#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u4f s ARG 46 N 0.00 0.80 0.07 -1.46 1.70 -1.26 -5.06 118.95 113.74 1u4f s ARG 46 Ca 0.00 0.47 -0.14 0.00 -0.47 0.00 0.00 55.73 55.60 1u4f s ARG 46 Cb 0.00 0.38 -0.24 0.00 -0.57 0.00 0.00 34.95 34.52 1u4f s ARG 46 CO 0.00 -0.19 1.17 0.35 -1.08 0.00 0.00 175.30 175.55 1u4f h PHE 47 N 3.59 1.01 -3.73 5.89 3.57 -1.94 -3.40 116.94 121.93 1u4f h PHE 47 Ca -0.26 -0.58 -0.68 0.00 3.53 0.00 0.00 57.97 59.99 1u4f h PHE 47 Cb 1.16 -0.10 -0.28 0.00 2.79 0.00 0.00 35.95 39.51 1u4f h PHE 47 CO 0.35 1.42 -0.81 0.08 -2.23 0.00 0.00 178.31 177.12 1u4f s VAL 48 N -3.21 2.68 0.46 1.41 1.01 -1.26 0.50 120.40 121.99 1u4f s VAL 48 Ca -0.09 -0.83 -0.02 0.00 0.00 0.00 0.00 61.98 61.04 1u4f s VAL 48 Cb 0.07 -2.06 -0.01 0.00 0.00 0.00 0.00 36.38 34.38 1u4f s VAL 48 CO 0.92 0.56 0.71 -0.54 0.00 0.00 0.00 175.10 176.76 1u4f s LYS 49 N -0.11 3.23 0.43 2.72 1.02 0.73 -4.94 119.74 122.81 1u4f s LYS 49 Ca -0.03 -0.22 0.20 0.00 0.02 0.00 0.00 55.97 55.94 1u4f s LYS 49 Cb -0.14 -2.49 1.14 0.00 -0.52 0.00 0.00 37.83 35.82 1u4f s LYS 49 CO 0.04 -0.25 1.84 0.87 -0.92 0.00 0.00 175.35 176.93 1u4f h LYS 50 N 0.33 0.35 -0.00 1.68 1.79 -2.01 0.25 116.57 118.95 1u4f h LYS 50 Ca -0.47 -0.02 0.00 0.00 -2.18 0.00 0.00 60.65 57.98 1u4f h LYS 50 Cb 1.24 -0.08 0.00 0.00 -1.58 0.00 0.00 32.23 31.81 1u4f h LYS 50 CO 0.60 0.23 -0.01 -0.40 -1.08 0.00 0.00 179.45 178.79 1u4f n ASP 51 N -4.50 0.26 0.00 0.86 5.68 -1.26 -4.92 116.55 112.67 1u4f n ASP 51 Ca 0.21 -0.96 0.00 0.00 -0.50 0.00 0.00 54.79 53.53 1u4f n ASP 51 Cb 0.78 -0.03 0.00 0.00 -1.14 0.00 0.00 41.12 40.72 1u4f n ASP 51 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1u4f n GLY 52 N 1.07 1.23 3.79 6.12 0.00 0.87 -5.06 105.19 113.21 1u4f n GLY 52 Ca 0.22 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.88 1u4f n GLY 52 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1u4f s HIS 53 N -2.30 3.15 -0.17 1.61 5.04 -1.26 -4.72 115.29 116.65 1u4f s HIS 53 Ca 0.00 1.61 -0.07 0.00 -1.54 0.00 0.00 55.06 55.06 1u4f s HIS 53 Cb 0.00 -3.13 -0.04 0.00 0.04 0.00 0.00 32.58 29.44 1u4f s HIS 53 CO 0.00 -0.77 0.08 0.00 -2.34 0.00 0.00 174.74 171.71 1u4f n ASN 55 N 3.24 4.39 -4.00 0.00 3.02 0.18 -4.87 115.26 117.22 1u4f n ASN 55 Ca -0.17 -2.86 -0.16 0.00 -0.03 0.00 0.00 54.58 51.36 1u4f n ASN 55 Cb 0.53 -1.63 -0.14 0.00 -0.61 0.00 0.00 39.78 37.93 1u4f n ASN 55 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1u4f s VAL 56 N 2.71 0.53 -0.03 2.41 0.11 -1.26 -0.89 120.40 123.98 1u4f s VAL 56 Ca 0.48 -0.45 0.05 0.00 -2.93 0.00 0.00 61.98 59.12 1u4f s VAL 56 Cb 0.14 -0.48 -0.01 0.00 -1.53 0.00 0.00 36.38 34.50 1u4f s VAL 56 CO -0.08 0.04 -0.17 -1.58 -3.33 0.00 0.00 175.10 169.98 1u4f s GLN 57 N -0.45 1.59 -0.09 1.54 0.74 0.29 -4.95 119.66 118.33 1u4f s GLN 57 Ca 0.00 -0.61 -0.02 0.00 0.05 0.00 0.00 55.36 54.78 1u4f s GLN 57 Cb -0.04 -1.45 -0.03 0.00 1.10 0.00 0.00 33.01 32.59 1u4f s GLN 57 CO -0.00 0.31 -0.01 -0.06 -0.55 0.00 0.00 175.29 174.98 1u4f s PHE 58 N -0.18 3.12 0.17 1.67 0.40 -1.26 -0.44 117.98 121.46 1u4f s PHE 58 Ca 0.01 0.14 0.06 0.00 -0.60 0.00 0.00 56.93 56.54 1u4f s PHE 58 Cb -0.09 -1.79 -0.04 0.00 0.51 0.00 0.00 43.02 41.60 1u4f s PHE 58 CO 0.01 0.41 -0.13 0.96 0.70 0.00 0.00 175.22 177.17 1u4f s ILE 59 N -0.78 1.49 -1.33 0.64 -4.36 -0.41 -4.82 121.20 111.62 1u4f s ILE 59 Ca 0.12 -2.08 -0.03 0.00 -0.26 0.00 0.00 60.65 58.40 1u4f s ILE 59 Cb -0.11 -1.90 0.02 0.00 1.25 0.00 0.00 42.46 41.71 1u4f s ILE 59 CO 0.02 -0.62 0.83 0.59 0.24 0.00 0.00 174.94 176.00 1u4f n ASN 60 N -0.17 -2.29 -0.01 4.36 5.03 -1.26 -2.64 115.26 118.28 1u4f n ASN 60 Ca -0.10 -0.76 -0.20 0.00 0.87 0.00 0.00 54.58 54.39 1u4f n ASN 60 Cb 0.60 -4.26 -0.14 0.00 -1.02 0.00 0.00 39.78 34.96 1u4f n ASN 60 CO 0.00 0.00 0.00 0.55 -1.83 0.00 0.00 177.26 175.98 1u4f n VAL 61 N -4.37 1.74 0.00 2.41 3.14 -1.26 -3.92 118.33 116.07 1u4f n VAL 61 Ca -0.22 -0.67 0.00 0.00 -2.96 0.00 0.00 64.34 60.49 1u4f n VAL 61 Cb 0.64 -1.62 0.00 0.00 -1.06 0.00 0.00 33.84 31.81 1u4f n VAL 61 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1u4f n GLY 62 N 1.96 0.69 2.64 7.55 0.00 -1.26 -4.63 105.19 112.14 1u4f n GLY 62 Ca -0.31 -1.41 -0.31 0.00 0.00 0.00 0.00 46.02 43.99 1u4f n GLY 62 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1u4f n GLU 63 N 0.00 3.22 -3.16 1.61 0.00 -1.26 -5.07 120.64 115.99 1u4f n GLU 63 Ca 0.00 -4.19 -0.14 0.00 0.00 0.00 0.00 57.16 52.83 1u4f n GLU 63 Cb 0.00 -2.26 0.07 0.00 0.00 0.00 0.00 31.44 29.25 1u4f n GLU 63 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.13 175.42 1u4f n ASN 190 N -0.49 -3.19 0.00 -1.84 5.15 -1.20 -5.07 115.26 108.62 1u4f n ASN 190 Ca 0.44 -0.55 0.00 0.00 -0.60 0.00 0.00 54.58 53.86 1u4f n ASN 190 Cb 0.51 -4.49 0.00 0.00 -0.53 0.00 0.00 39.78 35.27 1u4f n ASN 190 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 1u4f n GLU 191 N -3.48 0.00 0.00 1.20 1.02 -1.17 -4.95 120.64 113.27 1u4f n GLU 191 Ca -0.19 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 56.95 1u4f n GLU 191 Cb 0.63 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 32.05 1u4f n GLU 191 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1u4f n THR 192 N 0.00 0.00 -2.33 2.62 -2.24 -1.26 -3.71 114.28 107.36 1u4f n THR 