h GLU 362 CO -0.13 0.60 0.00 0.25 -1.00 0.00 0.00 179.01 178.73 1f0j n THR 363 N -4.45 2.51 -1.93 1.13 -2.24 -1.05 -5.03 114.28 103.21 1f0j n THR 363 Ca 0.10 -1.68 -0.36 0.00 -2.27 0.00 0.00 64.05 59.84 1f0j n THR 363 Cb 0.12 -0.27 0.04 0.00 -2.10 0.00 0.00 70.33 68.13 1f0j n THR 363 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 1f0j s LYS 364 N -2.81 2.86 0.15 -0.78 -2.85 -0.99 -5.05 119.74 110.27 1f0j s LYS 364 Ca 0.48 1.78 0.05 0.00 -1.00 0.00 0.00 55.97 57.28 1f0j s LYS 364 Cb 0.38 -1.92 -0.04 0.00 -2.06 0.00 0.00 37.83 34.18 1f0j s LYS 364 CO 0.12 -1.28 -0.12 0.15 0.10 0.00 0.00 175.35 174.32 1f0j s LYS 365 N -3.46 1.08 0.22 1.78 1.02 -1.26 -5.05 119.74 114.07 1f0j s LYS 365 Ca 0.76 -1.39 0.02 0.00 0.02 0.00 0.00 55.97 55.38 1f0j s LYS 365 Cb -0.29 -0.77 -0.05 0.00 -0.52 0.00 0.00 37.83 36.20 1f0j s LYS 365 CO 0.35 0.12 0.03 0.14 -0.92 0.00 0.00 175.35 175.07 1f0j s VAL 366 N -2.89 0.78 0.79 3.17 -7.23 -1.26 -0.23 120.40 113.54 1f0j s VAL 366 Ca 0.15 -2.00 -0.05 0.00 -1.81 0.00 0.00 61.98 58.26 1f0j s VAL 366 Cb -0.00 -2.38 0.15 0.00 0.56 0.00 0.00 36.38 34.71 1f0j s VAL 366 CO 0.02 -0.26 1.09 0.42 -0.31 0.00 0.00 175.10 176.06 1f0j s THR 367 N -3.59 2.08 -0.95 5.32 -4.23 0.17 -4.82 115.64 109.62 1f0j s THR 367 Ca 0.30 -0.43 0.06 0.00 -1.18 0.00 0.00 61.69 60.44 1f0j s THR 367 Cb 0.07 -2.65 0.05 0.00 1.34 0.00 0.00 72.50 71.31 1f0j s THR 367 CO 0.09 0.00 1.20 -1.54 -0.54 0.00 0.00 174.62 173.83 1f0j n SER 368 N -3.10 0.04 -0.84 3.99 3.41 -1.26 -0.49 113.62 115.36 1f0j n SER 368 Ca 0.15 0.52 0.09 0.00 -0.26 0.00 0.00 58.87 59.37 1f0j n SER 368 Cb 0.60 -0.52 0.14 0.00 -0.26 0.00 0.00 64.21 64.17 1f0j n SER 368 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1f0j n SER 369 N -1.55 2.88 0.00 4.04 3.41 -1.26 -4.95 113.62 116.18 1f0j n SER 369 Ca 0.01 -1.85 0.00 0.00 -0.26 0.00 0.00 58.87 56.78 1f0j n SER 369 Cb 0.06 -0.13 0.00 0.00 -0.26 0.00 0.00 64.21 63.88 1f0j n SER 369 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1f0j n GLY 370 N 1.08 1.23 3.76 5.00 0.00 0.35 -5.03 105.19 111.59 1f0j n GLY 370 Ca 0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.75 1f0j n GLY 370 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1f0j s VAL 371 N -3.12 3.32 0.47 1.61 1.01 -1.26 -4.59 120.40 117.84 1f0j s VAL 371 Ca 0.00 1.33 -0.24 0.00 0.00 0.00 0.00 61.98 63.07 1f0j s VAL 371 Cb 0.00 -3.85 -0.08 0.00 0.00 0.00 0.00 36.38 32.45 1f0j s VAL 371 CO 0.00 0.32 1.37 0.18 0.00 0.00 0.00 175.10 176.96 1f0j n LEU 372 N 1.10 4.90 -4.14 3.92 4.77 -0.15 0.45 117.00 127.85 1f0j n LEU 372 Ca -0.01 1.08 -0.34 0.00 -0.03 0.00 0.00 56.01 56.71 1f0j n LEU 372 Cb 0.44 -1.57 -0.14 0.00 -2.33 0.00 0.00 43.42 39.82 1f0j n LEU 372 CO 0.55 -0.41 -0.40 -0.76 -1.33 0.00 0.00 177.39 175.04 1f0j s LEU 373 N -2.57 3.68 -0.61 2.23 1.43 0.68 -4.75 118.68 118.77 1f0j s LEU 373 Ca 0.64 -1.29 -0.02 0.00 -1.03 0.00 0.00 54.13 52.43 1f0j s LEU 373 Cb -0.46 -1.65 0.16 0.00 0.03 0.00 0.00 46.19 44.27 1f0j s LEU 373 CO 0.56 -0.22 0.41 -0.76 0.23 0.00 0.00 176.35 176.56 1f0j s LEU 374 N 1.20 5.08 0.19 1.79 1.43 -1.26 -4.38 118.68 122.73 1f0j s LEU 374 Ca -0.06 -2.90 -0.06 0.00 -1.03 0.00 0.00 54.13 50.08 1f0j s LEU 374 Cb -0.20 -1.82 0.11 0.00 0.03 0.00 0.00 46.19 44.32 1f0j s LEU 374 CO -0.03 -0.34 1.56 0.44 0.23 0.00 0.00 176.35 178.21 1f0j h ASP 375 N 6.92 0.81 -2.17 2.29 3.32 -1.97 -3.45 116.42 122.17 1f0j h ASP 375 Ca -0.02 -0.34 -0.55 0.00 0.02 0.00 0.00 57.03 56.14 1f0j h ASP 375 Cb 0.94 -0.23 -0.09 0.00 0.22 0.00 0.00 39.33 40.18 1f0j h ASP 375 CO 0.71 1.07 -0.61 0.54 -1.72 0.00 0.00 179.24 179.23 1f0j s ASN 376 N -6.81 4.72 0.14 6.45 6.03 -1.26 -5.04 114.94 119.16 1f0j s ASN 376 Ca -0.09 -0.59 -0.21 0.00 -1.03 0.00 0.00 52.86 50.94 1f0j s ASN 376 Cb 0.12 -0.92 -0.00 0.00 -3.03 0.00 0.00 41.25 37.41 1f0j s ASN 376 CO 0.85 -0.04 1.68 0.22 -2.03 0.00 0.00 177.10 177.78 1f0j h TYR 377 N 1.79 -0.27 -0.91 1.54 3.20 -1.99 -2.06 116.97 118.26 1f0j h TYR 377 Ca -0.45 0.02 0.24 0.00 3.14 0.00 0.00 58.73 61.69 1f0j h TYR 377 Cb 1.25 0.15 -0.13 0.00 1.54 0.00 0.00 36.73 39.53 1f0j h TYR 377 CO 0.66 -0.17 0.38 1.15 -1.64 0.00 0.00 178.16 178.54 1f0j h THR 378 N -0.10 0.40 -0.07 1.81 2.02 -1.99 0.14 112.91 115.11 1f0j h THR 378 Ca 0.11 -0.11 -0.23 0.00 0.77 0.00 0.00 66.41 66.94 1f0j h THR 