#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ly2 n PHE 156 N 0.00 0.20 -0.76 -0.14 3.72 -1.26 -4.84 117.46 114.38 3ly2 n PHE 156 Ca 0.00 0.08 0.00 0.00 -0.05 0.00 0.00 57.45 57.48 3ly2 n PHE 156 Cb 0.00 -0.63 0.00 0.00 -0.94 0.00 0.00 39.48 37.91 3ly2 n PHE 156 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3ly2 n GLY 157 N 0.01 0.55 3.77 1.37 0.00 -1.26 -4.83 105.19 104.80 3ly2 n GLY 157 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 3ly2 n GLY 157 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ly2 s VAL 158 N -2.60 2.38 0.70 1.61 1.01 -1.26 -4.98 120.40 117.25 3ly2 s VAL 158 Ca 0.00 0.36 -0.11 0.00 0.00 0.00 0.00 61.98 62.23 3ly2 s VAL 158 Cb 0.00 -3.23 0.01 0.00 0.00 0.00 0.00 36.38 33.16 3ly2 s VAL 158 CO 0.00 0.08 1.07 0.54 0.00 0.00 0.00 175.10 176.78 3ly2 s ASN 159 N -0.07 5.47 0.20 3.32 2.20 -1.26 -4.88 114.94 119.92 3ly2 s ASN 159 Ca 0.54 1.39 -0.11 0.00 -0.94 0.00 0.00 52.86 53.74 3ly2 s ASN 159 Cb -0.44 -2.27 0.19 0.00 -2.00 0.00 0.00 41.25 36.73 3ly2 s ASN 159 CO 0.54 -1.35 1.81 0.74 -2.94 0.00 0.00 177.10 175.89 3ly2 h THR 160 N -0.66 0.99 0.42 0.54 2.02 -1.99 -0.10 112.91 114.13 3ly2 h THR 160 Ca -0.45 -0.22 -0.02 0.00 0.77 0.00 0.00 66.41 66.49 3ly2 h THR 160 Cb 1.23 0.29 0.00 0.00 -1.74 0.00 0.00 68.15 67.93 3ly2 h THR 160 CO 0.60 0.12 -0.20 -0.33 0.37 0.00 0.00 175.52 176.08 3ly2 h GLU 161 N 0.64 -0.55 -0.02 6.66 3.07 -2.02 -2.63 114.58 119.73 3ly2 h GLU 161 Ca 0.26 0.04 0.01 0.00 -0.50 0.00 0.00 59.36 59.17 3ly2 h GLU 161 Cb 0.13 0.12 -0.00 0.00 -0.84 0.00 0.00 28.75 28.16 3ly2 h GLU 161 CO -0.16 -0.36 0.02 -0.91 -1.40 0.00 0.00 179.01 176.20 3ly2 h ASN 162 N -0.58 0.00 -0.93 1.42 -0.26 -1.86 -2.18 115.58 111.19 3ly2 h ASN 162 Ca -0.06 0.00 0.08 0.00 -0.56 0.00 0.00 56.30 55.76 3ly2 h ASN 162 Cb 0.44 0.00 -0.07 0.00 -1.06 0.00 0.00 38.32 37.64 3ly2 h ASN 162 CO 0.10 0.00 0.60 -0.08 -1.06 0.00 0.00 177.43 176.99 3ly2 h GLU 163 N 0.00 0.98 -0.04 0.81 4.81 -0.63 0.92 114.58 121.43 3ly2 h GLU 163 Ca 0.01 -0.06 -0.03 0.00 -0.13 0.00 0.00 59.36 59.15 3ly2 h GLU 163 Cb 0.04 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 29.20 3ly2 h GLU 163 CO -0.00 0.65 -0.08 -0.44 -0.73 0.00 0.00 179.01 178.41 3ly2 h ASP 164 N 1.01 0.14 -0.39 1.04 3.45 -1.40 -1.14 116.42 119.12 3ly2 h ASP 164 Ca 0.42 -0.56 -0.00 0.00 0.43 0.00 0.00 57.03 57.31 3ly2 h ASP 164 Cb 0.29 -0.04 -0.02 0.00 -0.56 0.00 0.00 39.33 39.00 3ly2 h ASP 164 CO -0.17 0.68 0.24 0.45 -1.57 0.00 0.00 179.24 178.86 3ly2 h HIS 165 N -0.39 0.51 -0.61 4.55 3.86 -1.32 -0.73 115.15 121.01 3ly2 h HIS 165 Ca 0.00 0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.15 3ly2 h HIS 165 Cb 0.65 -0.17 -0.03 0.00 1.06 0.00 0.00 27.41 28.93 3ly2 h HIS 165 CO 0.12 0.35 0.13 1.25 0.86 0.00 0.00 177.93 180.64 3ly2 h LEU 166 N 0.52 0.91 -0.88 2.43 5.85 0.79 -0.98 115.31 123.95 3ly2 h LEU 166 Ca 0.14 -0.18 -0.08 0.00 0.84 0.00 0.00 57.88 58.59 3ly2 h LEU 166 Cb -0.02 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 40.76 3ly2 h LEU 166 CO -0.03 0.89 -0.07 0.00 -0.34 0.00 0.00 178.44 178.89 3ly2 h ALA 167 N 1.22 1.06 -0.06 1.25 0.00 -0.84 -1.67 119.26 120.23 3ly2 h ALA 167 Ca 0.19 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 3ly2 h ALA 167 Cb 0.35 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.96 3ly2 h ALA 167 CO 0.00 0.58 -0.00 -0.22 0.00 0.00 0.00 179.25 179.61 3ly2 h LYS 168 N 0.69 0.11 -0.93 0.00 3.64 -0.61 -2.99 116.57 116.49 3ly2 h LYS 168 Ca 0.13 -0.04 0.10 0.00 -1.27 0.00 0.00 60.65 59.57 3ly2 h LYS 168 Cb 0.53 -0.01 -0.07 0.00 -0.41 0.00 0.00 32.23 32.27 3ly2 h LYS 168 CO 0.03 0.40 0.59 1.49 -2.27 0.00 0.00 179.45 179.70 3ly2 h GLU 169 N -0.19 0.90 0.00 1.90 4.57 -1.03 -0.55 114.58 120.18 3ly2 h GLU 169 Ca 0.02 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 58.14 3ly2 h GLU 169 Cb 0.35 -0.20 0.00 0.00 -0.16 0.00 0.00 28.75 28.74 3ly2 h GLU 169 CO 0.00 0.60 0.00 1.28 -1.18 0.00 0.00 179.01 179.71 3ly2 n LEU 170 N -4.54 0.00 0.20 1.64 4.77 -0.64 -2.27 117.00 116.15 3ly2 n LEU 170 Ca 0.16 0.06 0.06 0.00 -0.03 0.00 0.00 56.01 56.26 3ly2 n LEU 170 Cb 0.31 -0.06 0.40 0.00 -2.33 0.00 0.00 43.42 41.75 3ly2 n LEU 170 CO 0.30 -0.03 0.73 -0.33 -1.33 0.00 0.00 177.39 176.74 3ly2 h GLU 171 N 0.00 0.00 -0.34 3.23 5.08 -1.09 -2.11 114.58 119.35 3ly2 h GLU 171 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3ly2 h GLU 171 Cb 0.03 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.28 3ly2 h GLU 171 CO 0.00 0.34 0.00 -0.25 -1.00 0.00 0.00 179.01 178.10 3ly2 n ASP 172 N -3.65 1.63 -0.33 1.42 8.00 -0.96 -4.46 116.55 118.20 3ly2 n ASP 172 Ca -0.01 -2.03 0.19 0.00 0.71 0.00 0.00 54.79 53.64 3ly2 n ASP 172 Cb 0.45 -0.23 0.39 0.00 -0.02 0.00 0.00 41.12 41.72 3ly2 n ASP 172 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 3ly2 h LEU 173 N 1.63 0.45 -2.17 0.64 5.85 -1.57 0.33 115.31 120.47 3ly2 h LEU 173 Ca 0.00 0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.89 3ly2 h LEU 173 Cb 0.44 0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.60 3ly2 h LEU 173 CO 0.02 -0.05 0.00 0.59 -0.34 0.00 0.00 178.44 178.66 3ly2 n ASN 174 N -5.03 3.19 -4.64 1.25 3.02 -1.26 -4.84 115.26 106.95 3ly2 n ASN 174 Ca 0.27 -2.06 -0.33 0.00 -0.03 0.00 0.00 54.58 52.43 3ly2 n ASN 174 Cb 0.82 -0.40 -0.10 0.00 -0.61 0.00 0.00 39.78 39.48 3ly2 n ASN 174 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 3ly2 s LYS 175 N -1.34 2.75 0.55 3.52 1.02 0.12 -4.87 119.74 121.49 3ly2 s LYS 175 Ca 0.38 -0.59 0.37 0.00 0.02 0.00 0.00 55.97 56.15 3ly2 s LYS 175 Cb 0.21 -2.63 1.80 0.00 -0.52 0.00 0.00 37.83 36.69 3ly2 s LYS 175 CO 0.25 0.64 2.10 2.35 -0.92 0.00 0.00 175.35 179.77 3ly2 h TRP 176 N 4.70 0.00 -0.32 3.18 2.91 -1.91 -2.50 115.95 122.00 3ly2 h TRP 176 Ca -0.49 0.00 0.00 0.00 1.13 0.00 0.00 58.89 59.53 3ly2 h TRP 176 Cb 1.18 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 29.83 3ly2 h TRP 176 CO 0.60 0.00 0.00 0.41 -1.03 0.00 0.00 178.44 178.42 3ly2 n GLY 177 N -0.62 0.62 3.75 2.65 0.00 -1.26 -4.89 105.19 105.44 3ly2 n GLY 177 Ca -0.01 -0.36 -0.42 0.00 0.00 0.00 0.00 46.02 45.24 3ly2 n GLY 177 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3ly2 s LEU 178 N -1.01 4.36 -0.65 0.99 0.20 -0.95 -4.94 118.68 116.68 3ly2 s LEU 178 Ca 0.22 2.85 -0.17 0.00 0.69 0.00 0.00 54.13 57.72 3ly2 s LEU 178 Cb 0.12 -3.63 0.14 0.00 -0.43 0.00 0.00 46.19 42.39 3ly2 s LEU 178 CO 0.14 -0.85 0.68 0.21 -0.29 0.00 0.00 176.35 176.24 3ly2 s ASN 179 N 0.53 6.36 0.48 3.68 3.84 -1.26 -4.89 114.94 123.68 3ly2 s ASN 179 Ca 0.63 -1.91 0.24 0.00 0.21 0.00 0.00 52.86 52.03 3ly2 s ASN 179 Cb -0.46 -2.25 1.24 0.00 -0.55 0.00 0.00 41.25 39.22 3ly2 s ASN 179 CO 0.45 -0.89 1.99 -0.29 -2.79 0.00 0.00 177.10 175.57 3ly2 h ILE 180 N 5.63 0.69 -0.53 -5.21 6.09 -1.98 -2.86 117.51 119.35 3ly2 h ILE 180 Ca -0.17 -0.74 -0.01 0.00 -1.37 0.00 0.00 64.86 62.57 3ly2 h ILE 180 Cb 1.08 1.46 -0.02 0.00 0.47 0.00 0.00 36.82 39.80 3ly2 h ILE 180 CO 1.00 0.17 0.29 -0.26 -3.07 0.00 0.00 178.15 176.27 3ly2 h PHE 181 N 0.00 0.73 -0.42 2.19 0.04 -1.96 -1.83 116.94 115.69 3ly2 h PHE 181 Ca -0.00 -0.02 -0.12 0.00 2.80 0.00 0.00 57.97 60.63 3ly2 h PHE 181 Cb 0.45 -0.23 -0.01 0.00 2.20 0.00 0.00 35.95 38.35 3ly2 h PHE 181 CO 0.00 0.54 -0.20 -0.91 -0.60 0.00 0.00 178.31 177.14 3ly2 h ASN 182 N 0.70 0.83 -0.89 2.17 2.35 -1.94 -2.50 115.58 116.31 3ly2 h ASN 182 Ca 0.19 -0.30 0.07 0.00 -0.55 0.00 0.00 56.30 55.71 3ly2 h ASN 182 Cb 0.06 -0.23 -0.06 0.00 0.05 0.00 0.00 38.32 38.14 3ly2 h ASN 182 CO -0.03 1.01 0.58 0.58 -1.65 0.00 0.00 177.43 177.92 3ly2 h VAL 183 N 0.72 1.05 -0.29 2.81 2.07 -1.35 -1.38 116.25 119.88 3ly2 h VAL 183 Ca 0.10 -0.34 -0.04 0.00 0.82 0.00 0.00 66.70 67.25 3ly2 h VAL 183 Cb 0.73 -0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.46 3ly2 h VAL 183 CO 0.06 0.18 0.03 0.00 0.02 0.00 0.00 177.57 177.86 3ly2 h ALA 184 N 1.53 0.38 0.00 1.67 0.00 -0.97 -2.79 119.26 119.08 3ly2 h ALA 184 Ca 0.39 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 3ly2 h ALA 184 Cb 0.24 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 3ly2 h ALA 184 CO -0.15 0.08 -0.04 0.78 0.00 0.00 0.00 179.25 179.92 3ly2 h GLY 185 N 0.29 0.00 -2.41 0.00 0.00 -0.87 -0.49 103.07 99.60 3ly2 h GLY 185 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.42 3ly2 h GLY 185 CO 0.01 0.00 0.00 -1.72 0.00 0.00 0.00 176.54 174.83 3ly2 n TYR 186 N -3.55 0.87 -2.23 5.60 4.01 -0.68 -4.39 117.16 116.79 3ly2 n TYR 186 Ca -0.02 -0.49 0.04 0.00 -0.16 0.00 0.00 57.90 57.27 3ly2 n TYR 186 Cb 0.15 -0.01 0.08 0.00 -0.31 0.00 0.00 39.34 39.25 3ly2 n TYR 186 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 3ly2 n SER 187 N 1.42 1.25 -3.85 7.72 3.41 -0.93 -4.76 113.62 117.89 3ly2 n SER 187 Ca 0.22 -2.59 -0.27 0.00 -0.26 0.00 0.00 58.87 55.96 3ly2 n SER 187 Cb 0.58 -0.37 0.03 0.00 -0.26 0.00 0.00 64.21 64.19 3ly2 n SER 187 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 3ly2 n HIS 188 N -0.02 -2.20 -3.64 7.33 8.25 -1.23 -2.32 115.22 121.39 3ly2 n HIS 188 Ca 0.10 0.89 -0.21 0.00 -0.26 0.00 0.00 57.72 58.24 3ly2 n HIS 188 Cb 1.00 -4.13 0.04 0.00 1.12 0.00 0.00 29.99 28.02 3ly2 n HIS 188 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 3ly2 n ASN 189 N -2.91 -1.89 -2.76 0.41 5.15 -0.24 -4.94 115.26 108.08 3ly2 n ASN 189 Ca -0.06 -0.81 -0.19 0.00 -0.60 0.00 0.00 54.58 52.92 3ly2 n ASN 189 Cb 0.57 -4.20 -0.00 0.00 -0.53 0.00 0.00 39.78 35.63 3ly2 n ASN 189 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 3ly2 n ARG 190 N -4.18 2.09 -0.16 1.20 5.12 -0.98 -4.93 116.66 114.81 3ly2 n ARG 190 Ca -0.27 -3.89 0.00 0.00 -1.93 0.00 0.00 57.85 51.76 3ly2 n ARG 190 Cb 0.67 -1.78 0.26 0.00 -1.16 0.00 0.00 32.46 30.45 3ly2 n ARG 190 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 3ly2 h PRO 191 N 2.88 0.88 0.04 5.56 0.13 -1.85 -1.50 132.00 138.15 3ly2 h PRO 191 Ca 0.09 -0.08 -0.00 0.00 -0.87 0.00 0.00 66.00 65.14 3ly2 h PRO 191 Cb 0.95 -0.19 0.00 0.00 0.13 0.00 0.00 31.00 31.90 3ly2 h PRO 191 CO 0.65 0.63 -0.02 1.25 -0.23 0.00 0.00 178.00 180.28 3ly2 h LEU 192 N 0.90 -0.05 -0.39 1.56 5.85 -1.92 0.36 115.31 121.61 3ly2 h LEU 192 Ca 0.23 -0.24 -0.01 0.00 0.84 0.00 0.00 57.88 58.69 3ly2 h LEU 192 Cb -0.02 0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.01 3ly2 h LEU 192 CO -0.04 0.22 0.19 0.74 -0.34 0.00 0.00 178.44 179.21 3ly2 h THR 193 N -0.32 1.17 0.75 1.05 2.02 -1.81 -0.69 112.91 115.08 3ly2 h THR 193 Ca -0.01 -0.49 -0.04 0.00 0.77 0.00 0.00 66.41 66.65 3ly2 h THR 193 Cb 0.29 0.77 0.01 0.00 -1.74 0.00 0.00 68.15 67.47 3ly2 h THR 193 CO 0.01 0.18 -0.36 0.00 0.37 0.00 0.00 175.52 175.72 3ly2 h ILE 195 N -1.05 1.13 -0.26 0.00 6.09 -0.26 -2.34 117.51 120.83 3ly2 h ILE 195 Ca -0.10 -0.53 -0.09 0.00 -1.37 0.00 0.00 64.86 62.77 3ly2 h ILE 195 Cb 0.78 1.06 -0.01 0.00 0.47 0.00 0.00 36.82 39.13 3ly2 h ILE 195 CO 0.17 0.17 -0.20 0.24 -3.07 0.00 0.00 178.15 175.46 3ly2 h MET 196 N 0.22 0.59 -0.39 2.19 2.86 -1.04 -1.78 114.93 117.59 3ly2 h MET 196 Ca 0.05 -0.29 0.01 0.00 -2.06 0.00 0.00 59.70 57.41 3ly2 h MET 196 Cb 0.23 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.86 3ly2 h MET 196 CO 0.01 0.88 0.24 -0.92 1.06 0.00 0.00 176.91 178.18 3ly2 h TYR 197 N 0.31 0.45 -0.49 -0.22 3.20 -1.04 0.98 116.97 120.16 3ly2 h TYR 197 Ca 0.05 0.01 0.02 0.00 3.14 0.00 0.00 58.73 61.95 3ly2 h TYR 197 Cb 0.74 -0.15 -0.03 0.00 1.54 0.00 0.00 36.73 38.83 3ly2 h TYR 197 CO 0.07 0.27 0.29 0.00 -1.64 0.00 0.00 178.16 177.16 3ly2 h ALA 198 N 1.16 