192 Ca 0.00 0.00 -0.37 0.00 -2.27 0.00 0.00 64.05 61.41 1u4f n THR 192 Cb 0.00 0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.21 1u4f n THR 192 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1u4f s LEU 193 N 0.00 4.09 -0.00 3.22 1.43 -1.26 -1.56 118.68 124.59 1u4f s LEU 193 Ca 0.00 2.26 -0.05 0.00 -1.03 0.00 0.00 54.13 55.30 1u4f s LEU 193 Cb 0.00 -4.17 -0.00 0.00 0.03 0.00 0.00 46.19 42.05 1u4f s LEU 193 CO 0.00 -0.75 0.10 0.54 0.23 0.00 0.00 176.35 176.47 1u4f s VAL 194 N -1.53 0.07 0.03 -1.59 0.11 0.24 -4.93 120.40 112.79 1u4f s VAL 194 Ca 0.60 -0.58 0.05 0.00 -2.93 0.00 0.00 61.98 59.13 1u4f s VAL 194 Cb -0.28 -0.35 -0.03 0.00 -1.53 0.00 0.00 36.38 34.19 1u4f s VAL 194 CO 0.34 -0.32 -0.11 -0.36 -3.33 0.00 0.00 175.10 171.32 1u4f s PHE 195 N -1.08 2.74 0.36 1.54 0.40 -1.26 -0.48 117.98 120.20 1u4f s PHE 195 Ca -0.12 -0.14 -0.28 0.00 -0.60 0.00 0.00 56.93 55.79 1u4f s PHE 195 Cb -0.07 -1.53 -0.11 0.00 0.51 0.00 0.00 43.02 41.83 1u4f s PHE 195 CO 0.01 0.34 1.45 -1.54 0.70 0.00 0.00 175.22 176.17 1u4f s SER 196 N -1.56 6.44 0.31 1.36 1.04 -0.40 -4.88 113.70 116.01 1u4f s SER 196 Ca 0.17 2.97 0.02 0.00 0.48 0.00 0.00 55.95 59.59 1u4f s SER 196 Cb -0.11 -2.66 0.58 0.00 0.10 0.00 0.00 66.02 63.93 1u4f s SER 196 CO 0.08 -0.80 1.89 -0.74 0.98 0.00 0.00 173.24 174.65 1u4f h HIS 197 N 3.17 1.03 -1.99 5.02 2.76 -1.92 -3.44 115.15 119.77 1u4f h HIS 197 Ca -0.50 0.03 -0.57 0.00 -2.20 0.00 0.00 60.37 57.12 1u4f h HIS 197 Cb 1.24 -0.33 -0.10 0.00 1.55 0.00 0.00 27.41 29.76 1u4f h HIS 197 CO 0.54 0.49 -0.62 -0.80 -1.30 0.00 0.00 177.93 176.24 1u4f s ASN 198 N -5.93 4.29 0.27 3.26 0.01 -1.26 -4.97 114.94 110.61 1u4f s ASN 198 Ca -0.11 -0.89 0.11 0.00 -0.71 0.00 0.00 52.86 51.26 1u4f s ASN 198 Cb 0.21 -0.61 -0.05 0.00 0.41 0.00 0.00 41.25 41.21 1u4f s ASN 198 CO 0.80 -0.18 -0.14 0.00 -1.51 0.00 0.00 177.10 176.06 1u4f s ALA 199 N -2.46 2.86 0.12 0.60 0.00 -0.93 -4.60 121.76 117.34 1u4f s ALA 199 Ca 0.34 -1.81 0.03 0.00 0.00 0.00 0.00 51.96 50.52 1u4f s ALA 199 Cb -0.02 -0.41 -0.04 0.00 0.00 0.00 0.00 23.12 22.65 1u4f s ALA 199 CO 0.20 0.28 -0.08 0.14 0.00 0.00 0.00 175.76 176.30 1u4f s VAL 200 N -2.45 0.87 -0.10 0.00 -7.23 0.23 0.99 120.40 112.72 1u4f s VAL 200 Ca 0.30 -1.98 0.02 0.00 -1.81 0.00 0.00 61.98 58.50 1u4f s VAL 200 Cb -0.05 -1.75 0.02 0.00 0.56 0.00 0.00 36.38 35.15 1u4f s VAL 200 CO 0.16 -0.82 -0.14 -0.63 -0.31 0.00 0.00 175.10 173.35 1u4f s ILE 201 N -3.51 1.43 0.24 -0.62 -1.09 -0.73 0.38 121.20 117.30 1u4f s ILE 201 Ca 0.14 -0.60 -0.22 0.00 -2.23 0.00 0.00 60.65 57.73 1u4f s ILE 201 Cb 0.04 -1.31 0.03 0.00 -1.58 0.00 0.00 