378 Cb 0.26 0.03 0.01 0.00 -1.74 0.00 0.00 68.15 66.72 1f0j h THR 378 CO -0.26 0.06 -0.88 0.44 0.37 0.00 0.00 175.52 175.25 1f0j h ASP 379 N 0.33 0.82 -0.27 4.18 3.32 -1.84 -2.43 116.42 120.54 1f0j h ASP 379 Ca 0.59 -0.59 -0.01 0.00 0.02 0.00 0.00 57.03 57.03 1f0j h ASP 379 Cb 1.19 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 40.48 1f0j h ASP 379 CO -0.58 1.39 0.11 0.03 -1.72 0.00 0.00 179.24 178.47 1f0j h ARG 380 N 0.42 0.40 -0.16 3.56 3.08 -0.31 -2.02 114.38 119.34 1f0j h ARG 380 Ca -0.08 -0.07 -0.09 0.00 0.07 0.00 0.00 59.98 59.81 1f0j h ARG 380 Cb 1.51 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 31.49 1f0j h ARG 380 CO 0.17 0.42 -0.30 0.97 -1.07 0.00 0.00 179.97 180.17 1f0j h ILE 381 N 0.28 1.27 -0.69 2.04 6.09 -0.89 -0.98 117.51 124.63 1f0j h ILE 381 Ca 0.09 -1.28 -0.05 0.00 -1.37 0.00 0.00 64.86 62.25 1f0j h ILE 381 Cb 0.17 1.48 -0.03 0.00 0.47 0.00 0.00 36.82 38.91 1f0j h ILE 381 CO -0.01 0.39 0.24 -0.61 -3.07 0.00 0.00 178.15 175.10 1f0j h GLN 382 N 0.27 1.04 -0.06 2.19 4.15 -1.18 0.14 115.11 121.66 1f0j h GLN 382 Ca 0.04 -0.19 -0.11 0.00 0.77 0.00 0.00 58.65 59.15 1f0j h GLN 382 Cb 0.67 -0.16 0.01 0.00 0.21 0.00 0.00 27.48 28.20 1f0j h GLN 382 CO 0.05 0.87 -0.39 0.28 -1.93 0.00 0.00 178.83 177.70 1f0j h VAL 383 N 1.01 1.42 -0.86 2.39 2.07 -0.97 -2.68 116.25 118.62 1f0j h VAL 383 Ca 0.23 -1.81 -0.01 0.00 0.82 0.00 0.00 66.70 65.93 1f0j h VAL 383 Cb 0.24 2.36 -0.04 0.00 -1.52 0.00 0.00 31.29 32.33 1f0j h VAL 383 CO -0.01 0.52 0.50 -0.07 0.02 0.00 0.00 177.57 178.54 1f0j h LEU 384 N -0.11 1.04 -0.31 2.57 3.38 -1.03 0.31 115.31 121.16 1f0j h LEU 384 Ca -0.03 -0.08 0.03 0.00 0.09 0.00 0.00 57.88 57.89 1f0j h LEU 384 Cb 1.06 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.51 1f0j h LEU 384 CO 0.08 0.81 0.12 -0.09 0.09 0.00 0.00 178.44 179.45 1f0j h ARG 385 N 1.18 0.26 -0.05 1.13 2.43 -0.75 -1.05 114.38 117.53 1f0j h ARG 385 Ca 0.31 -0.02 -0.15 0.00 -0.81 0.00 0.00 59.98 59.31 1f0j h ARG 385 Cb -0.03 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.45 1f0j h ARG 385 CO -0.06 0.17 -0.63 -0.91 -1.51 0.00 0.00 179.97 177.04 1f0j h ASN 386 N 0.26 0.23 -0.18 -3.80 2.35 -1.09 -2.62 115.58 110.73 1f0j h ASN 386 Ca 0.14 -0.14 -0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1f0j h ASN 386 Cb 0.09 -0.07 -0.01 0.00 0.05 0.00 0.00 38.32 38.39 1f0j h ASN 386 CO -0.13 0.80 0.11 -0.03 -1.65 0.00 0.00 177.43 176.53 1f0j h MET 387 N 0.15 0.26 -0.73 0.81 4.05 0.17 0.12 114.93 119.75 1f0j h MET 387 Ca -0.01 -0.03 -0.06 0.00 -0.28 0.00 0.00 59.70 59.32 1f0j h MET 387 Cb 1.14 -0.05 -0.03 0.00 -0.80 0.00 0.00 31.60 31.86 1f0j h MET 387 CO 0.09 0.24 0.22 0.28 0.23 0.00 0.00 176.91 177.98 1f0j h VAL 388 N 0.20 1.26 -0.77 -5.77 2.07 -1.19 -0.51 116.25 111.54 1f0j h VAL 388 Ca 0.07 -0.90 -0.02 0.00 0.82 0.00 0.00 66.70 66.67 1f0j h VAL 388 Cb 0.05 0.46 -0.04 0.00 -1.52 0.00 0.00 31.29 30.24 1f0j h VAL 388 CO -0.01 0.35 0.42 -0.74 0.02 0.00 0.00 177.57 177.61 1f0j h HIS 389 N 1.08 1.07 -0.46 1.57 6.17 -1.08 0.53 115.15 124.02 1f0j h HIS 389 Ca 0.24 -0.03 -0.07 0.00 0.71 0.00 0.00 60.37 61.22 1f0j h HIS 389 Cb 0.30 -0.34 -0.02 0.00 2.52 0.00 0.00 27.41 29.88 1f0j h HIS 389 CO 0.02 0.75 0.02 0.00 0.71 0.00 0.00 177.93 179.44 1f0j h ALA 391 N 0.93 1.28 -0.23 0.00 0.00 -0.63 -1.07 119.26 119.54 1f0j h ALA 391 Ca 0.13 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 1f0j h ALA 391 Cb 0.47 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1f0j h ALA 391 CO 0.02 0.64 -0.13 0.22 0.00 0.00 0.00 179.25 180.00 1f0j h ASP 392 N 1.27 0.36 -0.90 0.00 3.58 -0.50 -2.79 116.42 117.43 1f0j h ASP 392 Ca 0.34 -0.09 -0.63 0.00 0.42 0.00 0.00 57.03 57.07 1f0j h ASP 392 Cb -0.09 -0.10 -0.34 0.00 1.72 0.00 0.00 39.33 40.52 1f0j h ASP 392 CO -0.07 0.53 0.26 0.18 -2.88 0.00 0.00 179.24 177.26 1f0j n LEU 393 N -4.23 6.66 -0.49 2.28 4.77 -0.48 -4.63 117.00 120.88 1f0j n LEU 393 Ca 0.00 -4.44 0.11 0.00 -0.03 0.00 0.00 56.01 51.65 1f0j n LEU 393 Cb 0.30 -0.74 0.08 0.00 -2.33 0.00 0.00 43.42 40.72 1f0j n LEU 393 CO 0.39 1.69 0.40 -1.54 -1.33 0.00 0.00 177.39 177.00 1f0j n SER 394 N -0.85 1.93 -0.22 -1.43 3.41 -0.55 -4.54 113.62 111.37 1f0j n SER 394 Ca 0.56 -1.45 0.02 0.00 -0.26 0.00 0.00 58.87 57.74 1f0j n SER 394 Cb 0.79 0.38 0.13 0.00 -0.26 0.00 0.00 64.21 65.24 1f0j