0.62 -0.57 1.82 0.00 -1.37 -1.61 119.26 119.32 3ly2 h ALA 198 Ca 0.15 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 3ly2 h ALA 198 Cb -0.02 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 3ly2 h ALA 198 CO -0.06 -0.00 0.14 0.82 0.00 0.00 0.00 179.25 180.15 3ly2 h ILE 199 N 0.59 1.25 -0.14 0.00 2.04 -0.91 -1.53 117.51 118.82 3ly2 h ILE 199 Ca 0.19 -0.88 -0.07 0.00 1.00 0.00 0.00 64.86 65.11 3ly2 h ILE 199 Cb 0.01 0.74 -0.01 0.00 -0.74 0.00 0.00 36.82 36.81 3ly2 h ILE 199 CO -0.08 0.33 -0.22 -0.26 0.00 0.00 0.00 178.15 177.92 3ly2 h PHE 200 N 0.81 0.25 -0.02 1.37 -1.00 -0.44 -1.76 116.94 116.15 3ly2 h PHE 200 Ca 0.18 -0.04 -0.09 0.00 2.81 0.00 0.00 57.97 60.83 3ly2 h PHE 200 Cb 0.34 -0.07 0.01 0.00 3.61 0.00 0.00 35.95 39.84 3ly2 h PHE 200 CO 0.02 0.44 -0.33 1.96 -1.61 0.00 0.00 178.31 178.79 3ly2 h GLN 201 N 0.21 0.26 -0.85 1.51 4.20 -1.15 0.06 115.11 119.36 3ly2 h GLN 201 Ca 0.04 -0.25 0.18 0.00 0.06 0.00 0.00 58.65 58.67 3ly2 h GLN 201 Cb 0.51 0.07 -0.06 0.00 0.30 0.00 0.00 27.48 28.29 3ly2 h GLN 201 CO 0.03 0.94 0.56 1.49 -0.67 0.00 0.00 178.83 181.19 3ly2 h GLU 202 N -0.33 0.44 -0.35 1.46 4.57 -1.10 0.76 114.58 120.03 3ly2 h GLU 202 Ca -0.04 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.12 3ly2 h GLU 202 Cb 1.04 -0.10 0.00 0.00 -0.16 0.00 0.00 28.75 29.53 3ly2 h GLU 202 CO 0.07 0.29 0.00 0.54 -1.18 0.00 0.00 179.01 178.73 3ly2 n ARG 203 N -4.51 2.51 -2.56 1.92 1.74 -0.68 -4.95 116.66 110.13 3ly2 n ARG 203 Ca 0.17 -2.27 -0.17 0.00 -0.77 0.00 0.00 57.85 54.81 3ly2 n ARG 203 Cb 0.61 -1.51 -0.00 0.00 -1.02 0.00 0.00 32.46 30.53 3ly2 n ARG 203 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 3ly2 n ASP 204 N 1.50 -4.78 -0.03 0.55 4.64 0.26 -4.87 116.55 113.83 3ly2 n ASP 204 Ca 0.19 0.03 -0.08 0.00 -1.38 0.00 0.00 54.79 53.55 3ly2 n ASP 204 Cb 0.61 -4.00 0.09 0.00 -1.04 0.00 0.00 41.12 36.79 3ly2 n ASP 204 CO 0.00 0.00 0.00 -0.07 -0.82 0.00 0.00 177.20 176.31 3ly2 h LEU 205 N -0.22 0.65 -0.60 -2.67 3.38 -1.27 -2.33 115.31 112.26 3ly2 h LEU 205 Ca -0.40 -0.28 0.06 0.00 0.09 0.00 0.00 57.88 57.35 3ly2 h LEU 205 Cb 1.29 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 41.80 3ly2 h LEU 205 CO 0.46 0.96 0.31 -0.07 0.09 0.00 0.00 178.44 180.20 3ly2 h LEU 206 N 0.52 0.44 -0.08 1.67 3.38 -1.85 -1.45 115.31 117.93 3ly2 h LEU 206 Ca 0.05 0.04 -0.03 0.00 0.09 0.00 0.00 57.88 58.03 3ly2 h LEU 206 Cb 0.88 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.59 3ly2 h LEU 206 CO 0.08 0.29 -0.05 0.11 0.09 0.00 0.00 178.44 178.95 3ly2 h LYS 207 N 0.58 0.18 -0.92 1.13 1.79 -1.81 0.42 116.57 117.93 3ly2 h LYS 207 Ca 0.27 -0.08 0.09 0.00 -2.18 0.00 0.00 60.65 58.75 3ly2 h LYS 207 Cb 0.19 -0.00 -0.07 0.00 -1.58 0.00 0.00 32.23 30.78 3ly2 h LYS 207 CO -0.19 0.57 0.59 1.15 -1.08 0.00 0.00 179.45 180.50 3ly2 h THR 208 N -0.22 1.00 -0.30 -0.16 2.02 -1.19 -2.82 112.91 111.25 3ly2 h THR 208 Ca 0.02 -0.33 0.00 0.00 0.77 0.00 0.00 66.41 66.87 3ly2 h THR 208 Cb 0.53 -0.05 0.00 0.00 -1.74 0.00 0.00 68.15 66.90 3ly2 h THR 208 CO 0.01 0.17 0.00 0.49 0.37 0.00 0.00 175.52 176.57 3ly2 n PHE 209 N -4.53 0.80 -3.79 3.16 3.72 -0.57 -5.00 117.46 111.26 3ly2 n PHE 209 Ca 0.15 -0.74 -0.29 0.00 -0.05 0.00 0.00 57.45 56.51 3ly2 n PHE 209 Cb 0.28 -0.22 0.02 0.00 -0.94 0.00 0.00 39.48 38.62 3ly2 n PHE 209 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 3ly2 n ARG 210 N -0.13 -2.11 -3.81 -1.08 1.74 -0.58 -4.54 116.66 106.16 3ly2 n ARG 210 Ca 0.18 0.44 -0.37 0.00 -0.77 0.00 0.00 57.85 57.33 3ly2 n ARG 210 Cb 0.74 -4.26 -0.13 0.00 -1.02 0.00 0.00 32.46 27.79 3ly2 n ARG 210 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3ly2 s ILE 211 N -3.64 3.67 0.67 0.55 1.01 0.03 -4.70 121.20 118.80 3ly2 s ILE 211 Ca 0.29 -0.85 -0.15 0.00 0.00 0.00 0.00 60.65 59.94 3ly2 s ILE 211 Cb -0.11 -2.93 0.00 0.00 0.01 0.00 0.00 42.46 39.44 3ly2 s ILE 211 CO 0.87 0.06 1.11 -0.94 0.00 0.00 0.00 174.94 176.04 3ly2 s SER 212 N 1.44 5.03 0.37 3.58 1.04 -1.26 -4.68 113.70 119.22 3ly2 s SER 212 Ca 0.01 2.01 0.05 0.00 0.48 0.00 0.00 55.95 58.50 3ly2 s SER 212 Cb -0.17 -2.55 0.72 0.00 0.10 0.00 0.00 66.02 64.11 3ly2 s SER 212 CO 0.01 -1.68 1.97 0.28 0.98 0.00 0.00 173.24 174.80 3ly2 h SER 213 N -0.05 0.52 0.14 7.02 0.02 -1.98 -1.64 113.55 117.58 3ly2 h SER 213 Ca -0.47 -0.05 0.01 0.00 -0.84 0.00 0.00 61.79 60.45 3ly2 h SER 213 Cb 1.25 -0.13 -0.03 0.00 0.14 0.00 0.00 62.40 63.63 3ly2 h SER 213 CO 0.54 0.46 -0.25 -0.78 -1.14 0.00 0.00 176.83 175.66 3ly2 h ASP 214 N 0.58 -0.71 -0.20 3.07 1.82 -1.97 -0.21 116.42 118.81 3ly2 h ASP 214 Ca 0.14 0.08 -0.01 0.00 -0.39 0.00 0.00 57.03 56.85 3ly2 h ASP 214 Cb 0.10 0.26 -0.01 0.00 0.68 0.00 0.00 39.33 40.36 3ly2 h ASP 214 CO -0.02 -0.35 0.07 0.74 -1.61 0.00 0.00 179.24 178.08 3ly2 h THR 215 N -0.47 1.17 -0.20 2.25 2.02 -1.67 -1.74 112.91 114.26 3ly2 h THR 215 Ca 0.02 -0.53 0.01 0.00 0.77 0.00 0.00 66.41 66.69 3ly2 h THR 215 Cb 0.48 1.15 -0.02 0.00 -1.74 0.00 0.00 68.15 68.03 3ly2 h THR 215 CO -0.13 0.17 0.11 0.15 0.37 0.00 0.00 175.52 176.19 3ly2 h PHE 216 N 0.16 0.20 -0.41 3.16 3.57 -1.16 -0.98 116.94 121.48 3ly2 h PHE 216 Ca 0.07 0.01 -0.11 0.00 3.53 0.00 0.00 57.97 61.47 3ly2 h PHE 216 Cb 0.19 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 38.86 3ly2 h PHE 216 CO -0.01 0.12 -0.18 0.82 -2.23 0.00 0.00 178.31 176.83 3ly2 h ILE 217 N 0.23 1.27 -0.42 1.41 1.08 -1.05 -0.85 117.51 119.17 3ly2 h ILE 217 Ca 0.08 -1.27 -0.03 0.00 -0.39 0.00 0.00 64.86 63.25 3ly2 h ILE 217 Cb 0.01 1.14 -0.02 0.00 -3.07 0.00 0.00 36.82 34.88 3ly2 h ILE 217 CO -0.05 0.43 0.16 0.74 -0.69 0.00 0.00 178.15 178.74 3ly2 h THR 218 N 0.70 1.20 0.22 -0.27 2.02 -1.03 -0.76 112.91 114.99 3ly2 h THR 218 Ca 0.11 -0.63 -0.01 0.00 0.77 0.00 0.00 66.41 66.64 3ly2 h THR 218 Cb 0.68 0.83 0.00 0.00 -1.74 0.00 0.00 68.15 67.92 3ly2 h THR 218 CO 0.05 0.23 -0.11 0.22 0.37 0.00 0.00 175.52 176.28 3ly2 h TYR 219 N 0.54 -0.28 -0.92 3.16 3.20 -1.04 -2.31 116.97 119.32 3ly2 h TYR 219 Ca 0.14 -0.01 0.09 0.00 3.14 0.00 0.00 58.73 62.10 3ly2 h TYR 219 Cb 0.20 0.09 -0.07 0.00 1.54 0.00 0.00 36.73 38.50 3ly2 h TYR 219 CO 0.00 0.02 0.59 0.52 -1.64 0.00 0.00 178.16 177.65 3ly2 h MET 220 N -0.58 0.93 0.00 1.82 2.86 -1.11 0.43 114.93 119.28 3ly2 h MET 220 Ca -0.03 -0.06 -0.11 0.00 -2.06 0.00 0.00 59.70 57.44 3ly2 h MET 220 Cb 0.42 -0.21 -0.02 0.00 0.06 0.00 0.00 31.60 31.86 3ly2 h MET 220 CO 0.05 0.61 -0.52 0.52 1.06 0.00 0.00 176.91 178.63 3ly2 h MET 221 N 0.95 0.00 -0.07 1.72 2.86 -1.13 0.22 114.93 119.49 3ly2 h MET 221 Ca 0.42 0.00 -0.18 0.00 -2.06 0.00 0.00 59.70 57.88 3ly2 h MET 221 Cb 0.36 0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.03 3ly2 h MET 221 CO -0.18 0.52 -0.66 1.15 1.06 0.00 0.00 176.91 178.80 3ly2 h THR 222 N 0.00 1.35 -0.09 2.22 2.02 -0.40 -2.19 112.91 115.83 3ly2 h THR 222 Ca -0.01 -1.98 -0.01 0.00 0.77 0.00 0.00 66.41 65.18 3ly2 h THR 222 Cb 0.94 2.30 -0.00 0.00 -1.74 0.00 0.00 68.15 69.64 3ly2 h THR 222 CO 0.07 0.60 0.03 0.25 0.37 0.00 0.00 175.52 176.84 3ly2 h LEU 223 N 0.17 0.13 -1.35 2.58 5.85 -0.04 -2.74 115.31 119.91 3ly2 h LEU 223 Ca -0.06 -0.20 0.07 0.00 0.84 0.00 0.00 57.88 58.52 3ly2 h LEU 223 Cb 1.32 -0.03 -0.05 0.00 0.37 0.00 0.00 40.66 42.27 3ly2 h LEU 223 CO 0.13 0.29 0.49 -0.08 -0.34 0.00 0.00 178.44 178.94 3ly2 h GLU 224 N -0.04 0.76 0.00 1.25 4.81 -0.61 0.14 114.58 120.89 3ly2 h GLU 224 Ca 0.03 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 3ly2 h GLU 224 Cb 0.21 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.42 3ly2 h GLU 224 CO -0.00 0.50 0.00 -0.44 -0.73 0.00 0.00 179.01 178.34 3ly2 h ASP 225 N 0.79 0.00 -0.23 1.04 3.45 -1.10 -2.33 116.42 118.04 3ly2 h ASP 225 Ca 0.32 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.78 3ly2 h ASP 225 Cb 0.26 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.03 3ly2 h ASP 225 CO -0.11 0.00 0.00 1.41 -1.57 0.00 0.00 179.24 178.97 3ly2 n HIS 226 N -2.58 0.29 -3.54 4.55 8.25 0.04 -4.77 115.22 117.46 3ly2 n HIS 226 Ca 0.00 -0.15 -0.37 0.00 -0.26 0.00 0.00 57.72 56.95 3ly2 n HIS 226 Cb 0.19 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.23 3ly2 n HIS 226 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 3ly2 s TYR 227 N -1.71 3.53 -0.27 4.41 1.51 -0.88 -1.19 117.35 122.75 3ly2 s TYR 227 Ca 0.34 0.69 -0.29 0.00 -1.01 0.00 0.00 57.07 56.81 3ly2 s TYR 227 Cb 0.20 -2.32 0.01 0.00 -0.11 0.00 0.00 41.96 39.73 3ly2 s TYR 227 CO 0.29 0.35 1.15 -1.01 -1.11 0.00 0.00 175.55 175.22 3ly2 s HIS 228 N 0.07 3.02 0.31 2.71 3.76 -1.26 -4.74 115.29 119.16 3ly2 s HIS 228 Ca 0.19 1.14 0.30 0.00 -0.15 0.00 0.00 55.06 56.54 3ly2 s HIS 228 Cb -0.14 -3.63 1.44 0.00 1.11 0.00 0.00 32.58 31.36 3ly2 s HIS 228 CO 0.06 -1.10 2.03 0.66 -0.85 0.00 0.00 174.74 175.55 3ly2 h SER 229 N 8.27 0.00 -0.09 1.40 4.64 -1.93 -2.61 113.55 123.23 3ly2 h SER 229 Ca -0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.09 3ly2 h SER 229 Cb 1.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.17 3ly2 h SER 229 CO 1.01 0.10 0.00 -0.90 -0.87 0.00 0.00 176.83 176.17 3ly2 n ASP 230 N -3.39 1.02 -4.65 4.97 3.85 -1.26 -4.73 116.55 112.36 3ly2 n ASP 230 Ca -0.01 -1.55 -0.39 0.00 -0.71 0.00 0.00 54.79 52.14 3ly2 n ASP 230 Cb 0.28 -0.05 -0.08 0.00 -1.35 0.00 0.00 41.12 39.91 3ly2 n ASP 230 CO 0.00 0.00 0.00 -0.69 -1.01 0.00 0.00 177.20 175.50 3ly2 s VAL 231 N -1.89 5.18 0.20 2.12 1.01 -0.98 -5.00 120.40 121.03 3ly2 s VAL 231 Ca 0.32 0.70 -0.10 0.00 0.00 0.00 0.00 61.98 62.90 3ly2 s VAL 231 Cb 0.17 -3.74 0.14 0.00 0.00 0.00 0.00 36.38 32.95 3ly2 s VAL 231 CO 0.26 0.21 1.73 0.00 0.00 0.00 0.00 175.10 177.30 3ly2 h ALA 232 N 7.62 0.71 0.00 5.51 0.00 -1.86 -3.39 119.26 127.85 3ly2 h ALA 232 Ca -0.34 0.10 -0.06 0.00 0.00 0.00 0.00 54.91 54.60 3ly2 h ALA 232 Cb 1.16 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.04 3ly2 h ALA 232 CO 0.70 -0.24 -0.91 0.98 0.00 0.00 0.00 179.25 179.78 3ly2 n TYR 233 N -5.05 0.00 -0.90 0.00 9.36 -1.26 -4.78 117.16 114.53 3ly2 n TYR 233 Ca 0.08 0.00 -0.26 0.00 3.32 0.00 0.00 57.90 61.03 3ly2 n TYR 233 Cb 0.28 -0.38 -0.02 0.00 -0.63 0.00 0.00 39.34 38.58 3ly2 n TYR 233 CO 0.00 0.00 0.00 0.72 0.22 0.00 0.00 176.86 177.80 3ly2 n HIS 234 N -4.03 1.62 -3.92 2.98 8.25 -1.26 -4.28 115.22 114.58 3ly2 n HIS 234 Ca -0.14 -2.26 -0.14 0.00 -0.26 0.00 0.00 57.72 54.92 3ly2 n HIS 234 Cb 0.41 -1.90 -0.01 0.00 1.12 0.00 0.00 29.99 29.62 3ly2 n HIS 234 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 3ly2 n ASN 235 N 3.97 2.15 0.28 0.41 0.23 -1.26 -4.53 115.26 116.51 3ly2 n ASN 235 Ca 0.54 -2.00 0.15 0.00 -0.53 0.00 0.00 54.58 52.75 3ly2 n ASN 235 Cb 0.17 0.05 0.89 0.00 -2.08 0.00 0.00 39.78 38.81 3ly2 n ASN 235 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 3ly2 h SER 236 N 0.42 0.00 -0.55 0.53 4.64 -1.85 -2.08 113.55 114.66 3ly2 h SER 236 Ca -0.19 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.07 3ly2 h SER 236 Cb 0.63 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.70 3ly2 h SER 236 CO 0.30 0.00 0.10 0.25 -0.87 0.00 0.00 176.83 176.61 3ly2 h LEU 237 N 0.00 0.90 -0.57 5.97 5.85 -1.95 0.29 115.31 125.80 3ly2 h LEU 237 Ca 0.02 -0.19 -0.12 0.00 0.84 0.00 0.00 57.88 58.43 3ly2 h LEU 237 Cb 0.11 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 40.89 3ly2 h LEU 237 CO -0.00 0.90 -0.15 -0.74 -0.34 0.00 0.00 178.44 178.11 3ly2 h HIS 238 N 0.90 1.11 -0.52 1.25 2.76 -1.56 -0.96 115.15 118.12 3ly2 h HIS 238 Ca 0.19 -0.24 -0.07 0.00 -2.20 0.00 0.00 60.37 58.04 3ly2 h HIS 238 Cb 0.38 -0.27 -0.02 0.00 1.55 0.00 0.00 27.41 29.05 3ly2 h HIS 238 CO 0.02 1.05 0.05 0.00 -1.30 0.00 0.00 177.93 177.76 3ly2 h ALA 239 N 0.95 0.69 -0.17 5.26 0.00 -1.31 -0.86 119.26 123.82 3ly2 h ALA 239 Ca 0.13 -0.26 0.01 0.00 0.00 0.00 0.00 54.91 54.79 3ly2 h ALA 239 Cb 0.71 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 3ly2 h ALA 239 CO 0.05 0.46 0.08 0.00 0.00 0.00 0.00 179.25 179.84 3ly2 h ALA 240 N 0.96 0.19 -0.38 0.00 0.00 -0.22 -0.78 119.26 119.04 3ly2 h ALA 240 Ca 0.15 0.01 0.04 0.00 0.00 0.00 0.00 54.91 55.11 3ly2 h ALA 240 Cb 0.45 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.18 3ly2 h ALA 240 CO 0.02 -0.35 0.14 0.22 0.00 0.00 0.00 179.25 179.27 3ly2 h ASP 241 N 0.17 0.15 -0.40 0.00 3.58 -0.87 -0.12 116.42 118.92 3ly2 h ASP 241 Ca 0.07 0.04 -0.09 0.00 0.42 0.00 0.00 57.03 57.47 3ly2 h ASP 241 Cb 0.02 0.02 -0.02 0.00 1.72 0.00 0.00 39.33 41.07 3ly2 h ASP 241 CO -0.05 0.12 -0.08 0.58 -2.88 0.00 0.00 179.24 176.93 3ly2 h VAL 242 N 0.29 1.26 0.14 2.25 2.07 -0.96 0.89 116.25 122.19 3ly2 h VAL 242 Ca 0.17 -1.15 -0.01 0.00 0.82 0.00 0.00 66.70 66.54 3ly2 h VAL 242 Cb 0.15 0.97 0.00 0.00 -1.52 0.00 0.00 31.29 30.89 3ly2 h VAL 242 CO -0.18 0.40 -0.07 0.00 0.02 0.00 0.00 177.57 177.75 3ly2 h ALA 243 N 1.15 -0.18 -0.85 1.67 0.00 -0.73 -0.48 119.26 119.83 3ly2 h ALA 243 Ca 0.13 -0.12 0.01 0.00 0.00 0.00 0.00 54.91 54.92 3ly2 h ALA 243 Cb 0.57 0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.39 3ly2 h ALA 243 CO 0.03 -0.50 0.56 0.37 0.00 0.00 0.00 179.25 179.71 3ly2 h GLN 244 N -0.39 1.13 -0.37 0.00 -0.00 -0.91 -0.50 115.11 114.07 3ly2 h GLN 244 Ca -0.02 -0.08 -0.10 0.00 -0.00 0.00 0.00 58.65 58.45 3ly2 h GLN 244 Cb 0.31 -0.25 -0.02 0.00 0.00 0.00 0.00 27.48 27.52 3ly2 h GLN 244 CO 0.03 0.76 -0.20 0.77 0.00 0.00 0.00 178.83 180.19 3ly2 h SER 245 N 1.16 0.71 -0.23 -0.69 0.02 -0.71 -2.49 113.55 111.31 3ly2 h SER 245 Ca 0.31 -0.24 -0.10 0.00 -0.84 0.00 0.00 61.79 60.92 3ly2 h SER 245 Cb -0.12 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.21 3ly2 h SER 245 CO -0.07 0.90 -0.17 0.74 -1.14 0.00 0.00 176.83 177.09 3ly2 h THR 246 N 0.62 1.26 -0.70 -2.27 2.02 -0.58 -1.96 112.91 111.30 3ly2 h THR 246 Ca 0.09 -1.22 -0.02 0.00 0.77 0.00 0.00 66.41 66.04 3ly2 h THR 246 Cb 0.68 1.17 -0.03 0.00 -1.74 0.00 0.00 68.15 68.23 3ly2 h THR 246 CO 0.05 0.40 0.38 -0.74 0.37 0.00 0.00 175.52 175.98 3ly2 h HIS 247 N 0.60 0.96 -0.03 3.16 -0.00 -0.68 -1.64 115.15 117.51 3ly2 h HIS 247 Ca 0.10 -0.02 -0.11 0.00 -0.00 0.00 0.00 60.37 60.34 3ly2 h HIS 247 Cb 0.63 -0.31 0.01 0.00 -0.00 0.00 0.00 27.41 27.74 3ly2 h HIS 247 CO 0.03 0.67 -0.41 0.28 -0.00 0.00 0.00 177.93 178.50 3ly2 h VAL 248 N 0.98 1.45 -0.22 5.26 2.07 -1.16 -3.24 116.25 121.40 3ly2 h VAL 248 Ca 0.25 -1.90 0.02 0.00 0.82 0.00 0.00 66.70 65.89 3ly2 h VAL 248 Cb 0.04 2.51 -0.01 0.00 -1.52 0.00 0.00 31.29 32.30 3ly2 h VAL 248 CO -0.04 0.54 0.15 -0.07 0.02 0.00 0.00 177.57 178.17 3ly2 h LEU 249 N -0.20 0.18 -1.57 2.57 3.38 -1.21 -1.13 115.31 117.34 3ly2 h LEU 249 Ca -0.04 -0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.88 3ly2 h LEU 249 Cb 1.10 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.80 3ly2 h LEU 249 CO 0.08 0.13 -0.21 -0.07 0.09 0.00 0.00 178.44 178.46 3ly2 h LEU 250 N 0.22 0.00 -1.65 1.67 3.38 -1.32 -2.48 115.31 115.12 3ly2 h LEU 250 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 3ly2 h LEU 250 Cb 0.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.84 3ly2 h LEU 250 CO -0.02 0.21 0.00 -1.20 0.09 0.00 0.00 178.44 177.52 3ly2 n SER 251 N -3.73 2.46 -4.74 -0.43 7.64 -0.44 -4.77 113.62 109.61 3ly2 n SER 251 Ca -0.01 -1.86 -0.42 0.00 1.01 0.00 0.00 58.87 57.59 3ly2 n SER 251 Cb 0.32 -0.18 -0.01 0.00 -1.01 0.00 0.00 64.21 63.33 3ly2 n SER 251 CO 0.00 0.00 0.00 1.07 -3.01 0.00 0.00 175.04 173.10 3ly2 n THR 252 N 0.84 1.19 -0.24 0.44 5.66 -0.94 -4.86 114.28 116.38 3ly2 n THR 252 Ca 0.17 -0.30 -0.01 0.00 -3.05 0.00 0.00 64.05 60.86 3ly2 n THR 252 Cb 0.44 -1.90 0.06 0.00 -1.55 0.00 0.00 70.33 67.38 3ly2 n THR 252 CO 0.00 0.00 0.00 -0.65 -3.05 0.00 0.00 175.07 171.37 3ly2 h PRO 253 N 4.38 -0.05 0.00 1.09 0.11 -1.92 -1.57 132.00 134.04 3ly2 h PRO 253 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3ly2 h PRO 253 Cb 1.23 0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.36 3ly2 h PRO 253 CO 0.76 -0.03 0.06 0.00 -0.21 0.00 0.00 178.00 178.57 3ly2 n ALA 254 N -3.20 0.96 -0.31 -0.75 0.00 -1.26 -1.14 120.51 114.82 3ly2 n ALA 254 Ca 0.08 0.19 0.05 0.00 0.00 0.00 0.00 53.44 53.75 3ly2 n ALA 254 Cb 0.37 -1.22 0.12 0.00 0.00 0.00 0.00 19.45 18.72 3ly2 n ALA 254 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3ly2 n LEU 255 N -2.23 2.73 -4.69 0.00 4.77 -0.60 -0.04 117.00 116.94 3ly2 n LEU 255 Ca -0.01 -2.23 -0.44 0.00 -0.03 0.00 0.00 56.01 53.29 3ly2 n LEU 255 Cb 0.09 -0.22 -0.03 0.00 -2.33 0.00 0.00 43.42 40.93 3ly2 n LEU 255 CO 0.09 0.65 1.17 -0.67 -1.33 0.00 0.00 177.39 177.30 3ly2 n ASP 256 N -0.10 3.24 -1.33 -1.43 -0.08 -0.29 -2.12 116.55 114.44 3ly2 n ASP 256 Ca 0.10 1.11 -0.16 0.00 -1.51 0.00 0.00 54.79 54.32 3ly2 n ASP 256 Cb 0.45 -1.47 -0.07 0.00 2.34 0.00 0.00 41.12 42.37 3ly2 n ASP 256 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3ly2 n ALA 257 N 2.84 -0.25 0.03 -1.67 0.00 -1.26 -4.86 120.51 115.34 3ly2 n ALA 257 Ca 0.14 0.27 -0.22 0.00 0.00 0.00 0.00 53.44 53.62 3ly2 n ALA 257 Cb 0.32 -1.85 -0.14 0.00 0.00 0.00 0.00 19.45 17.77 3ly2 n ALA 257 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3ly2 h VAL 258 N 0.00 0.90 -3.01 0.00 2.07 -1.79 -3.47 116.25 110.95 3ly2 h VAL 258 Ca -0.34 -2.43 -0.61 0.00 0.82 0.00 0.00 66.70 64.14 3ly2 h VAL 258 Cb 1.22 2.68 -0.05 0.00 -1.52 0.00 0.00 31.29 33.61 3ly2 h VAL 258 CO 0.49 0.80 -0.26 -0.36 0.02 0.00 0.00 177.57 178.27 3ly2 s PHE 259 N -2.53 3.65 0.90 1.57 0.08 -1.26 -5.01 117.98 115.36 3ly2 s PHE 259 Ca -0.19 0.84 -0.12 0.00 0.12 0.00 0.00 56.93 57.57 3ly2 s PHE 259 Cb 0.05 -2.18 0.13 0.00 -0.57 0.00 0.00 43.02 40.45 3ly2 s PHE 259 CO 0.80 0.60 1.15 0.95 -0.10 0.00 0.00 175.22 178.62 3ly2 s THR 260 N -1.22 1.99 0.30 0.64 -4.23 -1.26 -4.86 115.64 107.00 3ly2 s THR 260 Ca 0.27 0.00 0.03 0.00 -1.18 0.00 0.00 61.69 60.81 3ly2 s THR 260 Cb -0.15 -2.81 0.11 0.00 1.34 0.00 0.00 72.50 71.00 3ly2 s THR 260 CO 0.15 0.00 1.79 0.44 -0.54 0.00 0.00 174.62 176.46 3ly2 h ASP 261 N -1.43 0.51 -0.40 3.99 3.32 -1.99 -2.08 116.42 118.35 3ly2 h ASP 261 Ca -0.49 -0.13 -0.03 0.00 0.02 0.00 0.00 57.03 56.40 3ly2 h ASP 261 Cb 1.33 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 40.72 3ly2 h ASP 261 CO 0.62 0.67 0.14 0.25 -1.72 0.00 0.00 179.24 179.20 3ly2 h LEU 262 N 0.49 0.57 -0.88 1.55 5.85 -1.99 -1.04 115.31 119.85 3ly2 h LEU 262 Ca 0.09 -0.19 -0.06 0.00 0.84 0.00 0.00 57.88 58.57 3ly2 h LEU 262 Cb 0.50 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.35 3ly2 h LEU 262 CO 0.03 0.60 0.18 -0.33 -0.34 0.00 0.00 178.44 178.58 3ly2 h GLU 263 N 0.50 1.00 -0.56 1.25 5.08 -1.87 -0.58 114.58 119.41 3ly2 h GLU 263 Ca 0.13 -0.21 -0.06 0.00 -1.00 0.00 0.00 59.36 58.22 3ly2 h GLU 263 Cb 0.22 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 3ly2 h GLU 263 CO -0.01 0.88 0.13 0.82 -1.00 0.00 0.00 179.01 179.83 3ly2 h ILE 264 N 0.96 1.25 -0.81 3.13 2.04 -1.16 -1.31 117.51 121.61 3ly2 h ILE 264 Ca 0.21 -0.90 -0.04 0.00 1.00 0.00 0.00 64.86 65.14 3ly2 h ILE 264 Cb 0.31 0.76 -0.04 0.00 -0.74 0.00 0.00 36.82 37.12 3ly2 h ILE 264 CO -0.00 0.33 0.37 0.25 0.00 0.00 0.00 178.15 179.09 3ly2 h LEU 265 N 0.80 1.08 -0.12 1.44 5.85 -0.78 -2.51 115.31 121.07 3ly2 h LEU 265 Ca 0.17 -0.15 -0.02 0.00 0.84 0.00 0.00 57.88 58.73 3ly2 h LEU 265 Cb 0.36 -0.28 -0.00 0.00 0.37 0.00 0.00 40.66 41.10 3ly2 h LEU 265 CO 0.00 0.93 0.01 0.00 -0.34 0.00 0.00 178.44 179.05 3ly2 h ALA 266 N 1.19 0.16 -0.50 1.25 0.00 -0.73 -1.17 119.26 119.47 3ly2 h ALA 266 Ca 0.27 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 3ly2 h ALA 266 Cb 0.15 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 3ly2 h ALA 266 CO -0.03 -0.17 0.14 0.00 0.00 0.00 0.00 179.25 179.19 3ly2 h ALA 267 N 0.78 1.32 0.05 0.00 0.00 -1.19 0.82 119.26 121.04 3ly2 h ALA 267 Ca 0.04 -0.18 -0.23 0.00 0.00 0.00 0.00 54.91 54.54 3ly2 h ALA 267 Cb 0.32 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 3ly2 h ALA 267 CO 0.00 0.49 -1.05 0.82 0.00 0.00 0.00 179.25 179.51 3ly2 h ILE 268 N 0.72 1.53 -0.30 0.00 2.04 -1.42 -2.33 117.51 117.75 3ly2 h ILE 268 Ca 0.17 -2.93 -0.15 0.00 1.00 0.00 0.00 64.86 62.95 3ly2 h ILE 268 Cb 0.24 2.72 -0.00 0.00 -0.74 0.00 0.00 36.82 39.04 3ly2 h ILE 268 CO -0.01 0.85 -0.41 0.15 0.00 0.00 0.00 178.15 178.74 3ly2 h PHE 269 N 0.09 0.99 -0.37 1.37 3.57 -0.96 -2.16 116.94 119.47 3ly2 h PHE 269 Ca -0.08 -0.32 0.01 0.00 3.53 0.00 0.00 57.97 61.11 3ly2 h PHE 269 Cb 1.75 -0.20 -0.02 0.00 2.79 0.00 0.00 35.95 40.26 3ly2 h PHE 269 CO 0.04 1.12 0.23 0.00 -2.23 0.00 0.00 178.31 177.47 3ly2 h ALA 270 N 0.70 0.47 -0.86 2.41 0.00 -0.86 -2.06 119.26 119.07 3ly2 h ALA 270 Ca 0.04 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 3ly2 h ALA 270 Cb 1.00 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.62 3ly2 h ALA 270 CO 0.10 -0.10 0.53 0.00 0.00 0.00 0.00 179.25 179.77 3ly2 h ALA 271 N 1.15 1.09 -0.28 0.00 0.00 -1.33 0.20 119.26 120.09 3ly2 h ALA 271 Ca 0.14 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 3ly2 h ALA 271 Cb -0.02 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.41 3ly2 h ALA 271 CO -0.05 0.54 -0.06 0.00 0.00 0.00 0.00 179.25 179.68 3ly2 h ALA 272 N 1.29 1.39 -0.02 0.00 0.00 -0.89 -3.15 119.26 117.89 3ly2 h ALA 272 Ca 0.31 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.00 3ly2 h ALA 272 Cb -0.07 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.60 3ly2 h ALA 272 CO -0.06 0.42 -0.25 0.44 0.00 0.00 0.00 179.25 179.80 3ly2 n ILE 273 N -4.27 0.00 0.30 0.00 -5.35 -0.82 -4.70 119.36 104.52 3ly2 n ILE 273 Ca 0.01 -0.37 0.12 0.00 -0.27 0.00 0.00 62.75 62.23 3ly2 n ILE 273 Cb 0.26 1.25 0.65 0.00 -1.74 0.00 0.00 39.64 40.06 3ly2 n ILE 273 CO 0.00 0.00 0.00 1.12 -1.76 0.00 0.00 176.55 175.91 3ly2 h HIS 274 N 2.37 0.00 0.00 4.28 2.07 -0.57 -1.98 115.15 121.32 3ly2 h HIS 274 Ca 0.00 0.00 -0.01 0.00 -2.85 0.00 0.00 60.37 57.51 3ly2 h HIS 274 Cb 0.63 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.60 3ly2 h HIS 274 CO 0.00 0.00 -0.39 -0.25 -3.07 0.00 0.00 177.93 174.22 3ly2 n ASP 275 N -2.68 0.67 -4.74 3.10 8.00 -1.26 -4.88 116.55 114.76 3ly2 n ASP 275 Ca -0.02 -2.31 -0.42 0.00 0.71 0.00 0.00 54.79 52.76 3ly2 n ASP 275 Cb 0.43 -0.27 -0.01 0.00 -0.02 0.00 0.00 41.12 41.25 3ly2 n ASP 275 CO 0.00 0.00 0.00 0.55 -0.39 0.00 0.00 177.20 177.36 3ly2 n VAL 276 N -0.37 1.62 -2.27 2.53 3.14 -0.75 -2.10 118.33 120.13 3ly2 n VAL 276 Ca 0.05 -0.40 -0.17 0.00 -2.96 0.00 0.00 64.34 60.85 3ly2 n VAL 276 Cb 0.70 -1.85 -0.01 0.00 -1.06 0.00 0.00 33.84 31.61 3ly2 n VAL 276 CO 0.00 0.00 0.00 -0.67 -6.46 0.00 0.00 176.83 169.70 3ly2 n ASP 277 N 1.17 -5.10 -4.71 6.55 2.03 -0.33 -4.37 116.55 111.78 3ly2 n ASP 277 Ca 0.05 0.02 -0.42 0.00 0.52 0.00 0.00 54.79 54.96 3ly2 n ASP 277 Cb 0.37 -4.18 -0.03 0.00 -0.72 0.00 0.00 41.12 36.56 3ly2 n ASP 277 CO 0.00 0.00 0.00 -2.28 -1.92 0.00 0.00 177.20 173.00 3ly2 s HIS 278 N -2.85 3.13 -1.49 -0.67 5.65 -0.89 -4.92 115.29 113.25 3ly2 s HIS 278 Ca 0.00 0.82 0.29 0.00 0.25 0.00 0.00 55.06 56.43 3ly2 s HIS 278 Cb 0.00 -3.76 1.35 0.00 -1.18 0.00 0.00 32.58 28.99 3ly2 s HIS 278 CO 0.00 -2.75 1.94 -0.35 -0.65 0.00 0.00 174.74 