42.46 39.64 1u4f s ILE 201 CO -0.03 0.43 0.79 0.00 -1.23 0.00 0.00 174.94 174.90 1u4f s ALA 202 N 1.00 -1.35 0.11 9.38 0.00 -0.71 -1.09 121.76 129.09 1u4f s ALA 202 Ca -0.07 -0.18 -0.25 0.00 0.00 0.00 0.00 51.96 51.47 1u4f s ALA 202 Cb -0.15 0.79 -0.07 0.00 0.00 0.00 0.00 23.12 23.69 1u4f s ALA 202 CO -0.01 -1.04 0.77 -1.64 0.00 0.00 0.00 175.76 173.83 1u4f s MET 203 N -3.73 4.52 -0.16 0.00 -1.94 -1.26 -0.86 119.30 115.87 1u4f s MET 203 Ca 0.11 1.11 -0.04 0.00 -1.71 0.00 0.00 55.69 55.16 1u4f s MET 203 Cb -0.05 -3.31 0.07 0.00 2.01 0.00 0.00 34.83 33.56 1u4f s MET 203 CO 0.06 0.45 0.16 0.50 -0.01 0.00 0.00 175.02 176.17 1u4f s ARG 204 N -0.66 0.10 -1.37 2.03 3.52 0.12 -4.89 118.95 117.80 1u4f s ARG 204 Ca 0.37 0.18 -0.05 0.00 -0.13 0.00 0.00 55.73 56.09 1u4f s ARG 204 Cb -0.22 -1.23 0.03 0.00 -1.56 0.00 0.00 34.95 31.97 1u4f s ARG 204 CO 0.25 -0.58 0.85 -0.25 -0.81 0.00 0.00 175.30 174.76 1u4f n ASP 205 N 5.31 -2.80 0.00 -2.12 8.00 -1.26 -2.08 116.55 121.59 1u4f n ASP 205 Ca -0.06 -0.77 0.00 0.00 0.71 0.00 0.00 54.79 54.68 1u4f n ASP 205 Cb 0.49 -4.18 0.00 0.00 -0.02 0.00 0.00 41.12 37.41 1u4f n ASP 205 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1u4f n GLY 206 N -1.61 1.22 3.20 0.44 0.00 -1.26 -5.02 105.19 102.16 1u4f n GLY 206 Ca -0.17 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.57 1u4f n GLY 206 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1u4f s LYS 207 N -0.09 2.08 -0.04 1.61 1.02 -0.89 -5.09 119.74 118.34 1u4f s LYS 207 Ca 0.00 -0.74 -0.30 0.00 0.02 0.00 0.00 55.97 54.95 1u4f s LYS 207 Cb 0.00 -1.80 -0.04 0.00 -0.52 0.00 0.00 37.83 35.47 1u4f s LYS 207 CO 0.00 0.32 1.23 -1.17 -0.92 0.00 0.00 175.35 174.81 1u4f s LEU 208 N -0.10 4.29 0.13 3.17 2.96 -1.26 -0.70 118.68 127.16 1u4f s LEU 208 Ca -0.02 1.87 0.07 0.00 -0.22 0.00 0.00 54.13 55.82 1u4f s LEU 208 Cb -0.12 -3.56 -0.04 0.00 0.50 0.00 0.00 46.19 42.97 1u4f s LEU 208 CO 0.02 -0.60 -0.16 0.00 -1.32 0.00 0.00 176.35 174.30 1u4f s LEU 210 N -2.38 3.75 0.09 0.00 2.96 -0.59 -1.74 118.68 120.77 1u4f s LEU 210 Ca 0.09 -0.01 0.04 0.00 -0.22 0.00 0.00 54.13 54.04 1u4f s LEU 210 Cb -0.06 -1.98 -0.03 0.00 0.50 0.00 0.00 46.19 44.62 1u4f s LEU 210 CO 0.04 0.08 -0.12 -0.04 -1.32 0.00 0.00 176.35 174.99 1u4f s MET 211 N 0.92 0.84 0.07 1.98 -1.94 0.16 -1.26 119.30 120.07 1u4f s MET 211 Ca 0.04 -1.07 -0.14 0.00 -1.71 0.00 0.00 55.69 52.82 1u4f s MET 211 Cb -0.14 -0.68 0.02 0.00 2.01 0.00 0.00 34.83 36.04 1u4f s MET 211 CO 0.03 0.13 0.32 1.67 -0.01 0.00 0.00 175.02 177.16 1u4f s TRP 212 N -1.89 -0.10 0.06 -0.03 -2.14 -0.97 -0.60 118.94 113.27 1u4f s TRP 212 Ca 0.02 -0.13 