n SER 394 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 1f0j h ASN 395 N 2.41 -0.11 0.42 4.04 -0.26 -1.83 -0.21 115.58 120.04 1f0j h ASN 395 Ca 0.00 0.14 0.00 0.00 -0.56 0.00 0.00 56.30 55.88 1f0j h ASN 395 Cb 0.73 0.21 0.00 0.00 -1.06 0.00 0.00 38.32 38.21 1f0j h ASN 395 CO 0.00 -0.06 0.00 -2.65 -1.06 0.00 0.00 177.43 173.66 1f0j n PRO 396 N -5.20 0.04 0.00 0.81 -0.02 -1.26 -2.46 135.00 126.91 1f0j n PRO 396 Ca 0.11 0.24 0.12 0.00 -2.02 0.00 0.00 63.50 61.95 1f0j n PRO 396 Cb 0.38 -1.50 0.19 0.00 -0.02 0.00 0.00 33.50 32.55 1f0j n PRO 396 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1f0j n THR 397 N -1.45 0.00 -2.57 3.45 -2.24 -0.10 -4.03 114.28 107.35 1f0j n THR 397 Ca 0.04 -0.37 -0.23 0.00 -2.27 0.00 0.00 64.05 61.21 1f0j n THR 397 Cb 0.15 1.17 0.08 0.00 -2.10 0.00 0.00 70.33 69.62 1f0j n THR 397 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1f0j s LYS 398 N -2.13 1.98 0.59 -0.78 -0.14 -1.03 -4.68 119.74 113.56 1f0j s LYS 398 Ca 0.28 -0.94 -0.19 0.00 -1.36 0.00 0.00 55.97 53.77 1f0j s LYS 398 Cb 0.20 -2.36 -0.05 0.00 -1.68 0.00 0.00 37.83 33.94 1f0j s LYS 398 CO 0.38 -1.21 1.03 -1.13 -0.76 0.00 0.00 175.35 173.66 1f0j n SER 399 N -2.69 1.08 -0.30 2.83 3.41 -1.26 -4.58 113.62 112.10 1f0j n SER 399 Ca 0.12 0.83 0.08 0.00 -0.26 0.00 0.00 58.87 59.65 1f0j n SER 399 Cb 0.60 -1.42 0.24 0.00 -0.26 0.00 0.00 64.21 63.37 1f0j n SER 399 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 1f0j h LEU 400 N 0.61 0.52 -0.64 1.04 5.85 -1.95 0.98 115.31 121.72 1f0j h LEU 400 Ca -0.49 0.10 0.09 0.00 0.84 0.00 0.00 57.88 58.43 1f0j h LEU 400 Cb 1.36 0.02 -0.07 0.00 0.37 0.00 0.00 40.66 42.33 1f0j h LEU 400 CO 0.52 0.20 0.27 -0.08 -0.34 0.00 0.00 178.44 179.00 1f0j h GLU 401 N 0.61 0.45 -0.03 1.25 4.81 -2.00 0.14 114.58 119.81 1f0j h GLU 401 Ca 0.48 -0.03 -0.08 0.00 -0.13 0.00 0.00 59.36 59.60 1f0j h GLU 401 Cb 0.71 -0.10 0.01 0.00 0.63 0.00 0.00 28.75 29.99 1f0j h GLU 401 CO -0.38 0.30 -0.31 -0.07 -0.73 0.00 0.00 179.01 177.82 1f0j h LEU 402 N 0.46 0.33 -0.83 1.64 3.38 -1.51 -3.10 115.31 115.68 1f0j h LEU 402 Ca 0.32 -0.70 0.10 0.00 0.09 0.00 0.00 57.88 57.69 1f0j h LEU 402 Cb 0.38 -0.10 -0.08 0.00 0.09 0.00 0.00 40.66 40.96 1f0j h LEU 402 CO -0.30 0.98 0.47 0.22 0.09 0.00 0.00 178.44 179.91 1f0j h TYR 403 N -0.30 0.86 -0.26 1.13 3.20 -0.50 -0.23 116.97 120.87 1f0j h TYR 403 Ca -0.03 0.03 -0.06 0.00 3.14 0.00 0.00 58.73 61.81 1f0j h TYR 403 Cb 1.00 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 39.00 1f0j h TYR 403 CO 0.15 0.33 -0.10 0.00 -1.64 0.00 0.00 178.16 176.90 1f0j h ARG 404 N 0.78 0.42 -0.44 1.82 3.08 -0.79 -0.93 114.38 118.32 1f0j h ARG 404 Ca 0.41 -0.11 -0.14 0.00 0.07 0.00 0.00 59.98 60.21 1f0j h ARG 404 Cb 0.40 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.39 1f0j h ARG 404 CO -0.26 0.53 -0.29 1.96 -1.07 0.00 0.00 179.97 180.84 1f0j h GLN 405 N 0.40 0.97 -0.43 0.04 4.20 -1.02 -1.96 115.11 117.31 1f0j h GLN 405 Ca 0.08 -0.45 -0.09 0.00 0.06 0.00 0.00 58.65 58.24 1f0j h GLN 405 Cb 0.42 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.18 1f0j h GLN 405 CO 0.02 1.12 -0.09 -1.49 -0.67 0.00 0.00 178.83 177.73 1f0j h TRP 406 N 0.81 0.91 -0.47 2.96 -0.00 -0.72 -2.80 115.95 116.65 1f0j h TRP 406 Ca 0.09 -0.19 -0.07 0.00 -0.00 0.00 0.00 58.89 58.72 1f0j h TRP 406 Cb 0.88 -0.22 -0.02 0.00 -0.00 0.00 0.00 29.16 29.79 1f0j h TRP 406 CO 0.06 0.92 0.01 1.79 -0.00 0.00 0.00 178.44 181.21 1f0j h THR 407 N 0.64 1.24 -0.68 1.49 1.35 -1.12 0.19 112.91 116.01 1f0j h THR 407 Ca 0.11 -0.97 0.04 0.00 -0.55 0.00 0.00 66.41 65.04 1f0j h THR 407 Cb 0.61 0.87 -0.05 0.00 -1.73 0.00 0.00 68.15 67.86 1f0j h THR 407 CO 0.04 0.34 0.42 0.44 -0.25 0.00 0.00 175.52 176.51 1f0j h ASP 408 N 0.72 0.67 -0.40 5.36 3.32 -1.24 -0.67 116.42 124.18 1f0j h ASP 408 Ca 0.14 0.01 -0.10 0.00 0.02 0.00 0.00 57.03 57.10 1f0j h ASP 408 Cb 0.43 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.83 1f0j h ASP 408 CO 0.02 0.46 -0.13 0.03 -1.72 0.00 0.00 179.24 177.90 1f0j h ARG 409 N 0.80 0.79 -0.20 3.56 3.08 -1.13 -0.79 114.38 120.49 1f0j h ARG 409 Ca 0.28 -0.32 0.04 0.00 0.07 0.00 0.00 59.98 60.05 1f0j h ARG 409 Cb 0.06 -0.04 -0.04 0.00 0.08 0.00 0.00 29.97 30.03 1f0j h ARG 409 CO -0.12 0.93 -0.03 0.82 -1.07 0.00 0.00 179.97 180.50 1f0j h ILE 410 N 0.59 0.82 -0.58 2.04 