172.94 3ly2 n PRO 279 N 4.11 0.51 -0.63 2.88 -0.04 -1.26 -4.55 135.00 136.02 3ly2 n PRO 279 Ca 0.12 -0.10 0.00 0.00 -0.04 0.00 0.00 63.50 63.48 3ly2 n PRO 279 Cb 0.41 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.37 3ly2 n PRO 279 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3ly2 n GLY 280 N 1.30 0.66 3.23 0.55 0.00 -1.26 -4.99 105.19 104.68 3ly2 n GLY 280 Ca 0.14 -0.25 -0.14 0.00 0.00 0.00 0.00 46.02 45.76 3ly2 n GLY 280 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3ly2 s VAL 281 N -2.00 1.12 0.88 1.61 -7.23 -1.26 -4.55 120.40 108.98 3ly2 s VAL 281 Ca 0.00 -1.96 -0.12 0.00 -1.81 0.00 0.00 61.98 58.09 3ly2 s VAL 281 Cb 0.00 -1.73 0.12 0.00 0.56 0.00 0.00 36.38 35.33 3ly2 s VAL 281 CO 0.00 -0.70 1.14 -0.94 -0.31 0.00 0.00 175.10 174.29 3ly2 s SER 282 N -2.98 3.77 0.20 4.85 1.04 -1.26 -4.91 113.70 114.40 3ly2 s SER 282 Ca 0.14 0.96 -0.10 0.00 0.48 0.00 0.00 55.95 57.44 3ly2 s SER 282 Cb 0.01 -1.54 0.12 0.00 0.10 0.00 0.00 66.02 64.71 3ly2 s SER 282 CO 0.00 -2.39 1.76 0.78 0.98 0.00 0.00 173.24 174.37 3ly2 h ASN 283 N -1.39 0.98 -0.59 7.02 2.35 -2.01 -2.43 115.58 119.51 3ly2 h ASN 283 Ca -0.49 -0.17 -0.01 0.00 -0.55 0.00 0.00 56.30 55.07 3ly2 h ASN 283 Cb 1.33 -0.25 -0.03 0.00 0.05 0.00 0.00 38.32 39.41 3ly2 h ASN 283 CO 0.62 0.89 0.34 -0.61 -1.65 0.00 0.00 177.43 177.02 3ly2 h GLN 284 N 1.02 0.84 -0.35 0.81 5.75 -1.97 -0.31 115.11 120.90 3ly2 h GLN 284 Ca 0.24 -0.08 -0.02 0.00 -0.15 0.00 0.00 58.65 58.63 3ly2 h GLN 284 Cb 0.21 -0.17 -0.02 0.00 1.07 0.00 0.00 27.48 28.57 3ly2 h GLN 284 CO -0.02 0.61 0.14 0.35 -2.65 0.00 0.00 178.83 177.26 3ly2 h PHE 285 N 0.85 0.52 -0.31 3.99 3.04 -1.82 0.15 116.94 123.37 3ly2 h PHE 285 Ca 0.22 -0.04 -0.02 0.00 3.98 0.00 0.00 57.97 62.11 3ly2 h PHE 285 Cb 0.02 -0.16 -0.02 0.00 2.56 0.00 0.00 35.95 38.35 3ly2 h PHE 285 CO 0.00 0.49 0.12 -0.07 -2.02 0.00 0.00 178.31 176.83 3ly2 h LEU 286 N 0.41 0.38 0.00 0.59 3.38 -0.87 -1.73 115.31 117.48 3ly2 h LEU 286 Ca 0.12 -0.03 -0.15 0.00 0.09 0.00 0.00 57.88 57.90 3ly2 h LEU 286 Cb 0.18 -0.10 0.01 0.00 0.09 0.00 0.00 40.66 40.85 3ly2 h LEU 286 CO -0.01 0.36 -0.61 0.40 0.09 0.00 0.00 178.44 178.67 3ly2 h ILE 287 N 0.43 1.43 0.00 1.22 2.04 -0.62 -1.37 117.51 120.65 3ly2 h ILE 287 Ca 0.11 -2.10 -0.05 0.00 1.00 0.00 0.00 64.86 63.82 3ly2 h ILE 287 Cb 0.10 2.62 -0.01 0.00 -0.74 0.00 0.00 36.82 38.79 3ly2 h ILE 287 CO -0.01 0.61 -0.24 0.78 0.00 0.00 0.00 178.15 179.29 3ly2 h ASN 288 N -0.12 0.00 0.10 1.72 2.35 -0.43 -1.78 115.58 117.43 3ly2 h ASN 288 Ca -0.08 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.67 3ly2 h ASN 288 Cb 1.32 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.69 3ly2 h ASN 288 CO 0.12 0.24 -0.08 0.35 -1.65 0.00 0.00 177.43 176.42 3ly2 n THR 289 N -4.16 0.00 -3.56 2.81 -2.24 -0.67 -4.93 114.28 101.53 3ly2 n THR 289 Ca -0.02 -0.17 -0.22 0.00 -2.27 0.00 0.00 64.05 61.36 3ly2 n THR 289 Cb 0.30 0.30 0.08 0.00 -2.10 0.00 0.00 70.33 68.91 3ly2 n THR 289 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 3ly2 n ASN 290 N -0.29 -5.33 -4.77 3.42 5.15 -0.67 -4.96 115.26 107.82 3ly2 n ASN 290 Ca 0.17 -0.56 -0.34 0.00 -0.60 0.00 0.00 54.58 53.26 3ly2 n ASN 290 Cb 0.32 -5.06 0.04 0.00 -0.53 0.00 0.00 39.78 34.55 3ly2 n ASN 290 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 3ly2 s SER 291 N -3.58 5.17 0.35 1.20 1.04 -0.53 -4.89 113.70 112.47 3ly2 s SER 291 Ca 0.44 2.07 0.09 0.00 0.48 0.00 0.00 55.95 59.03 3ly2 s SER 291 Cb -0.20 -2.56 0.81 0.00 0.10 0.00 0.00 66.02 64.17 3ly2 s SER 291 CO 0.73 -1.59 1.86 -0.08 0.98 0.00 0.00 173.24 175.14 3ly2 h GLU 292 N 0.27 0.68 -0.65 4.02 4.81 -1.93 -1.40 114.58 120.37 3ly2 h GLU 292 Ca -0.48 -0.04 -0.07 0.00 -0.13 0.00 0.00 59.36 58.65 3ly2 h GLU 292 Cb 1.25 -0.15 -0.03 0.00 0.63 0.00 0.00 28.75 30.45 3ly2 h GLU 292 CO 0.54 0.45 0.14 -0.07 -0.73 0.00 0.00 179.01 179.34 3ly2 h LEU 293 N 0.70 0.99 -0.74 1.64 3.38 -1.92 0.81 115.31 120.16 3ly2 h LEU 293 Ca 0.46 -0.21 -0.08 0.00 0.09 0.00 0.00 57.88 58.14 3ly2 h LEU 293 Cb 0.74 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 3ly2 h LEU 293 CO -0.22 0.96 0.07 0.00 0.09 0.00 0.00 178.44 179.34 3ly2 h ALA 294 N 1.16 0.95 -0.33 1.53 0.00 -1.53 -2.05 119.26 118.99 3ly2 h ALA 294 Ca 0.21 -0.28 -0.17 0.00 0.00 0.00 0.00 54.91 54.67 3ly2 h ALA 294 Cb 0.37 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 3ly2 h ALA 294 CO 0.00 0.65 -0.46 -0.07 0.00 0.00 0.00 179.25 179.37 3ly2 h LEU 295 N 0.96 0.95 -1.00 0.00 3.38 -1.13 0.11 115.31 118.58 3ly2 h LEU 295 Ca 0.19 -0.47 0.10 0.00 0.09 0.00 0.00 57.88 57.79 3ly2 h LEU 295 Cb 0.46 -0.27 -0.08 0.00 0.09 0.00 0.00 40.66 40.86 3ly2 h LEU 295 CO 0.02 1.25 0.63 -0.03 0.09 0.00 0.00 178.44 180.41 3ly2 h MET 296 N 0.69 1.01 -0.18 1.13 4.05 -0.53 -2.99 114.93 118.11 3ly2 h MET 296 Ca 0.04 -0.06 -0.07 0.00 -0.28 0.00 0.00 59.70 59.33 3ly2 h MET 296 Cb 1.05 -0.23 -0.04 0.00 -0.80 0.00 0.00 31.60 31.58 3ly2 h MET 296 CO 0.11 0.67 -0.17 0.66 0.23 0.00 0.00 176.91 178.41 3ly2 n TYR 297 N -4.59 0.58 -4.16 1.39 4.01 -0.80 -4.99 117.16 108.60 3ly2 n TYR 297 Ca 0.18 -1.35 -0.34 0.00 -0.16 0.00 0.00 57.90 56.22 3ly2 n TYR 297 Cb 0.30 -0.34 -0.02 0.00 -0.31 0.00 0.00 39.34 38.97 3ly2 n TYR 297 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 3ly2 n ASN 298 N -1.08 -2.93 0.00 7.72 3.02 -0.74 -1.37 115.26 119.87 3ly2 n ASN 298 Ca 0.25 -1.00 0.00 0.00 -0.03 0.00 0.00 54.58 53.80 3ly2 n ASN 298 Cb 0.85 -2.87 0.00 0.00 -0.61 0.00 0.00 39.78 37.15 3ly2 n ASN 298 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 3ly2 n ASP 299 N -2.72 -5.69 -4.44 6.41 8.00 -0.05 -4.95 116.55 113.11 3ly2 n ASP 299 Ca 0.01 0.00 -0.39 0.00 0.71 0.00 0.00 54.79 55.12 3ly2 n ASP 299 Cb 0.53 -3.41 -0.12 0.00 -0.02 0.00 0.00 41.12 38.10 3ly2 n ASP 299 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 3ly2 s GLU 300 N -1.92 3.32 -1.47 -1.24 0.41 -0.47 -4.56 118.70 112.76 3ly2 s GLU 300 Ca 0.00 -0.74 -0.01 0.00 -0.41 0.00 0.00 54.97 53.82 3ly2 s GLU 300 Cb 0.00 -3.60 0.01 0.00 -1.78 0.00 0.00 34.13 28.76 3ly2 s GLU 300 CO 0.00 -0.44 0.29 0.43 -0.49 0.00 0.00 175.26 175.05 3ly2 n SER 301 N 4.99 0.02 0.09 -0.19 7.64 -1.26 -4.81 113.62 120.10 3ly2 n SER 301 Ca -0.14 -1.10 -0.11 0.00 1.01 0.00 0.00 58.87 58.54 3ly2 n SER 301 Cb 0.49 -2.55 -0.06 0.00 -1.01 0.00 0.00 64.21 61.08 3ly2 n SER 301 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 3ly2 h VAL 302 N -1.80 0.00 -0.35 0.44 2.07 -1.87 -0.57 116.25 114.16 3ly2 h VAL 302 Ca -0.64 0.00 0.07 0.00 0.82 0.00 0.00 66.70 66.95 3ly2 h VAL 302 Cb 1.38 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 31.09 3ly2 h VAL 302 CO 0.66 0.00 -0.03 -0.07 0.02 0.00 0.00 177.57 178.15 3ly2 h LEU 303 N -0.50 -0.21 -0.80 2.57 3.38 -1.93 -1.61 115.31 116.21 3ly2 h LEU 303 Ca -0.01 0.09 0.03 0.00 0.09 0.00 0.00 57.88 58.08 3ly2 h LEU 303 Cb 0.49 0.17 -0.05 0.00 0.09 0.00 0.00 40.66 41.36 3ly2 h LEU 303 CO -0.16 -0.06 0.51 -0.33 0.09 0.00 0.00 178.44 178.49 3ly2 h GLU 304 N 0.06 0.97 -0.59 1.13 3.07 -1.88 0.83 114.58 118.17 3ly2 h GLU 304 Ca 0.17 -0.06 -0.05 0.00 -0.50 0.00 0.00 59.36 58.92 3ly2 h GLU 304 Cb 0.25 -0.22 -0.03 0.00 -0.84 0.00 0.00 28.75 27.91 3ly2 h GLU 304 CO -0.31 0.64 0.15 -0.91 -1.40 0.00 0.00 179.01 177.18 3ly2 h ASN 305 N 1.00 0.85 -0.34 1.42 2.35 -0.75 -2.61 115.58 117.50 3ly2 h ASN 305 Ca 0.32 -0.15 -0.06 0.00 -0.55 0.00 0.00 56.30 55.86 3ly2 h ASN 305 Cb 0.02 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.15 3ly2 h ASN 305 CO -0.12 0.82 -0.01 -0.74 -1.65 0.00 0.00 177.43 175.73 3ly2 h HIS 306 N 0.88 0.67 -0.63 1.19 2.76 -0.26 -1.61 115.15 118.15 3ly2 h HIS 306 Ca 0.19 -0.12 0.07 0.00 -2.20 0.00 0.00 60.37 58.31 3ly2 h HIS 306 Cb 0.30 -0.17 -0.06 0.00 1.55 0.00 0.00 27.41 29.03 3ly2 h HIS 306 CO 0.02 0.73 0.32 0.45 -1.30 0.00 0.00 177.93 178.15 3ly2 h HIS 307 N 0.42 0.58 -0.11 5.26 3.86 -0.67 -0.98 115.15 123.51 3ly2 h HIS 307 Ca 0.10 0.03 -0.00 0.00 -1.16 0.00 0.00 60.37 59.33 3ly2 h HIS 307 Cb 0.47 -0.17 -0.01 0.00 1.06 0.00 0.00 27.41 28.77 3ly2 h HIS 307 CO 0.04 0.26 0.06 -0.07 0.86 0.00 0.00 177.93 179.08 3ly2 h LEU 308 N 0.59 0.14 -0.68 2.43 3.38 -1.35 -0.13 115.31 119.68 3ly2 h LEU 308 Ca 0.29 -0.08 0.06 0.00 0.09 0.00 0.00 57.88 58.24 3ly2 h LEU 308 Cb 0.23 -0.04 -0.05 0.00 0.09 0.00 0.00 40.66 40.89 3ly2 h LEU 308 CO -0.21 0.18 0.39 0.00 0.09 0.00 0.00 178.44 178.89 3ly2 h ALA 309 N 0.97 0.92 -0.02 1.53 0.00 -0.70 -1.77 119.26 120.19 3ly2 h ALA 309 Ca 0.04 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 3ly2 h ALA 309 Cb 0.07 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 3ly2 h ALA 309 CO -0.01 0.08 -0.02 0.28 0.00 0.00 0.00 179.25 179.58 3ly2 h VAL 310 N 0.72 1.42 -0.61 0.00 2.07 -1.04 -0.69 116.25 118.13 3ly2 h VAL 310 Ca 0.30 -1.28 0.12 0.00 0.82 0.00 0.00 66.70 66.67 3ly2 h VAL 310 Cb 0.17 2.25 -0.09 0.00 -1.52 0.00 0.00 31.29 32.09 3ly2 h VAL 310 CO -0.17 0.34 0.07 1.23 0.02 0.00 0.00 177.57 179.06 3ly2 h GLY 311 N -0.48 0.73 1.37 2.17 0.00 -0.86 -1.38 103.07 104.61 3ly2 h GLY 311 Ca 0.00 0.02 -0.23 0.00 0.00 0.00 0.00 47.33 47.13 3ly2 h GLY 311 CO 0.01 -0.16 -0.87 0.74 0.00 0.00 0.00 176.54 176.26 3ly2 h PHE 312 N 0.19 0.84 -0.86 5.60 0.04 -1.38 -3.28 116.94 118.10 3ly2 h PHE 312 Ca 0.32 -0.41 0.02 0.00 2.80 0.00 0.00 57.97 60.70 3ly2 h PHE 312 Cb 0.50 -0.11 -0.04 0.00 2.20 0.00 0.00 35.95 38.49 3ly2 h PHE 312 CO -0.30 1.23 0.57 -0.22 -0.60 0.00 0.00 178.31 178.99 3ly2 h LYS 313 N 0.38 1.10 0.00 1.51 1.63 -0.40 -2.08 116.57 118.70 3ly2 h LYS 313 Ca -0.07 -0.07 -0.00 0.00 -0.85 0.00 0.00 60.65 59.66 3ly2 h LYS 313 Cb 1.49 -0.25 -0.00 0.00 -0.60 0.00 0.00 32.23 32.87 3ly2 h LYS 313 CO 0.16 0.72 -0.01 -0.07 -3.45 0.00 0.00 179.45 176.81 3ly2 h LEU 314 N 1.13 0.00 -2.72 5.20 3.38 -1.34 -1.89 115.31 119.07 3ly2 h LEU 314 Ca 0.32 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.29 3ly2 h LEU 314 Cb -0.08 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.67 3ly2 h LEU 314 CO -0.08 0.01 -0.01 -0.07 0.09 0.00 0.00 178.44 178.38 3ly2 h LEU 315 N 0.00 0.00 0.00 1.67 3.38 -1.52 -1.73 115.31 117.11 3ly2 h LEU 315 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3ly2 h LEU 315 Cb 0.