0.01 0.00 2.66 0.00 0.00 56.10 58.66 1u4f s TRP 212 Cb -0.06 0.12 -0.04 0.00 -3.10 0.00 0.00 33.47 30.39 1u4f s TRP 212 CO 0.01 -0.57 0.12 0.50 -2.66 0.00 0.00 176.95 174.35 1u4f s ARG 213 N -3.12 3.07 0.01 3.25 3.52 -1.26 -0.21 118.95 124.21 1u4f s ARG 213 Ca -0.01 -0.58 0.01 0.00 -0.13 0.00 0.00 55.73 55.02 1u4f s ARG 213 Cb 0.01 -2.84 -0.01 0.00 -1.56 0.00 0.00 34.95 30.55 1u4f s ARG 213 CO -0.07 0.59 -0.05 0.54 -0.81 0.00 0.00 175.30 175.51 1u4f s VAL 214 N -1.38 0.36 0.13 7.11 0.11 0.15 -1.27 120.40 125.61 1u4f s VAL 214 Ca 0.30 -0.46 -0.06 0.00 -2.93 0.00 0.00 61.98 58.82 1u4f s VAL 214 Cb -0.12 -0.36 -0.02 0.00 -1.53 0.00 0.00 36.38 34.35 1u4f s VAL 214 CO 0.22 -0.08 0.18 -0.83 -3.33 0.00 0.00 175.10 171.27 1u4f s GLY 215 N -0.58 0.55 -0.36 6.54 0.00 0.37 -0.83 107.32 113.00 1u4f s GLY 215 Ca -0.03 -1.02 0.03 0.00 0.00 0.00 0.00 44.72 43.70 1u4f s GLY 215 CO -0.00 -1.01 0.09 0.21 0.00 0.00 0.00 173.10 172.39 1u4f s ASN 216 N -2.97 4.55 0.00 1.64 3.04 -1.26 -0.60 114.94 119.34 1u4f s ASN 216 Ca 0.16 -2.19 0.30 0.00 0.04 0.00 0.00 52.86 51.17 1u4f s ASN 216 Cb 0.05 -1.48 1.46 0.00 -1.54 0.00 0.00 41.25 39.74 1u4f s ASN 216 CO -0.02 -0.36 2.02 0.18 -3.04 0.00 0.00 177.10 175.87 1u4f n LEU 217 N 4.19 0.05 -4.77 3.21 4.77 -0.60 -4.84 117.00 119.01 1u4f n LEU 217 Ca 0.03 0.27 -0.30 0.00 -0.03 0.00 0.00 56.01 55.98 1u4f n LEU 217 Cb 0.41 -0.29 0.11 0.00 -2.33 0.00 0.00 43.42 41.31 1u4f n LEU 217 CO 0.22 0.01 0.70 -0.60 -1.33 0.00 0.00 177.39 176.38 1u4f s ARG 218 N -2.60 1.74 0.00 3.23 3.52 -1.24 -3.03 118.95 120.57 1u4f s ARG 218 Ca 0.27 0.67 0.19 0.00 -0.13 0.00 0.00 55.73 56.73 1u4f s ARG 218 Cb 0.20 -1.88 0.52 0.00 -1.56 0.00 0.00 34.95 32.24 1u4f s ARG 218 CO 0.47 -1.87 1.43 1.63 -0.81 0.00 0.00 175.30 176.16 1u4f n LYS 219 N -3.60 2.27 -4.53 5.12 5.02 -1.26 -4.93 118.16 116.24 1u4f n LYS 219 Ca 0.07 -1.95 -0.25 0.00 -2.02 0.00 0.00 58.31 54.16 1u4f n LYS 219 Cb 0.56 -1.45 -0.11 0.00 -0.02 0.00 0.00 35.03 34.02 1u4f n LYS 219 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1u4f s SER 220 N -1.19 3.41 0.38 4.39 1.04 -1.26 -5.14 113.70 115.33 1u4f s SER 220 Ca 0.37 -1.27 -0.20 0.00 0.48 0.00 0.00 55.95 55.33 1u4f s SER 220 Cb 0.20 -0.30 -0.10 0.00 0.10 0.00 0.00 66.02 65.92 1u4f s SER 220 CO 0.27 -0.36 0.87 -1.00 0.98 0.00 0.00 173.24 174.00 1u4f s HIS 221 N -2.81 3.38 -0.40 5.02 3.76 -1.26 -4.86 115.29 118.12 1u4f s HIS 221 Ca 0.33 1.49 -0.14 0.00 -0.15 0.00 0.00 55.06 56.59 1u4f s HIS 221 Cb 0.06 -2.75 0.02 0.00 1.11 0.00 0.00 32.58 31.02 1u4f s HIS 221 CO 0.16 0.00 0.28 -1.17 -0.85 0.00 0.00 174.74 173.17 1u4f s LEU 222 N -2.95 5.01 -0.04 0.89 2.96 -1.26 -1.01 118.68 122.28 1u4f s LEU 222 Ca 0.58 -0.89 -0.25 0.00 -0.22 0.00 0.00 54.13 53.35 1u4f s LEU 222 Cb -0.11 -2.14 -0.04 0.00 0.50 0.00 0.00 46.19 44.41 1u4f s LEU 222 CO 0.16 -0.43 0.76 -0.69 -1.32 0.00 0.00 176.35 174.83 1u4f s VAL 223 N 1.66 4.97 -1.31 1.68 1.01 0.66 -3.99 120.40 125.08 1u4f s VAL 223 Ca 0.05 1.58 -0.07 0.00 0.00 0.00 0.00 61.98 63.53 1u4f s VAL 223 Cb -0.19 -4.10 0.01 0.00 0.00 0.00 0.00 36.38 32.10 1u4f s VAL 223 CO 0.09 0.25 1.14 -0.62 0.00 0.00 0.00 175.10 175.96 1u4f n GLU 224 N 3.65 -7.63 -2.54 2.72 1.02 -1.26 -1.16 120.64 115.44 1u4f n GLU 224 Ca -0.00 0.81 -0.37 0.00 -0.02 0.00 0.00 57.16 57.59 1u4f n GLU 224 Cb 0.51 -5.81 -0.04 0.00 -0.02 0.00 0.00 31.44 26.08 1u4f n GLU 224 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1u4f s ALA 225 N -3.32 3.09 0.12 0.62 0.00 -1.26 -4.53 121.76 116.49 1u4f s ALA 225 Ca 0.49 0.71 -0.23 0.00 0.00 0.00 0.00 51.96 52.93 1u4f s ALA 225 Cb -0.22 -3.27 0.06 0.00 0.00 0.00 0.00 23.12 19.69 1u4f s ALA 225 CO 0.71 -0.21 0.58 -3.38 0.00 0.00 0.00 175.76 173.46 1u4f s HIS 226 N -1.65 -0.50 0.30 0.00 -3.43 -0.61 -0.97 115.29 108.43 1u4f s HIS 226 Ca 0.57 0.38 0.11 0.00 -0.80 0.00 0.00 55.06 55.33 1u4f s HIS 226 Cb -0.22 0.49 -0.05 0.00 -1.43 0.00 0.00 32.58 31.36 1u4f s HIS 226 CO 0.28 -0.78 -0.14 0.14 -2.00 0.00 0.00 174.74 172.23 1u4f s VAL 227 N -3.33 2.45 0.07 -5.38 -7.23 -0.69 -1.53 120.40 104.77 1u4f s VAL 227 Ca -0.01 -2.29 -0.16 0.00 -1.81 0.00 0.00 61.98 57.70 1u4f s VAL 227 Cb -0.01 -2.47 0.03 0.00 0.56 0.00 0.00 36.38 34.50 1u4f s VAL 227 CO -0.09 -0.32 0.39 -0.13 -0.31 0.00 0.00 175.10 174.63 1u4f s ARG 228 N -3.56 0.95 -0.06 4.82 0.52 -0.98 -4.91 118.95 115.74 1u4f s ARG 228 Ca 0.31 -0.52 -0.16 0.00 -0.52 0.00 0.00 55.73 54.84 1u4f s ARG 228 Cb -0.02 0.42 0.03 0.00 0.52 0.00 0.00 34.95 35.90 1u4f s ARG 228 CO 0.16 -0.34 0.37 0.00 0.02 0.00 0.00 175.30 175.51 1u4f s ALA 229 N -2.99 -0.92 0.03 2.13 0.00 -1.26 -0.78 121.76 117.96 1u4f s ALA 229 Ca -0.02 0.65 0.01 0.00 0.00 0.00 0.00 51.96 52.60 1u4f s ALA 229 Cb 0.00 -0.15 -0.02 0.00 0.00 0.00 0.00 23.12 22.96 1u4f s ALA 229 CO -0.06 -0.25 -0.05 -0.65 0.00 0.00 0.00 175.76 174.75 1u4f s GLN 230 N -0.85 0.40 -0.26 0.00 -0.21 0.33 -0.96 119.66 118.10 1u4f s GLN 230 Ca -0.09 -0.62 -0.09 0.00 0.02 0.00 0.00 55.36 54.57 1u4f s GLN 230 Cb -0.04 -0.10 -0.04 0.00 1.00 0.00 0.00 33.01 33.83 1u4f s GLN 230 CO 0.04 0.01 0.13 -1.17 -2.12 0.00 0.00 175.29 172.17 1u4f s LEU 231 N -1.37 3.72 -0.18 2.90 0.20 0.29 -0.13 118.68 124.11 1u4f s LEU 231 Ca -0.12 -0.11 -0.12 0.00 0.69 0.00 0.00 54.13 54.47 