2.04 -0.52 -0.44 117.51 121.47 1f0j h ILE 410 Ca 0.10 -0.01 -0.10 0.00 1.00 0.00 0.00 64.86 65.85 1f0j h ILE 410 Cb 0.66 0.79 -0.02 0.00 -0.74 0.00 0.00 36.82 37.52 1f0j h ILE 410 CO 0.05 0.00 -0.02 0.24 0.00 0.00 0.00 178.15 178.42 1f0j h MET 411 N 0.02 1.02 -0.75 2.37 2.86 -1.10 -1.86 114.93 117.51 1f0j h MET 411 Ca 0.10 -0.33 0.05 0.00 -2.06 0.00 0.00 59.70 57.46 1f0j h MET 411 Cb 0.14 -0.09 -0.05 0.00 0.06 0.00 0.00 31.60 31.65 1f0j h MET 411 CO -0.19 1.01 0.45 1.49 1.06 0.00 0.00 176.91 180.73 1f0j h GLU 412 N 0.93 0.83 -0.44 1.72 4.81 -0.60 -0.23 114.58 121.61 1f0j h GLU 412 Ca 0.16 -0.05 -0.14 0.00 -0.13 0.00 0.00 59.36 59.20 1f0j h GLU 412 Cb 0.57 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.75 1f0j h GLU 412 CO 0.03 0.55 -0.28 1.49 -0.73 0.00 0.00 179.01 180.07 1f0j h GLU 413 N 0.85 0.95 -0.27 1.92 4.81 -0.82 -1.24 114.58 120.79 1f0j h GLU 413 Ca 0.32 -0.44 0.02 0.00 -0.13 0.00 0.00 59.36 59.13 1f0j h GLU 413 Cb 0.11 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.45 1f0j h GLU 413 CO -0.15 1.11 0.12 0.74 -0.73 0.00 0.00 179.01 180.10 1f0j h PHE 414 N 0.81 0.23 0.00 0.92 0.04 -0.70 -1.45 116.94 116.78 1f0j h PHE 414 Ca 0.09 0.01 -0.03 0.00 2.80 0.00 0.00 57.97 60.84 1f0j h PHE 414 Cb 0.86 -0.06 -0.00 0.00 2.20 0.00 0.00 35.95 38.95 1f0j h PHE 414 CO 0.05 0.12 -0.15 0.74 -0.60 0.00 0.00 178.31 178.48 1f0j h PHE 415 N 0.26 0.00 -0.39 -0.55 0.04 -0.90 -0.25 116.94 115.15 1f0j h PHE 415 Ca 0.11 0.00 -0.12 0.00 2.80 0.00 0.00 57.97 60.76 1f0j h PHE 415 Cb 0.05 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.19 1f0j h PHE 415 CO -0.10 0.15 -0.24 1.96 -0.60 0.00 0.00 178.31 179.48 1f0j h GLN 416 N 0.00 0.85 -0.45 1.51 4.20 -0.23 -0.97 115.11 120.02 1f0j h GLN 416 Ca -0.00 -0.40 -0.12 0.00 0.06 0.00 0.00 58.65 58.19 1f0j h GLN 416 Cb 0.35 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.11 1f0j h GLN 416 CO 0.02 1.04 -0.21 0.37 -0.67 0.00 0.00 178.83 179.38 1f0j h GLN 417 N 0.66 0.91 -0.96 1.46 4.15 -0.52 -2.23 115.11 118.58 1f0j h GLN 417 Ca 0.08 -0.37 0.02 0.00 0.77 0.00 0.00 58.65 59.14 1f0j h GLN 417 Cb 0.81 -0.04 -0.05 0.00 0.21 0.00 0.00 27.48 28.41 1f0j h GLN 417 CO 0.07 1.03 0.64 0.78 -1.93 0.00 0.00 178.83 179.41 1f0j h GLY 418 N 0.92 1.37 1.01 2.39 0.00 -0.83 0.21 103.07 108.14 1f0j h GLY 418 Ca 0.11 -0.50 -0.06 0.00 0.00 0.00 0.00 47.33 46.88 1f0j h GLY 418 CO 0.06 0.47 0.10 -0.55 0.00 0.00 0.00 176.54 176.63 1f0j h ASP 419 N 1.28 0.89 -0.67 0.19 3.32 -0.94 -1.39 116.42 119.09 1f0j h ASP 419 Ca 0.36 -0.25 -0.00 0.00 0.02 0.00 0.00 57.03 57.15 1f0j h ASP 419 Cb -0.11 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.17 1f0j h ASP 419 CO -0.09 0.92 0.41 0.11 -1.72 0.00 0.00 179.24 178.87 1f0j h LYS 420 N 0.83 0.91 -0.36 3.56 1.57 -0.70 0.18 116.57 122.55 1f0j h LYS 420 Ca 0.17 -0.08 -0.01 0.00 -1.87 0.00 0.00 60.65 58.86 1f0j h LYS 420 Cb 0.40 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.50 1f0j h LYS 420 CO 0.01 0.65 0.19 0.93 -0.57 0.00 0.00 179.45 180.66 1f0j h GLU 421 N 0.91 0.51 -0.55 3.15 5.08 -0.73 0.13 114.58 123.08 1f0j h GLU 421 Ca 0.24 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.53 1f0j h GLU 421 Cb -0.03 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.09 1f0j h GLU 421 CO -0.05 0.43 0.30 -0.09 -1.00 0.00 0.00 179.01 178.60 1f0j h ARG 422 N 0.46 0.77 -0.51 2.33 1.12 -0.86 0.41 114.38 118.11 1f0j h ARG 422 Ca 0.13 -0.09 -0.02 0.00 -1.11 0.00 0.00 59.98 58.88 1f0j h ARG 422 Cb 0.07 -0.15 -0.02 0.00 -0.01 0.00 0.00 29.97 29.85 1f0j h ARG 422 CO -0.02 0.59 0.22 0.93 -3.11 0.00 0.00 179.97 178.58 1f0j h GLU 423 N 0.74 0.72 -0.61 0.20 5.08 -0.27 -2.64 114.58 117.79 1f0j h GLU 423 Ca 0.19 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 1f0j h GLU 423 Cb 0.05 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.16 1f0j h GLU 423 CO -0.03 0.58 0.00 0.54 -1.00 0.00 0.00 179.01 179.10 1f0j n ARG 424 N -4.36 2.89 -2.69 2.33 1.74 0.00 -4.93 116.66 111.65 1f0j n ARG 424 Ca 0.04 -2.22 -0.16 0.00 -0.77 0.00 0.00 57.85 54.73 1f0j n ARG 424 Cb 0.15 -1.66 0.02 0.00 -1.02 0.00 0.00 32.46 29.95 1f0j n ARG 424 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1f0j n GLY 425 N 1.14 -0.22 3.82 -0.13 0.00 -0.64 -5.02 105.19 104.15 1f0j n GLY 425 Ca 0.20 -0.14 -0.27 0.00 0.00 0.00 0.00 46.02 45.81 1f0j