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.86 3ly2 h LEU 315 CO 0.00 0.01 -0.26 0.00 0.09 0.00 0.00 178.44 178.28 3ly2 n GLN 316 N -3.20 0.05 -1.42 1.13 1.13 -0.71 -2.77 117.38 111.61 3ly2 n GLN 316 Ca -0.03 0.03 -0.31 0.00 -1.94 0.00 0.00 57.00 54.75 3ly2 n GLN 316 Cb 0.11 -1.55 0.07 0.00 0.11 0.00 0.00 30.24 28.98 3ly2 n GLN 316 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 3ly2 s GLU 317 N -3.03 2.55 -0.21 -1.09 2.02 -0.65 -4.90 118.70 113.39 3ly2 s GLU 317 Ca 0.12 1.04 -0.40 0.00 0.02 0.00 0.00 54.97 55.74 3ly2 s GLU 317 Cb 0.17 -1.94 -0.17 0.00 0.10 0.00 0.00 34.13 32.29 3ly2 s GLU 317 CO 0.62 -1.40 1.58 -1.91 0.02 0.00 0.00 175.26 174.17 3ly2 n GLU 318 N -3.34 0.89 -3.16 1.61 4.07 -1.26 -1.87 120.64 117.59 3ly2 n GLU 318 Ca 0.08 0.33 -0.23 0.00 -0.06 0.00 0.00 57.16 57.28 3ly2 n GLU 318 Cb 0.53 -1.96 0.02 0.00 -0.06 0.00 0.00 31.44 29.98 3ly2 n GLU 318 CO 0.00 0.00 0.00 0.72 -0.06 0.00 0.00 177.13 177.79 3ly2 n HIS 319 N 4.21 -1.92 0.24 4.31 8.25 -1.26 -4.90 115.22 124.16 3ly2 n HIS 319 Ca 0.25 0.51 0.03 0.00 -0.26 0.00 0.00 57.72 58.24 3ly2 n HIS 319 Cb 0.11 -3.91 0.01 0.00 1.12 0.00 0.00 29.99 27.32 3ly2 n HIS 319 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3ly2 s ASP 321 N -0.76 6.46 0.00 0.00 2.15 -1.11 -4.60 116.67 118.80 3ly2 s ASP 321 Ca 0.05 -1.73 0.15 0.00 0.43 0.00 0.00 52.55 51.45 3ly2 s ASP 321 Cb 0.04 -2.57 0.73 0.00 -0.30 0.00 0.00 42.92 40.82 3ly2 s ASP 321 CO 0.11 -1.55 1.42 2.30 -0.17 0.00 0.00 175.17 177.28 3ly2 n ILE 322 N 6.84 0.66 -0.23 4.11 -5.35 -1.26 -1.94 119.36 122.18 3ly2 n ILE 322 Ca 0.39 0.16 0.06 0.00 -0.27 0.00 0.00 62.75 63.09 3ly2 n ILE 322 Cb 0.49 -0.92 0.16 0.00 -1.74 0.00 0.00 39.64 37.63 3ly2 n ILE 322 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 3ly2 n PHE 323 N -1.32 0.49 -0.32 4.28 3.72 -1.26 -4.67 117.46 118.37 3ly2 n PHE 323 Ca 0.06 -0.53 0.17 0.00 -0.05 0.00 0.00 57.45 57.11 3ly2 n PHE 323 Cb 0.13 -0.05 0.42 0.00 -0.94 0.00 0.00 39.48 39.04 3ly2 n PHE 323 CO 0.00 0.00 0.00 1.98 -0.05 0.00 0.00 176.76 178.69 3ly2 h MET 324 N 1.95 0.55 -0.62 -1.08 1.85 -1.75 -2.05 114.93 113.78 3ly2 h MET 324 Ca 0.00 -0.03 0.00 0.00 -0.61 0.00 0.00 59.70 59.06 3ly2 h MET 324 Cb 0.78 -0.12 0.00 0.00 0.43 0.00 0.00 31.60 32.69 3ly2 h MET 324 CO 0.02 0.37 0.00 0.09 -0.40 0.00 0.00 176.91 176.98 3ly2 n ASN 325 N -4.68 5.21 -4.93 1.39 3.02 -1.26 -4.91 115.26 109.10 3ly2 n ASN 325 Ca 0.23 -2.74 -0.26 0.00 -0.03 0.00 0.00 54.58 51.78 3ly2 n ASN 325 Cb 0.70 -0.65 -0.02 0.00 -0.61 0.00 0.00 39.78 39.21 3ly2 n ASN 325 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3ly2 s LEU 326 N -2.35 4.04 0.76 3.41 1.43 -0.77 -4.87 118.68 120.33 3ly2 s LEU 326 Ca 0.51 0.54 -0.11 0.00 -1.03 0.00 0.00 54.13 54.03 3ly2 s LEU 326 Cb 0.37 -3.38 0.05 0.00 0.03 0.00 0.00 46.19 43.26 3ly2 s LEU 326 CO 0.18 -0.24 1.09 0.42 0.23 0.00 0.00 176.35 178.03 3ly2 s THR 327 N -2.20 3.31 0.33 5.49 -4.23 -1.26 -4.80 115.64 112.28 3ly2 s THR 327 Ca 0.41 0.43 0.05 0.00 -1.18 0.00 0.00 61.69 61.40 3ly2 s THR 327 Cb -0.10 -3.22 0.30 0.00 1.34 0.00 0.00 72.50 70.82 3ly2 s THR 327 CO 0.34 -0.56 1.88 0.50 -0.54 0.00 0.00 174.62 176.24 3ly2 h LYS 328 N -0.94 0.80 -0.14 3.99 3.64 -1.97 -0.60 116.57 121.35 3ly2 h LYS 328 Ca -0.46 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 58.86 3ly2 h LYS 328 Cb 1.26 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 32.89 3ly2 h LYS 328 CO 0.60 0.53 0.05 -0.22 -2.27 0.00 0.00 179.45 178.14 3ly2 h LYS 329 N 0.83 0.21 -0.73 1.90 1.63 -2.00 -2.04 116.57 116.36 3ly2 h LYS 329 Ca 0.43 -0.04 -0.05 0.00 -0.85 0.00 0.00 60.65 60.14 3ly2 h LYS 329 Cb 0.52 -0.03 -0.03 0.00 -0.60 0.00 0.00 32.23 32.08 3ly2 h LYS 329 CO -0.19 0.33 0.27 1.96 -3.45 0.00 0.00 179.45 178.37 3ly2 h GLN 330 N 0.05 1.10 -0.46 1.90 4.20 -1.69 -2.51 115.11 117.69 3ly2 h GLN 330 Ca 0.04 -0.20 -0.04 0.00 0.06 0.00 0.00 58.65 58.51 3ly2 h GLN 330 Cb 0.20 -0.18 -0.02 0.00 0.30 0.00 0.00 27.48 27.79 3ly2 h GLN 330 CO -0.00 0.90 0.12 0.00 -0.67 0.00 0.00 178.83 179.18 3ly2 h ARG 331 N 1.07 0.73 -0.82 1.46 3.08 -1.01 -0.52 114.38 118.38 3ly2 h ARG 331 Ca 0.24 -0.17 -0.01 0.00 0.07 0.00 0.00 59.98 60.11 3ly2 h ARG 331 Cb 0.23 -0.10 -0.04 0.00 0.08 0.00 0.00 29.97 30.14 3ly2 h ARG 331 CO -0.02 0.72 0.46 1.96 -1.07 0.00 0.00 179.97 182.02 3ly2 h GLN 332 N 0.62 1.14 -0.18 0.04 4.20 -1.21 0.03 115.11 119.74 3ly2 h GLN 332 Ca 0.15 -0.13 -0.18 0.00 0.06 0.00 0.00 58.65 58.54 3ly2 h GLN 332 Cb 0.31 -0.23 -0.00 0.00 0.30 0.00 0.00 27.48 27.86 3ly2 h GLN 332 CO -0.00 0.83 -0.63 1.15 -0.67 0.00 0.00 178.83 179.51 3ly2 h THR 333 N 1.14 1.31 -0.53 -0.54 2.02 -1.29 -1.73 112.91 113.29 3ly2 h THR 333 Ca 0.29 -1.88 -0.07 0.00 0.77 0.00 0.00 66.41 65.52 3ly2 h THR 333 Cb 0.02 1.84 -0.02 0.00 -1.74 0.00 0.00 68.15 68.25 3ly2 h THR 333 CO -0.05 0.59 0.06 0.25 0.37 0.00 0.00 175.52 176.74 3ly2 h LEU 334 N 0.48 0.87 -0.68 2.58 6.46 -0.80 -1.99 115.31 122.23 3ly2 h LEU 334 Ca -0.01 -0.27 -0.05 0.00 -0.12 0.00 0.00 57.88 57.42 3ly2 h LEU 334 Cb 1.21 -0.23 -0.03 0.00 -0.73 0.00 0.00 40.66 40.88 3ly2 h LEU 334 CO 0.12 0.93 0.22 -0.09 -0.62 0.00 0.00 178.44 179.00 3ly2 h ARG 335 N 0.78 1.05 -0.77 1.25 2.43 -0.94 -1.16 114.38 117.03 3ly2 h ARG 335 Ca 0.16 -0.22 -0.05 0.00 -0.81 0.00 0.00 59.98 59.06 3ly2 h ARG 335 Cb 0.44 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 29.81 3ly2 h ARG 335 CO 0.02 0.91 0.30 -0.22 -1.51 0.00 0.00 179.97 179.46 3ly2 h LYS 336 N 0.99 1.14 -0.18 0.20 3.64 -1.10 -1.80 116.57 119.47 3ly2 h LYS 336 Ca 0.22 -0.21 -0.20 0.00 -1.27 0.00 0.00 60.65 59.20 3ly2 h LYS 336 Cb 0.29 -0.19 0.01 0.00 -0.41 0.00 0.00 32.23 31.93 3ly2 h LYS 336 CO -0.01 0.93 -0.65 0.52 -2.27 0.00 0.00 179.45 177.97 3ly2 h MET 337 N 1.12 0.76 -0.29 1.90 2.86 -1.11 -2.61 114.93 117.55 3ly2 h MET 337 Ca 0.26 -0.58 -0.02 0.00 -2.06 0.00 0.00 59.70 57.29 3ly2 h MET 337 Cb 0.22 0.11 -0.01 0.00 0.06 0.00 0.00 31.60 31.97 3ly2 h MET 337 CO -0.02 1.19 0.09 0.28 1.06 0.00 0.00 176.91 179.51 3ly2 h VAL 338 N 0.48 1.20 -0.55 -2.22 2.07 -1.11 0.60 116.25 116.73 3ly2 h VAL 338 Ca -0.03 -0.64 0.01 0.00 0.82 0.00 0.00 66.70 66.86 3ly2 h VAL 338 Cb 1.28 1.08 -0.03 0.00 -1.52 0.00 0.00 31.29 32.10 3ly2 h VAL 338 CO 0.14 0.21 0.36 0.40 0.02 0.00 0.00 177.57 178.70 3ly2 h ILE 339 N 0.30 1.12 -0.33 4.57 2.04 -1.40 0.84 117.51 124.65 3ly2 h ILE 339 Ca 0.09 -0.25 0.02 0.00 1.00 0.00 0.00 64.86 65.72 3ly2 h ILE 339 Cb 0.24 0.33 -0.02 0.00 -0.74 0.00 0.00 36.82 36.63 3ly2 h ILE 339 CO -0.00 0.13 0.18 -0.78 0.00 0.00 0.00 178.15 177.68 3ly2 h ASP 340 N 0.72 0.28 -0.24 1.72 1.82 -1.17 -1.59 116.42 117.97 3ly2 h ASP 340 Ca 0.21 0.01 -0.06 0.00 -0.39 0.00 0.00 57.03 56.80 3ly2 h ASP 340 Cb -0.06 -0.05 -0.01 0.00 0.68 0.00 0.00 39.33 39.90 3ly2 h ASP 340 CO -0.06 0.21 -0.07 0.24 -1.61 0.00 0.00 179.24 177.95 3ly2 h MET 341 N 0.37 0.48 -0.36 0.28 2.86 -0.35 -2.83 114.93 115.39 3ly2 h MET 341 Ca 0.13 -0.19 -0.05 0.00 -2.06 0.00 0.00 59.70 57.54 3ly2 h MET 341 Cb 0.02 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.64 3ly2 h MET 341 CO -0.08 0.71 0.02 0.28 1.06 0.00 0.00 176.91 178.90 3ly2 h VAL 342 N 0.21 1.25 0.00 -2.22 2.07 -0.78 -2.29 116.25 114.50 3ly2 h VAL 342 Ca 0.06 -0.92 -0.00 0.00 0.82 0.00 0.00 66.70 66.66 3ly2 h VAL 342 Cb 0.53 1.16 -0.00 0.00 -1.52 0.00 0.00 31.29 31.46 3ly2 h VAL 342 CO 0.03 0.31 -0.01 -0.07 0.02 0.00 0.00 177.57 177.85 3ly2 h LEU 343 N 0.43 0.00 -0.01 2.57 3.38 -1.34 -1.32 115.31 119.02 3ly2 h LEU 343 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 3ly2 h LEU 343 Cb 0.42 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.17 3ly2 h LEU 343 CO 0.01 0.01 0.00 0.00 0.09 0.00 0.00 178.44 178.55 3ly2 n ALA 344 N -2.11 2.28 1.34 1.53 0.00 -0.86 -3.18 120.51 119.51 3ly2 n ALA 344 Ca -0.02 -0.06 0.15 0.00 0.00 0.00 0.00 53.44 53.50 3ly2 n ALA 344 Cb 0.12 -1.46 0.73 0.00 0.00 0.00 0.00 19.45 18.84 3ly2 n ALA 344 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3ly2 n THR 345 N -1.84 0.01 -2.25 0.00 -2.24 -0.50 -4.72 114.28 102.75 3ly2 n THR 345 Ca 0.06 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.42 3ly2 n THR 345 Cb 0.37 -0.51 -0.02 0.00 -2.10 0.00 0.00 70.33 68.07 3ly2 n THR 345 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3ly2 s ASP 346 N -2.64 6.45 0.61 3.42 2.15 -1.19 -4.88 116.67 120.58 3ly2 s ASP 346 Ca 0.26 1.36 0.29 0.00 0.43 0.00 0.00 52.55 54.88 3ly2 s ASP 346 Cb 0.20 -2.54 1.51 0.00 -0.30 0.00 0.00 42.92 41.79 3ly2 s ASP 346 CO 0.47 -1.24 1.90 0.24 -0.17 0.00 0.00 175.17 176.37 3ly2 h MET 347 N 10.32 0.00 0.00 4.34 2.86 -1.92 -0.30 114.93 130.23 3ly2 h MET 347 Ca -0.30 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.34 3ly2 h MET 347 Cb 1.13 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.79 3ly2 h MET 347 CO 1.02 0.00 0.00 0.66 1.06 0.00 0.00 176.91 179.65 3ly2 h SER 348 N 0.00 0.00 -0.28 1.22 4.64 -1.95 -0.59 113.55 116.58 3ly2 h SER 348 Ca 0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 3ly2 h SER 348 Cb 1.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.10 3ly2 h SER 348 CO -0.00 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.25 3ly2 n LYS 349 N -2.30 2.39 -0.01 4.77 5.02 -0.12 -4.63 118.16 123.28 3ly2 n LYS 349 Ca -0.00 -2.15 -0.09 0.00 -2.02 0.00 0.00 58.31 54.04 3ly2 n LYS 349 Cb 0.12 -1.48 -0.03 0.00 -0.02 0.00 0.00 35.03 33.62 3ly2 n LYS 349 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 3ly2 h HIS 350 N 4.39 -0.41 -0.38 2.13 2.76 -1.22 -1.17 115.15 121.24 3ly2 h HIS 350 Ca 0.00 0.02 0.05 0.00 -2.20 0.00 0.00 60.37 58.25 3ly2 h HIS 350 Cb 0.97 0.20 -0.05 0.00 1.55 0.00 0.00 27.41 30.08 3ly2 h HIS 350 CO 0.18 -0.23 0.10 0.52 -1.30 0.00 0.00 177.93 177.19 3ly2 h MET 351 N -0.19 0.22 -0.63 5.26 2.86 -1.82 -0.99 114.93 119.64 3ly2 h MET 351 Ca 0.10 -0.01 0.04 0.00 -2.06 0.00 0.00 59.70 57.76 3ly2 h MET 351 Cb 0.34 -0.05 -0.04 0.00 0.06 0.00 0.00 31.60 31.90 3ly2 h MET 351 CO -0.26 0.15 0.37 1.03 1.06 0.00 0.00 176.91 179.26 3ly2 h SER 352 N 0.23 0.58 -0.46 1.22 0.87 -1.81 -1.73 113.55 112.46 3ly2 h SER 352 Ca 0.18 0.01 -0.02 0.00 -1.23 0.00 0.00 61.79 60.73 3ly2 h SER 352 Cb 0.20 -0.11 -0.02 0.00 -0.44 0.00 0.00 62.40 62.03 3ly2 h SER 352 CO -0.22 0.40 0.20 0.25 -0.53 0.00 0.00 176.83 176.93 3ly2 h LEU 353 N 0.71 0.62 -0.82 2.23 5.85 -0.59 -2.79 115.31 120.52 3ly2 h LEU 353 Ca 0.26 -0.15 -0.05 0.00 0.84 0.00 0.00 57.88 58.79 3ly2 h LEU 353 Cb 0.08 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 40.92 3ly2 h LEU 353 CO -0.13 0.60 0.29 0.25 -0.34 0.00 0.00 178.44 179.10 3ly2 h LEU 354 N 0.60 1.08 -0.25 2.25 5.85 -0.90 -1.86 115.31 122.09 3ly2 h LEU 354 Ca 0.16 -0.18 0.02 0.00 0.84 0.00 0.00 57.88 58.72 3ly2 h LEU 354 Cb 0.15 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 40.88 3ly2 h LEU 354 CO -0.02 0.97 0.11 0.00 -0.34 0.00 0.00 178.44 179.16 3ly2 h ALA 355 N 1.18 0.29 -0.24 1.25 0.00 -1.15 -1.10 119.26 119.49 3ly2 h ALA 355 Ca 0.25 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 3ly2 h ALA 355 Cb 0.24 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 3ly2 h ALA 355 CO -0.02 -0.30 0.11 -0.44 0.00 0.00 0.00 179.25 178.60 3ly2 h ASP 356 N 0.24 0.32 -0.99 0.00 3.45 -1.30 -1.42 116.42 116.72 3ly2 h ASP 356 Ca 0.10 -0.14 0.08 0.00 0.43 0.00 0.00 57.03 57.50 3ly2 h ASP 356 Cb 0.05 -0.08 -0.07 0.00 -0.56 0.00 0.00 39.33 38.66 3ly2 h ASP 356 CO -0.08 0.37 0.63 0.25 -1.57 0.00 0.00 179.24 178.83 3ly2 h LEU 357 N 0.24 0.99 -0.78 1.55 5.85 -1.11 0.23 115.31 122.29 3ly2 h LEU 357 Ca 0.08 0.02 -0.08 0.00 0.84 0.00 0.00 57.88 58.74 3ly2 h LEU 357 Cb 0.14 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 40.96 3ly2 h LEU 357 CO -0.01 0.61 0.03 0.11 -0.34 0.00 0.00 178.44 178.84 3ly2 h LYS 358 N 1.12 0.96 0.00 1.25 1.57 -0.90 -0.41 116.57 120.15 3ly2 h LYS 358 Ca 0.44 -0.27 -0.03 0.00 -1.87 0.00 0.00 60.65 58.92 3ly2 h LYS 358 Cb 0.23 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 32.43 3ly2 h LYS 358 CO -0.19 0.93 -0.16 1.15 -0.57 0.00 0.00 179.45 180.61 3ly2 h THR 359 N 0.89 0.50 -0.01 -0.16 2.02 0.04 -1.37 112.91 114.81 3ly2 h THR 359 Ca 0.17 -0.80 -0.04 0.00 0.77 0.00 0.00 66.41 66.51 3ly2 h THR 359 Cb 0.48 1.55 0.00 0.00 -1.74 0.00 0.00 68.15 68.44 3ly2 h THR 359 CO 0.02 0.15 -0.16 -0.03 0.37 0.00 0.00 175.52 175.88 3ly2 h MET 360 N 0.00 0.12 -0.92 6.66 -1.53 0.58 -3.10 114.93 116.73 3ly2 h MET 360 Ca -0.00 -0.12 0.00 0.00 -3.44 0.00 0.00 59.70 56.14 3ly2 h MET 360 Cb 0.53 0.03 -0.05 0.00 -0.55 0.00 0.00 31.60 31.57 3ly2 h MET 360 CO 0.02 0.86 0.58 0.28 0.14 0.00 0.00 176.91 178.79 3ly2 h VAL 361 N -0.57 1.25 -0.09 -5.77 2.07 -0.85 -0.73 116.25 111.55 3ly2 h VAL 361 Ca -0.02 -0.50 -0.03 0.00 0.82 0.00 0.00 66.70 66.96 3ly2 h VAL 361 Cb 0.91 -0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 