1u4f s LEU 231 Cb -0.09 -2.02 -0.05 0.00 -0.43 0.00 0.00 46.19 43.61 1u4f s LEU 231 CO -0.00 -0.04 0.21 -0.76 -0.29 0.00 0.00 176.35 175.47 1u4f s LEU 232 N 1.68 4.23 -0.29 -0.68 1.43 0.26 -1.37 118.68 123.94 1u4f s LEU 232 Ca 0.07 0.38 -0.22 0.00 -1.03 0.00 0.00 54.13 53.33 1u4f s LEU 232 Cb -0.15 -2.24 0.14 0.00 0.03 0.00 0.00 46.19 43.97 1u4f s LEU 232 CO 0.07 0.15 1.06 -0.75 0.23 0.00 0.00 176.35 177.10 1u4f s LYS 233 N 0.36 0.41 0.60 1.70 2.47 -1.06 -2.32 119.74 121.90 1u4f s LYS 233 Ca 0.13 0.56 -0.16 0.00 -1.56 0.00 0.00 55.97 54.93 1u4f s LYS 233 Cb -0.12 0.16 -0.03 0.00 -1.46 0.00 0.00 37.83 36.38 1u4f s LYS 233 CO 0.01 -0.06 1.08 -1.12 0.16 0.00 0.00 175.35 175.42 1u4f s SER 234 N 0.61 5.64 0.16 1.43 0.01 -1.24 -1.25 113.70 119.06 1u4f s SER 234 Ca -0.01 1.91 -0.19 0.00 1.31 0.00 0.00 55.95 58.96 1u4f s SER 234 Cb -0.04 -2.54 0.05 0.00 0.21 0.00 0.00 66.02 63.69 1u4f s SER 234 CO -0.10 -1.27 0.53 0.00 0.41 0.00 0.00 173.24 172.81 1u4f s ARG 235 N -3.95 1.27 -0.13 12.44 1.70 -0.84 -4.88 118.95 124.55 1u4f s ARG 235 Ca 0.66 -0.67 -0.01 0.00 -0.47 0.00 0.00 55.73 55.24 1u4f s ARG 235 Cb -0.18 0.54 -0.02 0.00 -0.57 0.00 0.00 34.95 34.72 1u4f s ARG 235 CO 0.36 -0.54 -0.12 0.42 -1.08 0.00 0.00 175.30 174.34 1u4f s ILE 236 N -3.81 3.15 0.65 4.99 -1.09 -1.26 -1.07 121.20 122.76 1u4f s ILE 236 Ca 0.04 -0.63 -0.11 0.00 -2.23 0.00 0.00 60.65 57.73 1u4f s ILE 236 Cb -0.00 -2.33 -0.02 0.00 -1.58 0.00 0.00 42.46 38.52 1u4f s ILE 236 CO -0.09 0.52 1.04 -0.89 -1.23 0.00 0.00 174.94 174.29 1u4f s THR 237 N 0.36 4.26 -0.30 2.92 2.01 -0.58 -4.90 115.64 119.41 1u4f s THR 237 Ca -0.10 0.70 0.21 0.00 0.31 0.00 0.00 61.69 62.80 1u4f s THR 237 Cb -0.16 -3.72 0.21 0.00 0.01 0.00 0.00 72.50 68.84 1u4f s THR 237 CO 0.05 -0.94 1.63 -1.54 -0.69 0.00 0.00 174.62 173.13 1u4f n SER 238 N -2.82 0.54 -0.19 3.53 3.41 -1.26 -0.15 113.62 116.67 1u4f n SER 238 Ca 0.06 0.73 0.13 0.00 -0.26 0.00 0.00 58.87 59.53 1u4f n SER 238 Cb 0.55 -0.81 0.34 0.00 -0.26 0.00 0.00 64.21 64.03 1u4f n SER 238 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1u4f n GLU 239 N -2.20 0.65 -0.31 4.33 4.71 -1.26 -4.94 120.64 121.61 1u4f n GLU 239 Ca -0.01 -0.38 0.00 0.00 -0.01 0.00 0.00 57.16 56.76 1u4f n GLU 239 Cb 0.06 -1.49 0.00 0.00 -1.01 0.00 0.00 31.44 29.00 1u4f n GLU 239 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1u4f n GLY 240 N 1.38 0.69 3.73 0.62 0.00 0.78 -5.04 105.19 107.35 1u4f n GLY 240 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 1u4f n GLY 240 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1u4f s GLU 241 N -0.66 4.35 -0.21 1.61 2.12 -1.26 -4.74 