n GLY 425 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1f0j s MET 426 N -5.24 3.01 0.36 1.61 -1.94 0.14 -5.02 119.30 112.23 1f0j s MET 426 Ca 0.17 -0.76 -0.27 0.00 -1.71 0.00 0.00 55.69 53.12 1f0j s MET 426 Cb -0.07 -2.74 -0.09 0.00 2.01 0.00 0.00 34.83 33.94 1f0j s MET 426 CO 0.21 0.52 1.26 -1.83 -0.01 0.00 0.00 175.02 175.17 1f0j s GLU 427 N -2.92 4.20 -0.05 2.03 -1.05 -1.26 -4.15 118.70 115.49 1f0j s GLU 427 Ca 0.31 2.09 -0.30 0.00 -0.15 0.00 0.00 54.97 56.92 1f0j s GLU 427 Cb -0.11 -2.91 -0.04 0.00 -0.44 0.00 0.00 34.13 30.64 1f0j s GLU 427 CO 0.24 -0.27 1.28 0.42 0.95 0.00 0.00 175.26 177.88 1f0j s ILE 428 N -1.23 4.07 0.83 1.83 -1.09 -1.26 -4.91 121.20 119.44 1f0j s ILE 428 Ca 0.53 1.40 -0.10 0.00 -2.23 0.00 0.00 60.65 60.24 1f0j s ILE 428 Cb -0.37 -3.90 0.09 0.00 -1.58 0.00 0.00 42.46 36.70 1f0j s ILE 428 CO 0.48 -0.02 1.11 -0.44 -1.23 0.00 0.00 174.94 174.84 1f0j s SER 429 N 1.71 3.89 0.36 3.58 0.01 -1.26 -4.93 113.70 117.06 1f0j s SER 429 Ca 0.59 1.94 -0.28 0.00 1.31 0.00 0.00 55.95 59.50 1f0j s SER 429 Cb -0.27 -2.52 -0.11 0.00 0.21 0.00 0.00 66.02 63.33 1f0j s SER 429 CO 0.23 -2.45 1.51 -2.65 0.41 0.00 0.00 173.24 170.29 1f0j n PRO 430 N -3.79 2.68 -0.21 12.44 -0.02 -1.26 -1.92 135.00 142.91 1f0j n PRO 430 Ca 0.10 0.94 0.00 0.00 -2.02 0.00 0.00 63.50 62.52 1f0j n PRO 430 Cb 0.53 -2.69 0.00 0.00 -0.02 0.00 0.00 33.50 31.32 1f0j n PRO 430 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 1f0j n MET 431 N 0.83 0.00 0.00 -0.52 2.81 -1.26 -4.80 117.12 114.18 1f0j n MET 431 Ca 0.03 0.00 0.13 0.00 -1.81 0.00 0.00 57.70 56.05 1f0j n MET 431 Cb 0.38 -2.55 0.32 0.00 -0.71 0.00 0.00 33.22 30.67 1f0j n MET 431 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1f0j s ASP 433 N -2.24 6.10 0.50 0.00 -1.08 -1.26 -3.84 116.67 114.84 1f0j s ASP 433 Ca 0.29 -0.56 0.34 0.00 -0.52 0.00 0.00 52.55 52.09 1f0j s ASP 433 Cb 0.20 -2.16 1.76 0.00 -1.46 0.00 0.00 42.92 41.26 1f0j s ASP 433 CO 0.43 -0.33 2.02 0.50 0.52 0.00 0.00 175.17 178.31 1f0j h LYS 434 N 8.54 0.00 -0.54 4.34 3.11 -1.92 0.22 116.57 130.32 1f0j h LYS 434 Ca -0.29 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.55 1f0j h LYS 434 Cb 1.14 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 32.37 1f0j h LYS 434 CO 0.68 0.00 0.00 -2.39 -2.81 0.00 0.00 179.45 174.93 1f0j n HIS 435 N -2.71 0.72 0.00 1.91 1.44 -1.26 -4.50 115.22 110.81 1f0j n HIS 435 Ca -0.02 -0.46 0.00 0.00 -2.01 0.00 0.00 57.72 55.23 1f0j n HIS 435 Cb 0.09 -0.01 0.00 0.00 0.12 0.00 0.00 29.99 30.19 1f0j n HIS 435 CO 0.00 0.00 0.00 2.41 -2.81 0.00 0.00 176.34 175.94 1f0j n THR 436 N 1.21 0.00 -1.75 0.61 -1.04 -0.79 -5.09 114.28 107.43 1f0j n THR 436 Ca 0.19 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 61.78 1f0j n THR 436 Cb 0.54 -0.28 -0.02 0.00 -1.82 0.00 0.00 70.33 68.75 1f0j n THR 436 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1f0j s ALA 437 N -1.39 3.77 -0.39 2.41 0.00 0.69 -4.99 121.76 121.86 1f0j s ALA 437 Ca 0.00 1.60 -0.02 0.00 0.00 0.00 0.00 51.96 53.53 1f0j s ALA 437 Cb 0.00 -3.66 0.10 0.00 0.00 0.00 0.00 23.12 19.56 1f0j s ALA 437 CO 0.00 -1.00 0.17 0.45 0.00 0.00 0.00 175.76 175.37 1f0j s SER 438 N 0.56 5.19 0.21 0.00 0.15 -1.26 -4.96 113.70 113.59 1f0j s SER 438 Ca 0.65 -1.92 -0.09 0.00 0.70 0.00 0.00 55.95 55.28 1f0j s SER 438 Cb -0.49 -1.80 0.27 0.00 -1.71 0.00 0.00 66.02 62.29 1f0j s SER 438 CO 0.47 -0.49 1.79 1.62 1.20 0.00 0.00 173.24 177.82 1f0j h VAL 439 N 6.38 0.90 -0.21 4.45 3.04 -1.98 -1.26 116.25 127.57 1f0j h VAL 439 Ca -0.14 -0.21 -0.03 0.00 -1.01 0.00 0.00 66.70 65.32 1f0j h VAL 439 Cb 1.05 0.24 -0.01 0.00 -2.01 0.00 0.00 31.29 30.56 1f0j h VAL 439 CO 0.67 0.11 0.03 1.05 -1.01 0.00 0.00 177.57 178.41 1f0j h GLU 440 N 0.61 0.35 -0.91 4.17 9.09 -1.94 -1.31 114.58 124.64 1f0j h GLU 440 Ca 0.31 -0.10 -0.01 0.00 0.05 0.00 0.00 59.36 59.61 1f0j h GLU 440 Cb 0.27 -0.04 -0.04 0.00 -1.65 0.00 0.00 28.75 27.29 1f0j h GLU 440 CO -0.22 0.51 0.52 0.87 0.05 0.00 0.00 179.01 180.73 1f0j h LYS 441 N 0.14 1.26 -0.26 1.06 1.57 -1.81 -1.76 116.57 116.76 1f0j h LYS 441 Ca 0.06 -0.14 -0.17 0.00 -1.87 0.00 0.00 60.65 58.54 1f0j h LYS 441 Cb 0.33 -0.25 -0.00 0.00 0.08 0.00 0.00 32.23 32.38 1f0j h LYS 441 CO 0.01 0.91 -0.51 0.77 -0.57 0.00 0.00 179.45 180.05 1f0j h SER 442 N 1.27 0.82 -0.29 0.86 0.02 -1.14 -1.88 113.55 113.21 1f0j h SER 442 Ca 0.32 -0.42 -0.09 0.00 -0.84 0.00 0.00 61.79 60.77 1f0j h SER 442 Cb -0.00 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.30 1f0j h SER 442 CO -0.06 1.18 -0.17 1.56 -1.14 0.00 0.00 176.83 178.20 1f0j h GLN 443 N 0.58 0.62 -0.80 3.45 1.08 -1.05 0.14 115.11 119.12 1f0j h GLN 443 Ca 0.02 -0.28 -0.04 0.00 -1.45 0.00 0.00 58.65 56.90 1f0j h GLN 443 Cb 1.08 -0.01 -0.04 0.00 -0.05 0.00 0.00 27.48 28.46 1f0j h GLN 443 CO 0.11 0.87 0.36 0.28 -0.95 0.00 0.00 178.83 179.49 1f0j h VAL 444 N 0.36 1.26 -0.29 -0.54 2.07 -1.34 0.21 116.25 117.97 1f0j h VAL 444 Ca 0.06 -0.75 -0.16 0.00 0.82 0.00 0.00 66.70 66.66 1f0j h VAL 444 Cb 0.70 0.25 -0.00 0.00 -1.52 0.00 0.00 31.29 30.72 1f0j h VAL 444 CO 0.05 0.32 -0.47 1.23 0.02 0.00 0.00 177.57 178.72 1f0j h GLY 445 N 1.17 0.85 0.98 2.17 0.00 -1.22 -0.74 103.07 106.28 1f0j h GLY 445 Ca 0.27 -0.92 -0.05 0.00 0.00 0.00 0.00 47.33 46.63 1f0j h GLY 445 CO -0.03 0.83 0.13 -2.75 0.00 0.00 0.00 176.54 174.72 1f0j h PHE 446 N 0.62 0.85 0.05 5.60 3.57 -0.25 -1.61 116.94 125.76 1f0j h PHE 446 Ca 0.03 -0.10 -0.00 0.00 3.53 0.00 0.00 57.97 61.43 1f0j h PHE 446 Cb 1.04 -0.24 0.00 0.00 2.79 0.00 0.00 35.95 39.54 1f0j h PHE 446 CO 0.06 0.75 -0.02 0.82 -2.23 0.00 0.00 178.31 177.68 1f0j h ILE 447 N 0.70 1.21 -0.76 1.41 2.04 -0.50 0.24 117.51 121.84 1f0j h ILE 447 Ca 0.16 -0.89 -0.02 0.00 1.00 0.00 0.00 64.86 65.12 1f0j h ILE 447 Cb 0.33 1.79 -0.04 0.00 -0.74 0.00 0.00 36.82 38.16 1f0j h ILE 447 CO 0.00 0.22 0.41 0.44 0.00 0.00 0.00 178.15 179.22 1f0j h ASP 448 N -0.47 0.96 0.53 1.72 3.32 -1.13 0.34 116.42 121.69 1f0j h ASP 448 Ca -0.01 -0.10 -0.14 0.00 0.02 0.00 0.00 57.03 56.80 1f0j h ASP 448 Cb 0.42 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.70 1f0j h ASP 448 CO 0.01 0.79 -1.59 -1.22 -1.72 0.00 0.00 179.24 175.51 1f0j n TYR 449 N -4.43 0.68 0.04 4.55 4.01 -0.61 -4.47 117.16 116.92 1f0j n TYR 449 Ca 0.07 0.22 0.00 0.00 -0.16 0.00 0.00 57.90 58.03 1f0j n TYR 449 Cb 0.10 -0.95 0.00 0.00 -0.31 0.00 0.00 39.34 38.17 1f0j n TYR 449 CO 0.00 0.00 0.00 -0.89 -0.46 0.00 0.00 176.86 175.51 1f0j n ILE 450 N -2.73 0.90 0.06 -0.72 2.08 -0.03 -4.77 119.36 114.15 1f0j n ILE 450 Ca -0.10 0.30 -0.13 0.00 0.56 0.00 0.00 62.75 63.38 1f0j n ILE 450 Cb 0.79 -1.42 -0.08 0.00 -0.75 0.00 0.00 39.64 38.19 1f0j n ILE 450 CO 0.00 0.00 0.00 0.58 0.56 0.00 0.00 176.55 177.69 1f0j h VAL 451 N 0.00 1.02 -0.17 1.39 2.07 -1.22 -2.73 116.25 116.60 1f0j h VAL 451 Ca 0.00 -0.26 -0.01 0.00 0.82 0.00 0.00 66.70 67.25 1f0j h VAL 451 Cb 0.00 1.19 -0.01 0.00 -1.52 0.00 0.00 31.29 30.95 1f0j h VAL 451 CO 0.00 0.06 0.06 -0.74 0.02 0.00 0.00 177.57 176.98 1f0j h HIS 452 N -0.19 0.26 -0.95 1.57 -0.00 -0.57 -0.61 115.15 114.66 1f0j h HIS 452 Ca -0.01 -0.02 0.08 0.00 -0.00 0.00 0.00 60.37 60.42 1f0j h HIS 452 Cb 0.17 -0.08 -0.07 0.00 -0.00 0.00 0.00 27.41 27.43 1f0j h HIS 452 CO -0.04 0.34 0.61 -1.35 -0.00 0.00 0.00 177.93 177.49 1f0j h PRO 453 N 0.11 1.02 0.27 5.26 0.11 -1.74 0.33 132.00 137.36 1f0j h PRO 453 Ca 0.06 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 66.09 1f0j h PRO 453 Cb 0.19 -0.23 0.00 0.00 0.11 0.00 0.00 31.00 31.07 1f0j h PRO 453 CO -0.00 0.68 -0.13 1.25 -0.21 0.00 0.00 178.00 179.58 1f0j h LEU 454 N 1.05 -0.31 -1.59 2.35 5.85 -1.27 -2.63 115.31 118.77 1f0j h LEU 454 Ca 0.42 -0.21 -0.04 0.00 0.84 0.00 0.00 57.88 58.88 1f0j h LEU 454 Cb 0.25 0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.35 1f0j h LEU 454 CO -0.17 0.09 -0.21 -0.50 -0.34 0.00 0.00 178.44 177.31 1f0j h TRP 455 N -0.75 0.00 -0.57 1.25 4.06 -0.88 -0.89 115.95 118.18 1f0j h TRP 455 Ca -0.04 0.00 -0.11 0.00 2.06 0.00 0.00 58.89 60.81 1f0j h TRP 455 Cb 0.50 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.64 1f0j h TRP 455 CO 0.03 0.21 -0.07 1.49 -3.56 0.00 0.00 178.44 176.55 1f0j h GLU 456 N 0.00 1.05 -0.22 0.49 4.81 -0.33 0.28 114.58 120.65 1f0j h GLU 456 Ca -0.00 -0.37 -0.19 0.00 -0.13 0.00 0.00 59.36 58.67 1f0j h GLU 456 Cb 0.49 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.80 1f0j h GLU 456 CO 0.03 1.06 -0.60 1.15 -0.73 0.00 0.00 179.01 179.92 1f0j h THR 457 N 0.93 1.29 0.07 0.32 2.02 -1.00 -2.33 112.91 114.21 1f0j h THR 457 Ca 0.15 -1.80 -0.00 0.00 0.77 0.00 0.00 66.41 65.53 1f0j h THR 457 Cb 0.63 1.82 0.00 0.00 -1.74 0.00 0.00 