30.59 3ly2 h VAL 361 CO 0.03 0.25 -0.10 -0.33 0.02 0.00 0.00 177.57 177.44 3ly2 h GLU 362 N 1.27 0.14 -0.12 1.57 5.08 -1.32 -3.06 114.58 118.13 3ly2 h GLU 362 Ca 0.33 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.67 3ly2 h GLU 362 Cb -0.09 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.14 3ly2 h GLU 362 CO -0.07 0.25 0.00 0.25 -1.00 0.00 0.00 179.01 178.44 3ly2 n THR 363 N -4.34 2.07 -2.07 1.13 -2.24 -0.94 -5.05 114.28 102.84 3ly2 n THR 363 Ca -0.01 -2.08 -0.37 0.00 -2.27 0.00 0.00 64.05 59.32 3ly2 n THR 363 Cb 0.22 -0.24 0.02 0.00 -2.10 0.00 0.00 70.33 68.22 3ly2 n THR 363 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 3ly2 s LYS 364 N -2.85 3.28 -0.15 -0.78 -2.85 -0.32 -5.02 119.74 111.05 3ly2 s LYS 364 Ca 0.37 1.87 0.01 0.00 -1.00 0.00 0.00 55.97 57.22 3ly2 s LYS 364 Cb 0.31 -2.14 0.02 0.00 -2.06 0.00 0.00 37.83 33.95 3ly2 s LYS 364 CO 0.06 -0.97 -0.17 0.15 0.10 0.00 0.00 175.35 174.52 3ly2 s LYS 365 N -3.05 2.61 -0.09 1.78 1.02 -1.26 -5.06 119.74 115.68 3ly2 s LYS 365 Ca 0.72 -0.69 -0.01 0.00 0.02 0.00 0.00 55.97 56.01 3ly2 s LYS 365 Cb -0.31 -2.26 -0.03 0.00 -0.52 0.00 0.00 37.83 34.71 3ly2 s LYS 365 CO 0.36 -0.16 -0.04 0.54 -0.92 0.00 0.00 175.35 175.13 3ly2 s VAL 366 N 1.24 3.96 0.87 3.17 0.11 -1.26 -0.02 120.40 128.47 3ly2 s VAL 366 Ca 0.01 -0.37 -0.11 0.00 -2.93 0.00 0.00 61.98 58.58 3ly2 s VAL 366 Cb -0.14 -2.66 0.11 0.00 -1.53 0.00 0.00 36.38 32.17 3ly2 s VAL 366 CO -0.08 0.58 1.09 0.42 -3.33 0.00 0.00 175.10 173.78 3ly2 s THR 367 N -0.60 2.77 0.53 5.04 -4.23 0.11 -4.89 115.64 114.37 3ly2 s THR 367 Ca 0.09 0.25 0.29 0.00 -1.18 0.00 0.00 61.69 61.14 3ly2 s THR 367 Cb -0.12 -2.77 0.45 0.00 1.34 0.00 0.00 72.50 71.40 3ly2 s THR 367 CO 0.02 -0.33 1.94 0.77 -0.54 0.00 0.00 174.62 176.48 3ly2 h SER 368 N -1.45 0.00 0.16 3.99 4.64 -2.00 -1.42 113.55 117.48 3ly2 h SER 368 Ca -0.49 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.83 3ly2 h SER 368 Cb 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 3ly2 h SER 368 CO 0.55 0.00 -0.08 0.28 -0.87 0.00 0.00 176.83 176.71 3ly2 h SER 369 N 0.00 -0.19 0.00 4.97 0.02 -2.04 -3.47 113.55 112.85 3ly2 h SER 369 Ca 0.35 -0.22 0.00 0.00 -0.84 0.00 0.00 61.79 61.08 3ly2 h SER 369 Cb 1.40 0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.99 3ly2 h SER 369 CO -0.00 0.12 0.00 0.61 -1.14 0.00 0.00 176.83 176.42 3ly2 n GLY 370 N -0.39 -0.81 3.86 -3.77 0.00 -0.53 -5.14 105.19 98.40 3ly2 n GLY 370 Ca -0.09 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.61 3ly2 n GLY 370 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ly2 s VAL 371 N -0.17 4.80 0.53 1.61 1.01 -1.26 -4.72 120.40 122.21 3ly2 s VAL 371 Ca 0.00 0.70 -0.19 0.00 0.00 0.00 0.00 61.98 62.49 3ly2 s VAL 371 Cb 0.00 -3.63 -0.06 0.00 0.00 0.00 0.00 36.38 32.68 3ly2 s VAL 371 CO 0.00 -0.19 1.07 -0.76 0.00 0.00 0.00 175.10 175.21 3ly2 s LEU 372 N -3.06 3.72 -0.32 3.92 1.43 0.94 0.04 118.68 125.35 3ly2 s LEU 372 Ca 0.51 1.96 0.03 0.00 -1.03 0.00 0.00 54.13 55.59 3ly2 s LEU 372 Cb -0.11 -4.56 0.09 0.00 0.03 0.00 0.00 46.19 41.64 3ly2 s LEU 372 CO 0.21 -1.01 0.02 -0.22 0.23 0.00 0.00 176.35 175.59 3ly2 s LEU 373 N -3.86 4.42 -0.53 1.79 2.96 0.97 -4.75 118.68 119.69 3ly2 s LEU 373 Ca 0.68 -1.89 -0.07 0.00 -0.22 0.00 0.00 54.13 52.63 3ly2 s LEU 373 Cb -0.18 -1.64 0.14 0.00 0.50 0.00 0.00 46.19 45.01 3ly2 s LEU 373 CO 0.26 -0.34 0.38 -0.76 -1.32 0.00 0.00 176.35 174.57 3ly2 s LEU 374 N 1.00 5.61 0.00 -0.68 1.43 -1.26 -4.47 118.68 120.32 3ly2 s LEU 374 Ca 0.04 -2.22 0.00 0.00 -1.03 0.00 0.00 54.13 50.93 3ly2 s LEU 374 Cb -0.20 -1.96 0.00 0.00 0.03 0.00 0.00 46.19 44.06 3ly2 s LEU 374 CO -0.06 -0.58 0.35 0.47 0.23 0.00 0.00 176.35 176.75 3ly2 n ASP 375 N 4.45 0.00 -4.27 2.29 9.92 -1.26 -4.83 116.55 122.85 3ly2 n ASP 375 Ca -0.01 0.35 -0.27 0.00 -0.53 0.00 0.00 54.79 54.32 3ly2 n ASP 375 Cb 0.41 0.00 0.17 0.00 -0.64 0.00 0.00 41.12 41.05 3ly2 n ASP 375 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 3ly2 s ASN 376 N -2.19 3.44 0.08 -2.24 2.20 -1.26 -4.98 114.94 110.00 3ly2 s ASN 376 Ca 0.00 -0.06 -0.21 0.00 -0.94 0.00 0.00 52.86 51.65 3ly2 s ASN 376 Cb 0.00 -0.05 -0.11 0.00 -2.00 0.00 0.00 41.25 39.09 3ly2 s ASN 376 CO 0.00 -2.49 1.62 0.22 -2.94 0.00 0.00 177.10 173.50 3ly2 h TYR 377 N -1.27 0.22 -0.98 1.54 3.20 -2.00 -2.98 116.97 114.70 3ly2 h TYR 377 Ca -0.41 -0.02 0.28 0.00 3.14 0.00 0.00 58.73 61.73 3ly2 h TYR 377 Cb 1.24 -0.06 -0.14 0.00 1.54 0.00 0.00 36.73 39.30 3ly2 h TYR 377 CO -0.92 0.30 0.52 1.15 -1.64 0.00 0.00 178.16 177.57 3ly2 h THR 378 N 0.07 0.39 0.10 1.81 2.02 -1.99 0.14 112.91 115.44 3ly2 h THR 378 Ca 0.05 -0.14 -0.26 0.00 0.77 0.00 0.00 66.41 66.83 3ly2 h THR 378 Cb 0.17 -0.04 -0.00 0.00 -1.74 0.00 0.00 68.15 66.54 3ly2 h THR 378 CO -0.00 0.07 -1.17 0.44 0.37 0.00 0.00 175.52 175.23 3ly2 h ASP 379 N 0.40 0.38 -0.05 4.18 3.32 -1.94 -3.02 116.42 119.69 3ly2 h ASP 379 Ca 0.67 -0.39 -0.03 0.00 0.02 0.00 0.00 57.03 57.31 3ly2 h ASP 379 Cb 1.42 -0.12 -0.00 0.00 0.22 0.00 0.00 39.33 40.85 3ly2 h ASP 379 CO -0.56 1.28 -0.07 0.03 -1.72 0.00 0.00 179.24 178.20 3ly2 h ARG 380 N 0.08 0.13 -0.30 3.56 3.08 -0.84 -2.69 114.38 117.41 3ly2 h ARG 380 Ca -0.11 -0.08 -0.05 0.00 0.07 0.00 0.00 59.98 59.82 3ly2 h ARG 380 Cb 1.89 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 31.93 3ly2 h ARG 380 CO 0.19 0.62 -0.01 0.97 -1.07 0.00 0.00 179.97 180.66 3ly2 h ILE 381 N -0.34 1.19 -0.50 2.04 6.09 -0.97 -0.89 117.51 124.12 3ly2 h ILE 381 Ca 0.01 -0.75 -0.04 0.00 -1.37 0.00 0.00 64.86 62.71 3ly2 h ILE 381 Cb 0.60 0.98 -0.02 0.00 0.47 0.00 0.00 36.82 38.85 3ly2 h ILE 381 CO 0.02 0.25 0.15 -0.61 -3.07 0.00 0.00 178.15 174.89 3ly2 h GLN 382 N 0.45 0.74 -0.02 2.19 4.15 -1.51 0.05 115.11 121.15 3ly2 h GLN 382 Ca 0.10 -0.13 -0.22 0.00 0.77 0.00 0.00 58.65 59.17 3ly2 h GLN 382 Cb 0.32 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 27.89 3ly2 h GLN 382 CO 0.01 0.64 -0.90 0.28 -1.93 0.00 0.00 178.83 176.93 3ly2 h VAL 383 N 0.72 1.38 -0.27 2.39 2.07 -0.98 -3.02 116.25 118.55 3ly2 h VAL 383 Ca 0.17 -2.35 -0.12 0.00 0.82 0.00 0.00 66.70 65.22 3ly2 h VAL 383 Cb 0.22 2.34 -0.01 0.00 -1.52 0.00 0.00 31.29 32.31 3ly2 h VAL 383 CO -0.01 0.71 -0.32 -0.07 0.02 0.00 0.00 177.57 177.90 3ly2 h LEU 384 N 0.27 0.58 -0.03 2.57 3.38 -0.60 -1.06 115.31 120.42 3ly2 h LEU 384 Ca -0.07 -0.23 -0.00 0.00 0.09 0.00 0.00 57.88 57.67 3ly2 h LEU 384 Cb 1.53 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 42.12 3ly2 h LEU 384 CO 0.16 0.86 0.01 0.03 0.09 0.00 0.00 178.44 179.59 3ly2 h ARG 385 N 0.48 0.04 0.00 1.13 3.08 -1.02 -1.82 114.38 116.27 3ly2 h ARG 385 Ca 0.06 -0.01 -0.05 0.00 0.07 0.00 0.00 59.98 60.05 3ly2 h ARG 385 Cb 0.79 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.83 3ly2 h ARG 385 CO 0.06 0.19 -0.22 -0.91 -1.07 0.00 0.00 179.97 178.02 3ly2 h ASN 386 N -0.12 0.00 0.18 7.04 2.35 -1.47 -0.58 115.58 122.98 3ly2 h ASN 386 Ca 0.01 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.75 3ly2 h ASN 386 Cb 0.17 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.54 3ly2 h ASN 386 CO -0.00 0.22 -0.09 -0.03 -1.65 0.00 0.00 177.43 175.89 3ly2 h MET 387 N 0.00 -0.23 -0.72 0.81 4.05 -0.79 0.16 114.93 118.21 3ly2 h MET 387 Ca -0.00 0.02 -0.03 0.00 -0.28 0.00 0.00 59.70 59.40 3ly2 h MET 387 Cb 0.44 0.05 -0.03 0.00 -0.80 0.00 0.00 31.60 31.26 3ly2 h MET 387 CO 0.03 0.09 0.33 0.28 0.23 0.00 0.00 176.91 177.88 3ly2 h VAL 388 N -0.57 1.23 -0.63 -5.77 2.07 -1.16 -0.65 116.25 110.78 3ly2 h VAL 388 Ca -0.02 -0.67 -0.02 0.00 0.82 0.00 0.00 66.70 66.81 3ly2 h VAL 388 Cb 0.43 0.32 -0.03 0.00 -1.52 0.00 0.00 31.29 30.49 3ly2 h VAL 388 CO 0.04 0.28 0.31 -0.74 0.02 0.00 0.00 177.57 177.48 3ly2 h HIS 389 N 1.03 0.90 -0.62 1.57 6.17 -0.98 0.37 115.15 123.59 3ly2 h HIS 389 Ca 0.25 -0.04 -0.08 0.00 0.71 0.00 0.00 60.37 61.21 3ly2 h HIS 389 Cb 0.12 -0.28 -0.02 0.00 2.52 0.00 0.00 27.41 29.75 3ly2 h HIS 389 CO 0.01 0.67 0.07 0.00 0.71 0.00 0.00 177.93 179.39 3ly2 h ALA 391 N 1.10 0.97 -0.24 0.00 0.00 -0.62 -0.92 119.26 119.56 3ly2 h ALA 391 Ca 0.19 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 3ly2 h ALA 391 Cb 0.46 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 3ly2 h ALA 391 CO 0.02 0.57 -0.01 0.22 0.00 0.00 0.00 179.25 180.05 3ly2 h ASP 392 N 1.07 0.32 -0.80 0.00 -0.00 -0.53 -2.51 116.42 113.97 3ly2 h ASP 392 Ca 0.25 -0.05 -0.47 0.00 -0.00 0.00 0.00 57.03 56.76 3ly2 h ASP 392 Cb 0.18 -0.08 -0.26 0.00 -0.00 0.00 0.00 39.33 39.16 3ly2 h ASP 392 CO -0.02 0.39 0.38 0.18 -0.00 0.00 0.00 179.24 180.16 3ly2 n LEU 393 N -4.33 6.13 -0.57 2.28 4.77 -0.64 -4.62 117.00 120.01 3ly2 n LEU 393 Ca 0.00 -3.94 0.13 0.00 -0.03 0.00 0.00 56.01 52.17 3ly2 n LEU 393 Cb 0.21 -0.78 0.27 0.00 -2.33 0.00 0.00 43.42 40.79 3ly2 n LEU 393 CO 0.37 1.32 0.65 -1.54 -1.33 0.00 0.00 177.39 176.86 3ly2 n SER 394 N -1.05 1.93 -0.09 -1.43 3.41 -0.43 -4.51 113.62 111.46 3ly2 n SER 394 Ca 0.52 -1.52 -0.06 0.00 -0.26 0.00 0.00 58.87 57.55 3ly2 n SER 394 Cb 1.18 0.12 -0.00 0.00 -0.26 0.00 0.00 64.21 65.25 3ly2 n SER 394 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 3ly2 h ASN 395 N 2.80 -0.66 0.27 4.04 -0.26 -1.82 -0.92 115.58 119.03 3ly2 h ASN 395 Ca 0.00 0.14 0.00 0.00 -0.56 0.00 0.00 56.30 55.88 3ly2 h ASN 395 Cb 0.69 0.34 0.00 0.00 -1.06 0.00 0.00 38.32 38.29 3ly2 h ASN 395 CO 0.00 -0.23 0.00 -2.65 -1.06 0.00 0.00 177.43 173.49 3ly2 n PRO 396 N -5.36 0.07 -0.40 0.81 -0.02 -1.26 -2.21 135.00 126.63 3ly2 n PRO 396 Ca 0.01 0.26 0.10 0.00 -2.02 0.00 0.00 63.50 61.85 3ly2 n PRO 396 Cb 0.28 -1.50 0.31 0.00 -0.02 0.00 0.00 33.50 32.56 3ly2 n PRO 396 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 3ly2 n THR 397 N -1.39 1.20 -3.20 3.45 -2.24 -0.36 -4.19 114.28 107.54 3ly2 n THR 397 Ca 0.04 -1.06 -0.20 0.00 -2.27 0.00 0.00 64.05 60.56 3ly2 n THR 397 Cb 0.10 0.41 0.04 0.00 -2.10 0.00 0.00 70.33 68.78 3ly2 n THR 397 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3ly2 s LYS 398 N -1.21 2.39 0.45 -0.78 -0.14 -0.94 -4.75 119.74 114.77 3ly2 s LYS 398 Ca 0.46 -1.64 -0.25 0.00 -1.36 0.00 0.00 55.97 53.18 3ly2 s LYS 398 Cb 0.26 -2.56 -0.09 0.00 -1.68 0.00 0.00 37.83 33.76 3ly2 s LYS 398 CO 0.29 -0.69 1.35 -1.13 -0.76 0.00 0.00 175.35 174.41 3ly2 n SER 399 N -2.07 2.90 -0.32 2.83 3.41 -1.26 -4.61 113.62 114.50 3ly2 n SER 399 Ca 0.11 1.10 0.27 0.00 -0.26 0.00 0.00 58.87 60.09 3ly2 n SER 399 Cb 0.62 -1.55 0.58 0.00 -0.26 0.00 0.00 64.21 63.60 3ly2 n SER 399 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 3ly2 h LEU 400 N 2.11 0.31 -0.70 1.04 5.85 -1.95 0.21 115.31 122.19 3ly2 h LEU 400 Ca -0.49 0.06 -0.02 0.00 0.84 0.00 0.00 57.88 58.27 3ly2 h LEU 400 Cb 1.28 0.02 -0.03 0.00 0.37 0.00 0.00 40.66 42.30 3ly2 h LEU 400 CO 0.60 0.05 0.36 -0.08 -0.34 0.00 0.00 178.44 179.03 3ly2 h GLU 401 N 0.27 0.98 0.01 1.25 4.81 -2.00 -0.53 114.58 119.37 3ly2 h GLU 401 Ca 0.59 -0.13 -0.00 0.00 -0.13 0.00 0.00 59.36 59.69 3ly2 h GLU 401 Cb 1.75 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 30.95 3ly2 h GLU 401 CO -0.22 0.76 -0.00 -0.07 -0.73 0.00 0.00 179.01 178.74 3ly2 h LEU 402 N 0.96 -0.01 -1.29 1.64 3.38 -1.02 -3.27 115.31 115.71 3ly2 h LEU 402 Ca 0.24 -0.71 0.14 0.00 0.09 0.00 0.00 57.88 57.64 3ly2 h LEU 402 Cb 0.08 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.76 3ly2 h LEU 402 CO -0.03 0.72 0.57 0.22 0.09 0.00 0.00 178.44 180.01 3ly2 h TYR 403 N -0.74 0.82 0.00 1.13 3.20 -0.93 -0.18 116.97 120.26 3ly2 h TYR 403 Ca -0.00 0.02 -0.06 0.00 3.14 0.00 0.00 58.73 61.83 3ly2 h TYR 403 Cb 0.72 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 38.73 3ly2 h TYR 403 CO 0.18 0.31 -0.28 0.00 -1.64 0.00 0.00 178.16 176.73 3ly2 h ARG 404 N 0.70 0.00 0.11 1.82 3.08 -1.18 -1.77 114.38 117.14 3ly2 h ARG 404 Ca 0.44 0.00 -0.26 0.00 0.07 0.00 0.00 59.98 60.23 3ly2 h ARG 404 Cb 0.71 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.76 3ly2 h ARG 404 CO -0.20 0.28 -1.19 1.96 -1.07 0.00 0.00 179.97 179.74 3ly2 h GLN 405 N 0.00 0.26 -0.41 0.04 4.20 -1.11 -2.74 115.11 115.36 3ly2 h GLN 405 Ca -0.00 -0.42 -0.11 0.00 0.06 0.00 0.00 58.65 58.18 3ly2 h GLN 405 Cb 0.70 0.15 -0.02 0.00 0.30 0.00 0.00 27.48 28.62 3ly2 h GLN 405 CO 0.04 1.19 -0.17 -1.49 -0.67 0.00 0.00 178.83 177.72 3ly2 h TRP 406 N 0.08 0.86 -0.45 2.96 -0.00 -1.08 -2.43 115.95 115.88 3ly2 h TRP 406 Ca -0.12 -0.18 -0.09 0.00 -0.00 0.00 0.00 58.89 58.51 3ly2 h TRP 406 Cb 1.92 -0.21 -0.02 0.00 -0.00 0.00 0.00 29.16 30.85 3ly2 h TRP 406 CO 0.06 0.89 -0.05 1.15 -0.00 0.00 0.00 178.44 180.48 3ly2 h THR 407 N 0.69 1.27 -0.33 1.49 2.02 -1.34 -1.36 112.91 115.35 3ly2 h THR 407 Ca 0.10 -1.14 0.02 0.00 0.77 0.00 0.00 66.41 66.16 3ly2 h THR 407 Cb 0.67 1.10 -0.02 0.00 -1.74 0.00 0.00 68.15 68.15 3ly2 h THR 407 CO 0.05 0.39 0.18 0.44 0.37 0.00 0.00 175.52 176.95 3ly2 h ASP 408 N 0.67 0.29 -0.05 4.18 3.32 -1.33 -1.86 116.42 121.64 3ly2 h ASP 408 Ca 0.12 0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.18 3ly2 h ASP 408 Cb 0.57 -0.05 -0.00 0.00 0.22 0.00 0.00 39.33 40.07 3ly2 h ASP 408 CO 0.03 0.21 0.03 0.03 -1.72 0.00 0.00 179.24 177.82 3ly2 h ARG 409 N 0.38 0.07 -0.43 3.56 3.08 -1.31 -0.55 114.38 119.17 3ly2 h ARG 409 Ca 0.13 -0.01 -0.02 0.00 0.07 0.00 0.00 59.98 60.16 3ly2 h ARG 409 Cb 0.02 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.03 3ly2 h ARG 409 CO -0.07 0.12 0.19 0.97 -1.07 0.00 0.00 179.97 180.11 3ly2 h ILE 410 N -0.01 1.15 -0.14 2.04 6.09 -1.14 -1.03 117.51 124.48 3ly2 h ILE 410 Ca 0.02 -0.46 -0.19 0.00 -1.37 0.00 0.00 64.86 62.86 3ly2 h ILE 410 Cb 0.07 0.62 -0.00 0.00 0.47 0.00 0.00 36.82 37.99 3ly2 h ILE 410 CO -0.00 0.18 -0.68 0.24 -3.07 0.00 0.00 178.15 174.82 3ly2 h MET 411 N 0.60 0.55 -0.61 2.19 2.86 -1.12 -2.34 114.93 117.06 3ly2 h MET 411 Ca 0.15 -0.41 -0.03 0.00 -2.06 0.00 0.00 59.70 57.34 3ly2 h MET 411 Cb 0.09 0.07 -0.03 0.00 0.06 0.00 0.00 31.60 31.80 3ly2 h MET 411 CO -0.02 1.04 0.25 1.49 1.06 0.00 0.00 176.91 180.73 3ly2 h GLU 412 N 0.39 0.92 -0.68 1.72 4.81 -0.40 -1.18 114.58 120.17 3ly2 h GLU 412 Ca -0.02 -0.17 -0.06 0.00 -0.13 0.00 0.00 59.36 58.98 3ly2 h GLU 412 Cb 1.26 -0.15 -0.03 0.00 0.63 0.00 0.00 28.75 30.46 3ly2 h GLU 412 CO 0.13 0.78 0.20 1.49 -0.73 0.00 0.00 179.01 180.87 3ly2 h GLU 413 N 0.86 1.07 -0.68 1.92 4.81 -1.15 -1.08 114.58 120.33 3ly2 h GLU 413 Ca 0.20 -0.24 -0.02 0.00 -0.13 0.00 0.00 59.36 59.17 3ly2 h GLU 413 Cb 0.20 -0.15 -0.03 0.00 0.63 0.00 0.00 28.75 29.40 3ly2 h GLU 413 CO -0.02 0.93 0.33 0.74 -0.73 0.00 0.00 179.01 180.27 3ly2 h PHE 414 N 1.00 0.97 -0.14 0.92 0.04 -1.04 -1.57 116.94 117.12 3ly2 h PHE 414 Ca 0.22 -0.04 -0.06 0.00 2.80 0.00 0.00 57.97 60.88 3ly2 h PHE 414 Cb 0.32 -0.30 -0.01 0.00 2.20 0.00 0.00 35.95 38.16 3ly2 h PHE 414 CO 0.02 0.72 -0.19 0.74 -0.60 0.00 0.00 178.31 179.00 3ly2 h PHE 415 N 0.94 0.26 -0.73 -0.55 0.04 -0.87 -1.57 116.94 114.45 3ly2 h PHE 415 Ca 0.23 -0.04 -0.06 0.00 2.80 0.00 0.00 57.97 60.90 3ly2 h PHE 415 Cb 0.11 -0.07 -0.03 0.00 2.20 0.00 0.00 35.95 38.16 3ly2 h PHE 415 CO 0.00 0.43 0.21 1.96 -0.60 0.00 0.00 178.31 180.31 3ly2 h GLN 416 N 0.22 1.15 -0.62 1.51 4.20 -0.35 -1.12 115.11 120.11 3ly2 h GLN 416 Ca 0.04 -0.26 -0.08 0.00 0.06 0.00 0.00 58.65 58.42 3ly2 h GLN 416 Cb 0.48 -0.16 -0.03 0.00 0.30 0.00 0.00 27.48 28.07 3ly2 h GLN 416 CO 0.03 0.99 0.08 0.37 -0.67 0.00 0.00 178.83 179.64 3ly2 h GLN 417 N 1.10 1.01 -0.94 1.46 4.15 -0.59 -1.78 115.11 119.52 3ly2 h GLN 417 Ca 0.23 -0.27 0.04 0.00 0.77 0.00 0.00 58.65 59.42 3ly2 h GLN 417 Cb 0.34 -0.12 -0.06 0.00 0.21 0.00 0.00 27.48 27.85 3ly2 h GLN 417 CO -0.00 0.94 0.61 0.78 -1.93 0.00 0.00 178.83 179.23 3ly2 h GLY 418 N 1.03 1.38 0.94 2.39 0.00 -0.68 0.18 103.07 108.32 3ly2 h GLY 418 Ca 0.19 -0.47 -0.01 0.00 0.00 0.00 0.00 47.33 47.04 3ly2 h GLY 418 CO 0.01 0.39 0.15 -0.55 0.00 0.00 0.00 176.54 176.54 3ly2 h ASP 419 N 1.18 0.38 -0.88 0.19 3.32 -0.66 -1.24 116.42 118.71 3ly2 h ASP 419 Ca 0.38 -0.11 -0.02 0.00 0.02 0.00 0.00 57.03 57.30 3ly2 h ASP 419 Cb 0.02 -0.10 -0.04 0.00 0.22 0.00 0.00 39.33 39.43 3ly2 h ASP 419 CO -0.13 0.39 0.48 0.11 -1.72 0.00 0.00 179.24 178.37 3ly2 h LYS 420 N 0.35 1.24 -0.70 3.56 1.57 -0.55 -0.96 116.57 121.07 3ly2 h LYS 420 Ca 0.10 -0.15 -0.04 0.00 -1.87 0.00 0.00 60.65 58.69 3ly2 h LYS 420 Cb 0.10 -0.24 -0.03 0.00 0.08 0.00 0.00 32.23 32.14 3ly2 h LYS 420 CO -0.01 0.91 0.28 0.93 -0.57 0.00 0.00 179.45 180.98 3ly2 h GLU 421 N 1.24 1.04 -0.38 3.15 5.08 -0.37 -1.68 114.58 122.65 3ly2 h GLU 421 Ca 0.31 -0.19 -0.02 0.00 -1.00 0.00 0.00 59.36 58.46 3ly2 h GLU 421 Cb 0.04 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.10 3ly2 h GLU 421 CO -0.05 0.86 0.14 -0.09 -1.00 0.00 0.00 179.01 178.87 3ly2 h ARG 422 N 0.99 0.58 -0.74 2.33 2.43 -0.78 0.59 114.38 119.77 3ly2 h ARG 422 Ca 0.23 -0.11 0.01 0.00 -0.81 0.00 0.00 59.98 59.30 3ly2 h ARG 422 Cb 0.21 -0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 29.63 3ly2 h ARG 422 CO -0.02 0.56 0.49 0.93 -1.51 0.00 0.00 179.97 180.42 3ly2 h GLU 423 N 0.47 0.98 -0.26 0.20 5.08 -0.87 -1.50 114.58 118.67 3ly2 h GLU 423 Ca 0.13 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 3ly2 h GLU 423 Cb 0.21 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.24 3ly2 h GLU 423 CO -0.01 0.65 0.00 0.54 -1.00 0.00 0.00 179.01 179.19 3ly2 n ARG 424 N -4.42 1.62 -1.59 2.33 1.74 -0.66 -4.90 116.66 110.78 3ly2 n ARG 424 Ca 0.08 -0.96 -0.07 0.00 -0.77 0.00 0.00 57.85 56.13 3ly2 n ARG 424 Cb 0.03 -1.23 -0.02 0.00 -1.02 0.00 0.00 32.46 30.23 3ly2 n ARG 424 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3ly2 n GLY 425 N 0.95 0.56 3.96 -0.13 0.00 -0.57 -5.04 105.19 104.91 3ly2 n GLY 425 Ca 0.10 -0.69 -0.23 0.00 0.00 0.00 0.00 46.02 45.21 3ly2 n GLY 425 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3ly2 s MET 426 N -3.32 3.44 0.29 1.61 -1.94 0.20 -4.99 119.30 114.59 3ly2 s MET 426 Ca 0.00 -0.70 -0.29 0.00 -1.71 0.00 0.00 55.69 52.99 3ly2 s MET 426 Cb 0.00 -2.90 -0.10 0.00 2.01 0.00 0.00 34.83 33.84 3ly2 s MET 426 CO 0.00 0.45 1.21 -1.21 -0.01 0.00 0.00 175.02 175.46 3ly2 s GLU 427 N -3.78 4.49 0.03 2.03 0.41 -1.26 -4.09 118.70 116.53 3ly2 s GLU 427 Ca 0.34 2.00 -0.30 0.00 -0.41 0.00 0.00 54.97 56.60 3ly2 s GLU 427 Cb -0.10 -3.14 -0.06 0.00 -1.78 0.00 0.00 34.13 29.05 3ly2 s GLU 427 CO 0.29 -0.01 1.37 0.42 -0.49 0.00 0.00 175.26 176.85 3ly2 s ILE 428 N -1.01 3.67 0.74 -1.63 -1.09 -1.26 -4.91 121.20 115.71 3ly2 s ILE 428 Ca 0.48 1.11 -0.13 0.00 -2.23 0.00 0.00 60.65 59.88 3ly2 s ILE 428 Cb -0.36 -3.71 0.04 0.00 -1.58 0.00 0.00 42.46 36.85 3ly2 s ILE 428 CO 0.46 0.03 1.12 -0.44 -1.23 0.00 0.00 174.94 174.87 3ly2 s SER 429 N 1.63 4.55 0.32 3.58 0.01 -1.26 -4.93 113.70 117.60 3ly2 s SER 429 Ca 0.63 1.99 -0.29 0.00 1.31 0.00 0.00 55.95 59.59 3ly2 s SER 429 Cb -0.32 -2.54 -0.12 0.00 0.21 0.00 0.00 66.02 63.24 3ly2 s SER 429 CO 0.27 -2.01 1.44 -2.65 0.41 0.00 0.00 173.24 170.71 3ly2 n PRO 430 N -3.07 2.40 -0.90 12.44 -0.02 -1.26 -1.79 135.00 142.80 3ly2 n PRO 430 Ca 0.10 0.85 0.00 0.00 -2.02 0.00 0.00 63.50 62.43 3ly2 n PRO 430 Cb 0.52 -2.53 0.00 0.00 -0.02 0.00 0.00 33.50 31.47 3ly2 n PRO 430 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 3ly2 n MET 431 N 1.21 -0.29 -0.18 -0.52 2.81 -1.26 -4.83 117.12 114.06 3ly2 n MET 431 Ca 0.06 0.07 0.10 0.00 -1.81 0.00 0.00 57.70 56.12 3ly2 n MET 431 Cb 0.36 -3.39 0.19 0.00 -0.71 0.00 0.00 33.22 29.68 3ly2 n MET 431 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3ly2 s ASP 433 N -1.28 5.52 0.43 0.00 -1.08 -1.26 -4.11 116.67 114.88 3ly2 s ASP 433 Ca 0.34 -0.70 0.18 0.00 -0.52 0.00 0.00 52.55 51.85 3ly2 s ASP 433 Cb 0.20 -1.98 1.10 0.00 -1.46 0.00 0.00 42.92 40.78 3ly2 s ASP 433 CO 0.27 -0.25 1.87 0.50 0.52 0.00 0.00 175.17 178.08 3ly2 h LYS 434 N 8.35 0.37 0.00 4.34 3.64 -1.92 -1.88 116.57 129.46 3ly2 h LYS 434 Ca -0.30 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.06 3ly2 h LYS 434 Cb 1.13 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.87 3ly2 h LYS 434 CO 0.63 0.24 -0.42 0.45 -2.27 0.00 0.00 179.45 178.08 3ly2 h HIS 435 N 0.38 0.00 0.00 1.91 3.86 -2.00 -3.36 115.15 115.94 3ly2 h HIS 435 Ca 0.44 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.65 3ly2 h HIS 435 Cb 1.12 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.59 3ly2 h HIS 435 CO -0.00 0.00 0.00 0.25 0.86 0.00 0.00 177.93 179.04 3ly2 n THR 436 N -2.24 0.27 -2.41 2.45 -2.24 -0.97 -5.05 114.28 104.10 3ly2 n THR 436 Ca 0.04 -0.57 -0.33 0.00 -2.27 0.00 0.00 64.05 60.91 3ly2 n THR 436 Cb 0.45 0.95 -0.03 0.00 -2.10 0.00 0.00 70.33 69.60 3ly2 n THR 436 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3ly2 s ALA 437 N -0.27 2.89 -0.46 6.98 0.00 -0.75 -4.95 121.76 125.20 3ly2 s ALA 437 Ca 0.00 0.45 0.03 0.00 0.00 0.00 0.00 51.96 52.44 3ly2 s ALA 437 Cb 0.00 -3.21 0.15 0.00 0.00 0.00 0.00 23.12 20.06 3ly2 s ALA 437 CO 0.00 -0.39 0.31 -1.54 0.00 0.00 0.00 175.76 174.14 3ly2 s SER 438 N -2.42 3.05 0.12 0.00 1.04 -1.26 -5.03 113.70 109.21 3ly2 s SER 438 Ca 0.64 -2.90 -0.33 0.00 0.48 0.00 0.00 55.95 53.84 3ly2 s SER 438 Cb -0.14 -0.85 -0.12 0.00 0.10 0.00 0.00 66.02 65.01 3ly2 s SER 438 CO 0.26 -0.21 1.55 0.58 0.98 0.00 0.00 173.24 176.40 3ly2 h VAL 439 N 4.88 0.00 -0.01 5.02 2.07 -1.99 -1.56 116.25 124.68 3ly2 h VAL 439 Ca 0.11 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.66 3ly2 h VAL 439 Cb 0.90 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.63 3ly2 h VAL 439 CO 0.45 0.00 -0.25 -0.33 0.02 0.00 0.00 177.57 177.46 3ly2 h GLU 440 N -0.52 -0.38 -0.53 1.57 3.07 -1.90 -1.30 114.58 114.60 3ly2 h GLU 440 Ca 0.05 0.03 0.07 0.00 -0.50 0.00 0.00 59.36 59.00 3ly2 h GLU 440 Cb 0.65 0.09 -0.03 0.00 -0.84 0.00 0.00 28.75 28.62 3ly2 h GLU 440 CO -0.49 -0.25 0.36 -0.22 -1.40 0.00 0.00 179.01 177.00 3ly2 h LYS 441 N -0.39 0.43 -0.09 2.33 3.64 -1.81 -2.11 116.57 118.58 3ly2 h LYS 441 Ca 0.06 -0.03 -0.19 0.00 -1.27 0.00 0.00 60.65 59.23 3ly2 h LYS 441 Cb 0.48 -0.10 -0.00 0.00 -0.41 0.00 0.00 32.23 32.20 3ly2 h LYS 441 CO -0.23 0.29 -0.74 0.77 -2.27 0.00 0.00 179.45 177.27 3ly2 h SER 442 N 0.45 0.55 -0.55 4.20 0.02 -0.56 -1.97 113.55 115.68 3ly2 h SER 442 Ca 0.23 -0.36 -0.11 0.00 -0.84 0.00 0.00 61.79 60.71 3ly2 h SER 442 Cb 0.35 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 62.71 3ly2 h SER 442 CO -0.06 1.11 -0.09 1.56 -1.14 0.00 0.00 176.83 178.21 3ly2 h GLN 443 N 0.31 1.04 -0.55 3.45 1.08 -0.62 0.16 115.11 119.97 3ly2 h GLN 443 Ca -0.03 -0.37 -0.01 0.00 -1.45 0.00 0.00 58.65 56.79 3ly2 h GLN 443 Cb 1.32 -0.07 -0.03 0.00 -0.05 0.00 0.00 27.48 28.65 3ly2 h GLN 443 CO 0.13 1.06 0.32 0.28 -0.95 0.00 0.00 178.83 179.67 3ly2 h VAL 444 N 0.93 1.17 -0.64 -0.54 2.07 -1.37 0.42 116.25 118.29 3ly2 h VAL 444 Ca 0.15 -0.41 -0.04 0.00 0.82 0.00 0.00 66.70 67.22 3ly2 h VAL 444 Cb 0.65 0.45 -0.03 0.00 -1.52 0.00 0.00 31.29 30.85 3ly2 h VAL 444 CO 0.05 0.18 0.26 1.23 0.02 0.00 0.00 177.57 179.31 3ly2 h GLY 445 N 0.74 1.03 1.00 2.17 0.00 -0.97 0.60 103.07 107.65 3ly2 h GLY 445 Ca 0.20 -0.56 -0.00 0.00 0.00 0.00 0.00 47.33 46.97 3ly2 h GLY 445 CO -0.03 0.53 0.40 -2.75 0.00 0.00 0.00 176.54 174.68 3ly2 h PHE 446 N 0.91 0.84 0.23 5.60 3.57 -0.14 -1.69 116.94 126.25 3ly2 h PHE 446 Ca 0.22 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.71 3ly2 h PHE 446 Cb 0.20 -0.28 0.00 0.00 2.79 0.00 0.00 35.95 38.66 3ly2 h PHE 446 CO 0.01 0.56 -0.11 0.82 -2.23 0.00 0.00 178.31 177.36 3ly2 h ILE 447 N 0.87 0.81 -0.27 1.41 2.04 -0.61 -0.94 117.51 120.83 3ly2 h ILE 447 Ca 0.23 -0.78 0.04 0.00 1.00 0.00 0.00 64.86 65.35 3ly2 h ILE 447 Cb -0.05 1.23 -0.01 0.00 -0.74 0.00 0.00 36.82 37.25 3ly2 h ILE 447 CO -0.05 0.16 0.19 0.44 0.00 0.00 0.00 178.15 178.89 3ly2 h ASP 448 N -0.74 0.16 0.00 1.72 5.19 -0.82 0.72 116.42 122.66 3ly2 h ASP 448 Ca -0.03 -0.00 -0.09 0.00 -0.62 0.00 0.00 57.03 56.29 3ly2 h ASP 448 Cb 0.50 -0.04 -0.02 0.00 0.18 0.00 0.00 39.33 39.95 3ly2 h ASP 448 CO 0.05 0.11 -1.70 -1.22 -3.12 0.00 0.00 179.24 173.36 3ly2 n TYR 449 N -4.49 0.00 0.04 4.55 0.53 -0.64 -4.61 117.16 112.53 3ly2 n TYR 449 Ca 0.02 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.90 3ly2 n TYR 449 Cb 0.21 -0.42 0.00 0.00 -1.03 0.00 0.00 39.34 38.10 3ly2 n TYR 449 CO 0.00 0.00 0.00 -0.89 -1.02 0.00 0.00 176.86 174.95 3ly2 n ILE 450 N -2.16 0.84 0.25 -0.72 5.41 -0.44 -4.74 119.36 117.79 3ly2 n ILE 450 Ca -0.09 0.28 -0.14 0.00 1.00 0.00 0.00 62.75 63.79 3ly2 n ILE 450 Cb 0.56 -1.55 -0.08 0.00 -0.71 0.00 0.00 39.64 37.87 3ly2 n ILE 450 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 176.55 177.13 3ly2 h VAL 451 N 0.00 0.40 -0.20 1.39 2.07 -1.30 -2.94 116.25 115.66 3ly2 h VAL 451 Ca 0.00 -0.43 0.03 0.00 0.82 0.00 0.00 66.70 67.12 3ly2 h VAL 451 Cb 0.31 0.56 -0.03 0.00 -1.52 0.00 0.00 31.29 30.61 3ly2 h VAL 451 CO 0.00 0.06 0.01 -0.74 0.02 0.00 0.00 177.57 176.92 3ly2 h HIS 452 N -0.95 0.02 -0.80 1.57 -0.00 -1.10 0.04 115.15 113.93 3ly2 h HIS 452 Ca -0.07 0.01 0.07 0.00 -0.00 0.00 0.00 60.37 60.39 3ly2 h HIS 452 Cb 0.59 0.02 -0.05 0.00 -0.00 0.00 0.00 27.41 27.98 3ly2 h HIS 452 CO 0.01 -0.01 0.52 -1.35 -0.00 0.00 0.00 177.93 177.10 3ly2 h PRO 453 N 0.08 0.82 0.25 5.26 0.11 -1.75 0.67 132.00 137.46 3ly2 h PRO 453 Ca 0.09 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 66.14 3ly2 h PRO 453 Cb 0.11 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 31.04 3ly2 h PRO 453 CO -0.15 0.54 -0.12 1.25 -0.21 0.00 0.00 178.00 179.32 3ly2 h LEU 454 N 0.85 -0.28 -1.81 2.35 5.85 -1.20 -2.99 115.31 118.07 3ly2 h LEU 454 Ca 0.35 -0.23 -0.01 0.00 0.84 0.00 0.00 57.88 58.82 3ly2 h LEU 454 Cb 0.27 0.07 -0.00 0.00 0.37 0.00 0.00 40.66 41.37 3ly2 h LEU 454 CO -0.13 0.21 -0.03 -0.50 -0.34 0.00 0.00 178.44 177.66 3ly2 h TRP 455 N -0.91 0.08 -0.39 1.25 4.06 -0.89 -1.33 115.95 117.82 3ly2 h TRP 455 Ca -0.03 -0.00 -0.02 0.00 2.06 0.00 0.00 58.89 60.90 3ly2 h TRP 455 Cb 0.50 -0.03 -0.02 0.00 -1.00 0.00 0.00 29.16 28.62 3ly2 h TRP 455 CO 0.05 0.11 0.17 1.49 -3.56 0.00 0.00 178.44 176.71 3ly2 h GLU 456 N 0.08 0.58 -0.11 0.49 4.81 -0.92 0.39 114.58 119.90 3ly2 h GLU 456 Ca 0.02 -0.10 -0.10 0.00 -0.13 0.00 0.00 59.36 59.06 3ly2 h GLU 456 Cb 0.11 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.37 3ly2 h GLU 456 CO 0.00 0.53 -0.36 1.15 -0.73 0.00 0.00 179.01 179.60 3ly2 h THR 457 N 0.49 1.29 -0.18 0.32 2.02 -1.22 -2.19 112.91 113.44 3ly2 h THR 457 Ca 0.13 -1.39 -0.22 0.00 0.77 0.00 0.00 66.41 65.71 3ly2 h THR 457 Cb 0.16 1.61 0.01 0.00 -1.74 0.00 0.00 68.15 68.18 3ly2 h THR 457 CO -0.01 0.42 -0.73 -0.25 0.37 0.00 0.00 175.52 175.31 3ly2 h TRP 458 N 0.20 1.08 -0.03 3.16 2.91 -0.73 -2.48 115.95 120.05 3ly2 h TRP 458 Ca 0.02 -0.46 -0.00 0.00 1.13 0.00 0.00 58.89 59.58 3ly2 h TRP 458 Cb 0.74 -0.17 -0.00 0.00 -0.51 0.00 0.00 29.16 29.21 3ly2 h TRP 458 CO 0.01 1.29 0.01 0.00 -1.03 0.00 0.00 178.44 178.73 3ly2 h ALA 459 N 0.57 1.96 0.28 2.65 0.00 -0.01 -2.00 119.26 122.71 3ly2 h ALA 459 Ca -0.04 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 3ly2 h ALA 459 Cb 1.36 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.14 3ly2 h ALA 459 CO 0.15 0.03 -0.13 -0.44 0.00 0.00 0.00 179.25 178.86 3ly2 h ASP 460 N 0.05 -0.32 -0.44 0.00 5.19 -1.11 -1.81 116.42 117.98 3ly2 h ASP 460 Ca 0.01 -0.17 0.04 0.00 -0.62 0.00 0.00 57.03 56.30 3ly2 h ASP 460 Cb 0.01 0.08 -0.04 0.00 0.18 0.00 0.00 39.33 39.56 3ly2 h ASP 460 CO -0.00 0.01 0.19 0.25 -3.12 0.00 0.00 179.24 176.57 3ly2 h LEU 461 N -0.67 0.25 -3.88 1.55 5.85 -0.96 -2.86 115.31 114.59 3ly2 h LEU 461 Ca -0.04 0.03 -0.45 0.00 0.84 0.00 0.00 57.88 58.26 3ly2 h LEU 461 Cb 0.47 -0.01 -0.27 0.00 0.37 0.00 0.00 40.66 41.22 3ly2 h LEU 461 CO 0.06 0.18 0.52 1.33 -0.34 0.00 0.00 178.44 180.20 3ly2 n VAL 462 N -4.95 3.09 -1.62 1.05 0.24 -0.81 -4.96 118.33 110.37 3ly2 n VAL 462 Ca 0.03 -2.06 -0.49 0.00 -2.04 0.00 0.00 64.34 59.78 3ly2 n VAL 462 Cb 0.14 -0.44 -0.05 0.00 -1.47 0.00 0.00 33.84 32.02 3ly2 n VAL 462 CO 0.00 0.00 0.00 1.67 -2.14 0.00 0.00 176.83 176.36 3ly2 n GLN 463 N -1.12 1.49 -1.12 7.34 7.27 -0.68 -0.65 117.38 129.92 3ly2 n GLN 463 Ca 0.55 0.54 -0.15 0.00 0.07 0.00 0.00 57.00 58.00 3ly2 n GLN 463 Cb 1.56 -2.19 0.16 0.00 2.41 0.00 0.00 30.24 32.18 3ly2 n GLN 463 CO 0.00 0.00 0.00 -0.35 0.07 0.00 0.00 177.06 176.78 3ly2 n PRO 464 N 2.58 2.24 -0.29 3.69 -0.04 -1.26 -4.91 135.00 137.02 3ly2 n PRO 464 Ca 0.17 -3.29 -0.05 0.00 -0.04 0.00 0.00 63.50 60.29 3ly2 n PRO 464 Cb 0.24 -2.01 0.07 0.00 -0.04 0.00 0.00 33.50 31.75 3ly2 n PRO 464 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 3ly2 h ASP 465 N 1.28 0.93 -0.12 3.54 3.32 -1.17 -2.96 116.42 121.23 3ly2 h ASP 465 Ca 0.38 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.38 3ly2 h ASP 465 Cb 1.78 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 41.09 3ly2 h ASP 465 CO 0.74 0.70 0.00 0.00 -1.72 0.00 0.00 179.24 178.97 3ly2 n ALA 466 N -2.34 2.51 -0.12 3.45 0.00 -1.26 -4.36 120.51 118.39 3ly2 n ALA 466 Ca 0.08 -0.23 -0.07 0.00 0.00 0.00 0.00 53.44 53.22 3ly2 n ALA 466 Cb 0.04 -0.99 0.02 0.00 0.00 0.00 0.00 19.45 18.52 3ly2 n ALA 466 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 3ly2 h GLN 467 N 0.71 0.42 -0.48 0.00 5.75 -1.87 -1.26 115.11 118.39 3ly2 h GLN 467 Ca 0.00 -0.03 0.01 0.00 -0.15 0.00 0.00 58.65 58.48 3ly2 h GLN 467 Cb 0.23 -0.10 -0.03 0.00 1.07 0.00 0.00 27.48 28.66 3ly2 h GLN 467 CO 0.01 0.28 0.31 -0.44 -2.65 0.00 0.00 178.83 176.34 3ly2 h ASP 468 N 0.43 0.53 -0.19 -0.69 3.45 -1.85 -1.10 116.42 117.01 3ly2 h ASP 468 Ca 0.17 -0.01 0.04 0.00 0.43 0.00 0.00 57.03 57.65 3ly2 h ASP 468 Cb 0.05 -0.13 -0.04 0.00 -0.56 0.00 0.00 39.33 38.65 3ly2 h ASP 468 CO -0.10 0.38 -0.06 0.40 -1.57 0.00 0.00 179.24 178.29 3ly2 h ILE 469 N 0.63 0.79 -0.42 0.35 2.04 -1.79 -0.61 117.51 118.50 3ly2 h ILE 469 Ca 0.18 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.10 3ly2 h ILE 469 Cb -0.06 0.79 -0.02 0.00 -0.74 0.00 0.00 36.82 36.79 3ly2 h ILE 469 CO -0.05 0.00 0.28 0.25 0.00 0.00 0.00 178.15 178.64 3ly2 h LEU 470 N -0.02 0.25 -0.05 1.44 5.85 -0.74 -0.73 115.31 121.31 3ly2 h LEU 470 Ca 0.09 0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.73 3ly2 h LEU 470 Cb 0.16 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.14 3ly2 h LEU 470 CO -0.20 0.16 -0.28 0.44 -0.34 0.00 0.00 178.44 178.23 3ly2 h ASP 471 N 0.29 0.33 -0.91 1.25 3.32 0.00 -2.86 116.42 117.83 3ly2 h ASP 471 Ca 0.18 -0.67 0.03 0.00 0.02 0.00 0.00 57.03 56.59 3ly2 h ASP 471 Cb 0.36 -0.10 -0.05 0.00 0.22 0.00 0.00 39.33 39.77 3ly2 h ASP 471 CO -0.04 0.94 0.60 0.74 -1.72 0.00 0.00 179.24 179.76 3ly2 h THR 472 N -0.27 1.18 -0.26 0.35 2.02 -0.64 -1.16 112.91 114.13 3ly2 h THR 472 Ca -0.02 -0.41 0.03 0.00 0.77 0.00 0.00 66.41 66.78 3ly2 h THR 472 Cb 0.94 -0.10 -0.03 0.00 -1.74 0.00 0.00 68.15 67.22 3ly2 h THR 472 CO 0.06 0.22 0.09 0.25 0.37 0.00 0.00 175.52 176.50 3ly2 h LEU 473 N 1.18 0.11 -1.58 2.58 5.85 -1.18 0.23 115.31 122.50 3ly2 h LEU 473 Ca 0.35 0.03 -0.03 0.00 0.84 0.00 0.00 57.88 59.07 3ly2 h LEU 473 Cb -0.05 0.01 -0.00 0.00 0.37 0.00 0.00 40.66 40.99 3ly2 h LEU 473 CO -0.10 0.09 -0.12 -0.33 -0.34 0.00 0.00 178.44 177.64 3ly2 h GLU 474 N 0.21 0.00 0.09 1.25 5.08 -1.17 0.16 114.58 120.20 3ly2 h GLU 474 Ca 0.11 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.30 3ly2 h GLU 474 Cb 0.08 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.35 3ly2 h GLU 474 CO -0.11 0.12 -0.75 -0.44 -1.00 0.00 0.00 179.01 176.83 3ly2 h ASP 475 N 0.00 0.51 -0.13 1.42 3.32 -0.41 -2.89 116.42 118.24 3ly2 h ASP 475 Ca -0.00 -0.87 -0.08 0.00 0.02 0.00 0.00 57.03 56.10 3ly2 h ASP 475 Cb 0.51 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.89 3ly2 h ASP 475 CO 0.02 1.33 -0.15 0.78 -1.72 0.00 0.00 179.24 179.49 3ly2 h ASN 476 N -0.25 0.50 -0.29 6.45 2.35 -0.74 -1.59 115.58 122.02 3ly2 h ASN 476 Ca -0.12 -0.14 0.01 0.00 -0.55 0.00 0.00 56.30 55.51 3ly2 h ASN 476 Cb 1.52 -0.13 -0.02 0.00 0.05 0.00 0.00 38.32 39.74 3ly2 h ASN 476 CO 0.14 0.68 0.16 -0.09 -1.65 0.00 0.00 177.43 176.67 3ly2 h ARG 477 N 0.47 0.32 -0.06 0.81 1.12 -1.01 -1.63 114.38 114.39 3ly2 h ARG 477 Ca 0.08 -0.02 -0.12 0.00 -1.11 0.00 0.00 59.98 58.82 3ly2 h ARG 477 Cb 0.54 -0.07 -0.01 0.00 -0.01 0.00 0.00 29.97 30.42 3ly2 h ARG 477 CO 0.03 0.21 -0.49 -0.91 -3.11 0.00 0.00 179.97 175.71 3ly2 h ASN 478 N 0.33 0.17 0.31 -3.80 2.35 -1.26 -1.56 115.58 112.12 3ly2 h ASN 478 Ca 0.11 -0.08 -0.01 0.00 -0.55 0.00 0.00 56.30 55.77 3ly2 h ASN 478 Cb 0.01 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 38.33 3ly2 h ASN 478 CO -0.06 0.63 -0.15 -0.25 -1.65 0.00 0.00 177.43 175.95 3ly2 h TRP 479 N 0.13 -0.38 -0.74 1.19 7.01 -0.84 -0.88 115.95 121.44 3ly2 h TRP 479 Ca 0.00 -0.01 0.01 0.00 2.11 0.00 0.00 58.89 61.00 3ly2 h TRP 479 Cb 0.91 0.13 -0.04 0.00 -2.10 0.00 0.00 29.16 28.06 3ly2 h TRP 479 CO 0.01 -0.17 0.49 1.88 -2.79 0.00 0.00 178.44 177.85 3ly2 h TYR 480 N -0.50 0.94 -0.81 2.65 0.05 -1.24 -1.07 116.97 116.98 3ly2 h TYR 480 Ca -0.04 0.02 -0.01 0.00 0.05 0.00 0.00 58.73 58.75 3ly2 h TYR 480 Cb 0.38 -0.32 -0.04 0.00 1.01 0.00 0.00 36.73 37.76 3ly2 h TYR 480 CO -0.03 0.59 0.48 0.37 -1.05 0.00 0.00 178.16 178.53 3ly2 h GLN 481 N 1.01 1.10 0.00 4.88 5.75 -1.01 -1.28 115.11 125.56 3ly2 h GLN 481 Ca 0.27 -0.10 0.00 0.00 -0.15 0.00 0.00 58.65 58.67 3ly2 h GLN 481 Cb -0.11 -0.23 0.00 0.00 1.07 0.00 0.00 27.48 28.21 3ly2 h GLN 481 CO -0.06 0.77 0.00 0.66 -2.65 0.00 0.00 178.83 177.55 3ly2 h SER 482 N 1.12 0.00 0.06 -0.69 4.64 0.10 -3.02 113.55 115.77 3ly2 h SER 482 Ca 0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.61 3ly2 h SER 482 Cb -0.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.05 3ly2 h SER 482 CO -0.05 0.00 -0.09 0.23 -0.87 0.00 0.00 176.83 176.05 3ly2 n MET 483 N -2.64 1.44 -1.99 4.77 2.81 -0.50 -4.85 117.12 116.15 3ly2 n MET 483 Ca 0.03 -0.87 -0.42 0.00 -1.81 0.00 0.00 57.70 54.63 3ly2 n MET 483 Cb 0.38 -1.48 -0.03 0.00 -0.71 0.00 0.00 33.22 31.38 3ly2 n MET 483 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 3ly2 s ILE 484 N -2.17 3.29 0.35 2.02 1.01 -1.10 -4.88 121.20 119.73 3ly2 s ILE 484 Ca 0.33 0.63 -0.28 0.00 0.00 0.00 0.00 60.65 61.33 3ly2 s ILE 484 Cb 0.20 -3.41 -0.12 0.00 0.01 0.00 0.00 42.46 39.15 3ly2 s ILE 484 CO 0.40 -0.02 1.33 -2.65 0.00 0.00 0.00 174.94 173.99 3ly2 n PRO 485 N 6.02 2.22 0.00 2.79 -0.02 -1.26 -5.09 135.00 139.66 3ly2 n PRO 485 Ca 0.16 0.78 0.00 0.00 -2.02 0.00 0.00 63.50 62.42 3ly2 n PRO 485 Cb 0.42 -2.39 0.00 0.00 -0.02 0.00 0.00 33.50 31.50 3ly2 n PRO 485 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48