68.15 68.87 1f0j h THR 457 CO 0.04 0.58 -0.03 -0.25 0.37 0.00 0.00 175.52 176.22 1f0j h TRP 458 N 0.54 -0.09 -0.92 3.16 2.91 -1.05 -1.84 115.95 118.66 1f0j h TRP 458 Ca -0.01 -0.00 0.16 0.00 1.13 0.00 0.00 58.89 60.17 1f0j h TRP 458 Cb 1.22 0.03 -0.08 0.00 -0.51 0.00 0.00 29.16 29.82 1f0j h TRP 458 CO 0.08 -0.04 0.59 0.00 -1.03 0.00 0.00 178.44 178.04 1f0j h ALA 459 N 0.82 1.86 -0.08 2.65 0.00 -0.93 -0.01 119.26 123.57 1f0j h ALA 459 Ca -0.01 0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.94 1f0j h ALA 459 Cb 0.08 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1f0j h ALA 459 CO 0.02 -0.13 0.01 0.22 0.00 0.00 0.00 179.25 179.37 1f0j h ASP 460 N 0.67 0.00 -0.28 0.00 1.82 -0.79 0.28 116.42 118.12 1f0j h ASP 460 Ca 0.48 0.01 0.01 0.00 -0.39 0.00 0.00 57.03 57.14 1f0j h ASP 460 Cb 0.82 0.02 -0.02 0.00 0.68 0.00 0.00 39.33 40.83 1f0j h ASP 460 CO -0.23 0.02 0.17 0.25 -1.61 0.00 0.00 179.24 177.83 1f0j h LEU 461 N 0.05 0.28 -3.62 2.28 5.85 -0.25 -3.00 115.31 116.90 1f0j h LEU 461 Ca 0.03 -0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.67 1f0j h LEU 461 Cb 0.03 -0.06 -0.05 0.00 0.37 0.00 0.00 40.66 40.94 1f0j h LEU 461 CO -0.05 0.21 0.11 1.33 -0.34 0.00 0.00 178.44 179.70 1f0j n VAL 462 N -4.92 2.82 -1.55 1.05 0.24 -0.72 -5.00 118.33 110.26 1f0j n VAL 462 Ca -0.01 -1.55 -0.55 0.00 -2.04 0.00 0.00 64.34 60.19 1f0j n VAL 462 Cb 0.04 -0.31 -0.07 0.00 -1.47 0.00 0.00 33.84 32.03 1f0j n VAL 462 CO 0.00 0.00 0.00 1.67 -2.14 0.00 0.00 176.83 176.36 1f0j n GLN 463 N 0.24 0.63 -0.80 7.34 7.27 0.98 -0.08 117.38 132.96 1f0j n GLN 463 Ca 0.33 0.23 0.04 0.00 0.07 0.00 0.00 57.00 57.67 1f0j n GLN 463 Cb 1.26 -1.79 0.34 0.00 2.41 0.00 0.00 30.24 32.46 1f0j n GLN 463 CO 0.00 0.00 0.00 -0.35 0.07 0.00 0.00 177.06 176.78 1f0j n PRO 464 N 2.00 4.01 -0.32 3.69 -0.04 -1.26 -4.99 135.00 138.09 1f0j n PRO 464 Ca 0.19 -3.07 0.17 0.00 -0.04 0.00 0.00 63.50 60.75 1f0j n PRO 464 Cb 0.15 -2.13 0.34 0.00 -0.04 0.00 0.00 33.50 31.82 1f0j n PRO 464 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1f0j h ASP 465 N 3.00 -0.09 -0.72 3.54 5.19 -0.78 -2.10 116.42 124.46 1f0j h ASP 465 Ca 0.07 0.23 -0.20 0.00 -0.62 0.00 0.00 57.03 56.51 1f0j h ASP 465 Cb 1.91 0.33 -0.12 0.00 0.18 0.00 0.00 39.33 41.63 1f0j h ASP 465 CO 0.47 -0.26 0.25 0.00 -3.12 0.00 0.00 179.24 176.58 1f0j n ALA 466 N -2.76 4.53 -0.19 3.45 0.00 -1.26 -4.58 120.51 119.70 1f0j n ALA 466 Ca 0.25 -2.33 -0.07 0.00 0.00 0.00 0.00 53.44 51.28 1f0j n ALA 466 Cb 0.81 -1.23 0.07 0.00 0.00 0.00 0.00 19.45 19.11 1f0j n ALA 466 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 1f0j h GLN 467 N 2.75 1.00 0.00 0.00 -0.00 -1.74 -2.27 115.11 114.85 1f0j h GLN 467 Ca 0.25 -0.29 -0.07 0.00 -0.00 0.00 0.00 58.65 58.54 1f0j h GLN 467 Cb 2.31 -0.11 -0.01 0.00 0.00 0.00 0.00 27.48 29.67 1f0j h GLN 467 CO 0.72 0.96 -0.33 -0.44 0.00 0.00 0.00 178.83 179.74 1f0j h ASP 468 N 0.92 0.00 -0.28 -0.69 3.32 -1.83 -1.93 116.42 115.94 1f0j h ASP 468 Ca 0.17 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 57.16 1f0j h ASP 468 Cb 0.50 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.04 1f0j h ASP 468 CO 0.02 0.33 -0.07 0.40 -1.72 0.00 0.00 179.24 178.21 1f0j h ILE 469 N 0.00 1.28 -0.58 0.35 2.04 -1.77 -2.12 117.51 116.70 1f0j h ILE 469 Ca -0.00 -1.09 -0.05 0.00 1.00 0.00 0.00 64.86 64.72 1f0j h ILE 469 Cb 0.66 1.42 -0.03 0.00 -0.74 0.00 0.00 36.82 38.13 1f0j h ILE 469 CO 0.04 0.34 0.18 -0.07 0.00 0.00 0.00 178.15 178.65 1f0j h LEU 470 N 0.29 0.82 -0.30 1.44 3.38 -1.05 -0.50 115.31 119.38 1f0j h LEU 470 Ca 0.07 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 1f0j h LEU 470 Cb 0.54 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 1f0j h LEU 470 CO 0.03 0.77 0.11 0.44 0.09 0.00 0.00 178.44 179.88 1f0j h ASP 471 N 0.86 0.43 -0.57 -0.43 3.32 -1.23 -1.03 116.42 117.77 1f0j h ASP 471 Ca 0.19 -0.18 -0.02 0.00 0.02 0.00 0.00 57.03 57.04 1f0j h ASP 471 Cb 0.25 -0.11 -0.03 0.00 0.22 0.00 0.00 39.33 39.66 1f0j h ASP 471 CO -0.01 0.50 0.27 0.74 -1.72 0.00 0.00 179.24 179.02 1f0j h THR 472 N 0.34 1.21 -0.96 0.35 2.02 -1.10 -1.46 112.91 113.31 1f0j h THR 472 Ca 0.10 -0.58 0.04 0.00 0.77 0.00 0.00 66.41 66.74 1f0j h THR 472 Cb 0.21 0.54 -0.06 0.00 -1.74 0.00 0.00 68.15 67.10 1f0j h THR 472 CO -0.01 0.23 0.63 0.25 0.37 0.00 0.00 175.52 177.00 1f0j h LEU 473 N 0.77 1.03 -0.19 2.58 5.85 -0.86 -0.09 115.31 124.40 1f0j h LEU 473 Ca 0.20 -0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.87 1f0j h LEU 473 Cb 0.12 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 40.91 1f0j h LEU 473 CO -0.02 0.69 -0.02 -0.08 -0.34 0.00 0.00 178.44 178.67 1f0j h GLU 474 N 1.18 0.36 -0.46 1.25 4.57 -0.67 -0.75 114.58 120.07 1f0j h GLU 474 Ca 0.39 -0.12 -0.01 0.00 -1.18 0.00 0.00 59.36 58.43 1f0j h GLU 474 Cb 0.05 -0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 28.59 1f0j h GLU 474 CO -0.13 0.59 0.23 -0.44 -1.18 0.00 0.00 179.01 178.08 1f0j h ASP 475 N 0.10 0.59 -0.66 1.04 3.32 -0.80 -1.63 116.42 118.37 1f0j h ASP 475 Ca 0.05 -0.11 -0.06 0.00 0.02 0.00 0.00 57.03 56.93 1f0j h ASP 475 Cb 0.44 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 39.81 1f0j h ASP 475 CO 0.01 0.53 0.18 0.78 -1.72 0.00 0.00 179.24 179.03 1f0j h ASN 476 N 0.59 1.00 -0.24 6.45 2.35 -0.99 -1.03 115.58 123.72 1f0j h ASN 476 Ca 0.16 -0.19 0.02 0.00 -0.55 0.00 0.00 56.30 55.73 1f0j h ASN 476 Cb 0.09 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.18 1f0j h ASN 476 CO -0.02 0.95 0.11 -0.09 -1.65 0.00 0.00 177.43 176.73 1f0j h ARG 477 N 1.02 0.23 0.00 0.81 1.12 -0.84 -2.02 114.38 114.70 1f0j h ARG 477 Ca 0.22 -0.01 -0.03 0.00 -1.11 0.00 0.00 59.98 59.04 1f0j h ARG 477 Cb 0.33 -0.05 -0.00 0.00 -0.01 0.00 0.00 29.97 30.23 1f0j h ARG 477 CO -0.00 0.15 -0.16 -0.91 -3.11 0.00 0.00 179.97 175.94 1f0j h ASN 478 N 0.24 0.00 -0.56 -3.80 2.35 -0.92 -1.48 115.58 111.41 1f0j h ASN 478 Ca 0.10 0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 55.77 1f0j h ASN 478 Cb 0.04 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.38 1f0j h ASN 478 CO -0.08 0.16 0.04 -0.25 -1.65 0.00 0.00 177.43 175.65 1f0j h TRP 479 N 0.00 1.04 0.02 1.19 7.01 -0.45 -2.44 115.95 122.32 1f0j h TRP 479 Ca -0.00 -0.16 -0.20 0.00 2.11 0.00 0.00 58.89 60.63 1f0j h TRP 479 Cb 0.54 -0.28 -0.02 0.00 -2.10 0.00 0.00 29.16 27.31 1f0j h TRP 479 CO 0.00 0.93 -0.95 1.88 -2.79 0.00 0.00 178.44 177.51 1f0j h TYR 480 N 0.85 0.16 -0.38 2.65 0.05 -1.25 -3.19 116.97 115.85 1f0j h TYR 480 Ca 0.16 -0.10 0.04 0.00 0.05 0.00 0.00 58.73 58.88 1f0j h TYR 480 Cb 0.49 -0.01 -0.02 0.00 1.01 0.00 0.00 36.73 38.19 1f0j h TYR 480 CO 0.04 0.98 0.26 0.37 -1.05 0.00 0.00 178.16 178.75 1f0j h GLN 481 N 0.04 0.34 0.00 4.88 5.75 -1.06 -0.12 115.11 124.94 1f0j h GLN 481 Ca -0.04 -0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.44 1f0j h GLN 481 Cb 1.63 -0.08 0.00 0.00 1.07 0.00 0.00 27.48 30.10 1f0j h GLN 481 CO 0.13 0.22 0.00 0.77 -2.65 0.00 0.00 178.83 177.31 1f0j h SER 482 N 0.35 0.00 0.68 -0.69 0.02 -1.43 -1.66 113.55 110.82 1f0j h SER 482 Ca 0.16 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.11 1f0j h SER 482 Cb 0.21 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.75 1f0j h SER 482 CO -0.04 0.00 -0.67 0.23 -1.14 0.00 0.00 176.83 175.21 1f0j n MET 483 N -2.93 0.21 -2.71 3.45 2.81 -0.06 -4.79 117.12 113.11 1f0j n MET 483 Ca -0.01 0.04 -0.43 0.00 -1.81 0.00 0.00 57.70 55.50 1f0j n MET 483 Cb 0.17 -1.62 -0.03 0.00 -0.71 0.00 0.00 33.22 31.03 1f0j n MET 483 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 1f0j s ILE 484 N -3.13 4.54 1.22 2.02 1.01 -0.63 -4.99 121.20 121.25 1f0j s ILE 484 Ca 0.07 1.55 -0.18 0.00 0.00 0.00 0.00 60.65 62.09 1f0j s ILE 484 Cb 0.15 -4.38 0.25 0.00 0.01 0.00 0.00 42.46 38.49 1f0j s ILE 484 CO 0.73 -0.49 0.57 -0.81 0.00 0.00 0.00 174.94 174.94 1f0j n PRO 485 N 6.82 -3.09 0.00 2.79 -0.04 -1.26 -4.51 135.00 135.71 1f0j n PRO 485 Ca 0.10 -0.91 0.00 0.00 -0.04 0.00 0.00 63.50 62.65 1f0j n PRO 485 Cb 0.47 -1.79 0.00 0.00 -0.04 0.00 0.00 33.50 32.14 1f0j n PRO 485 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1f0j n GLN 486 N -3.78 0.00 -0.82 0.54 -0.00 -1.26 -4.82 117.38 107.24 1f0j n GLN 486 Ca 0.07 0.00 0.11 0.00 -0.00 0.00 0.00 57.00 57.17 1f0j n GLN 486 Cb 0.52 0.00 -0.04 0.00 -0.00 0.00 0.00 30.24 30.73 1f0j n GLN 486 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1f0j n ALA 487 N 0.00 -2.14 1.56 2.61 0.00 -1.26 -5.21 120.51 116.07 1f0j n ALA 487 Ca 0.00 0.36 0.14 0.00 0.00 0.00 0.00 53.44 53.94 1f0j n ALA 487 Cb 0.00 -0.80 0.57 0.00 0.00 0.00 0.00 19.45 19.23 1f0j n ALA 487 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20