118.70 119.91 1u4f s GLU 241 Ca 0.00 2.08 -0.15 0.00 0.36 0.00 0.00 54.97 57.26 1u4f s GLU 241 Cb 0.00 -3.21 -0.04 0.00 0.26 0.00 0.00 34.13 31.14 1u4f s GLU 241 CO 0.00 -0.33 0.36 -0.47 -0.54 0.00 0.00 175.26 174.28 1u4f s TYR 242 N 0.46 3.36 -0.42 5.30 5.04 -1.26 -1.53 117.35 128.29 1u4f s TYR 242 Ca 0.60 0.55 -0.06 0.00 -2.44 0.00 0.00 57.07 55.71 1u4f s TYR 242 Cb -0.37 -2.49 0.10 0.00 0.35 0.00 0.00 41.96 39.55 1u4f s TYR 242 CO 0.36 -0.00 0.24 0.42 -1.34 0.00 0.00 175.55 175.23 1u4f s ILE 243 N 1.29 3.78 0.18 3.14 -1.09 -0.24 -5.01 121.20 123.26 1u4f s ILE 243 Ca 0.17 -1.75 -0.23 0.00 -2.23 0.00 0.00 60.65 56.61 1u4f s ILE 243 Cb -0.15 -3.45 0.08 0.00 -1.58 0.00 0.00 42.46 37.37 1u4f s ILE 243 CO 0.07 -0.62 1.46 -2.65 -1.23 0.00 0.00 174.94 171.97 1u4f n PRO 244 N 4.77 -0.32 -3.37 2.79 -0.02 -1.26 -1.99 135.00 135.60 1u4f n PRO 244 Ca -0.07 1.44 -0.13 0.00 -2.02 0.00 0.00 63.50 62.72 1u4f n PRO 244 Cb 0.42 -2.12 -0.08 0.00 -0.02 0.00 0.00 33.50 31.69 1u4f n PRO 244 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1u4f s LEU 245 N -10.56 -0.48 0.11 2.45 1.43 -1.26 -3.61 118.68 106.75 1u4f s LEU 245 Ca -0.12 -0.44 -0.26 0.00 -1.03 0.00 0.00 54.13 52.28 1u4f s LEU 245 Cb 0.15 0.80 -0.07 0.00 0.03 0.00 0.00 46.19 47.10 1u4f s LEU 245 CO 0.63 -0.36 0.79 -0.62 0.23 0.00 0.00 176.35 177.02 1u4f s ASP 246 N 2.45 7.32 -1.07 2.29 2.15 -0.38 -4.81 116.67 124.62 1u4f s ASP 246 Ca 0.10 1.57 -0.08 0.00 0.43 0.00 0.00 52.55 54.57 1u4f s ASP 246 Cb -0.14 -2.49 0.27 0.00 -0.30 0.00 0.00 42.92 40.26 1u4f s ASP 246 CO -0.28 0.09 1.05 -1.10 -0.17 0.00 0.00 175.17 174.76 1u4f s GLN 247 N -0.53 4.03 -0.05 4.34 -0.21 -1.26 -2.57 119.66 123.41 1u4f s GLN 247 Ca 0.38 -3.22 -0.30 0.00 0.02 0.00 0.00 55.36 52.25 1u4f s GLN 247 Cb -0.22 -4.45 -0.03 0.00 1.00 0.00 0.00 33.01 29.30 1u4f s GLN 247 CO 0.25 -1.25 1.23 0.42 -2.12 0.00 0.00 175.29 173.83 1u4f s ILE 248 N -1.25 4.18 0.28 1.08 1.01 -0.47 -4.77 121.20 121.25 1u4f s ILE 248 Ca 0.30 1.51 -0.29 0.00 0.00 0.00 0.00 60.65 62.16 1u4f s ILE 248 Cb -0.10 -3.97 -0.10 0.00 0.01 0.00 0.00 42.46 38.31 1u4f s ILE 248 CO -0.09 -0.01 1.15 -0.62 0.00 0.00 0.00 174.94 175.38 1u4f s ASP 249 N 1.56 7.14 -0.32 3.58 -1.08 -1.26 0.10 116.67 126.40 1u4f s ASP 249 Ca 0.57 2.36 -0.08 0.00 -0.52 0.00 0.00 52.55 54.87 1u4f s ASP 249 Cb -0.25 -2.63 0.01 0.00 -1.46 0.00 0.00 42.92 38.58 1u4f s ASP 249 CO 0.22 -0.25 0.13 -0.63 0.52 0.00 0.00 175.17 175.16 1u4f s ILE 250 N -1.05 4.27 -0.04 4.11 1.01 -0.14 -4.85 121.20 124.50 1u4f s ILE 250 Ca 0.46 -0.66 -0.30 0.00 0.00 0.00 0.00 60.65 60.15 1u4f s ILE 250 Cb -0.34 -3.24 -0.07 0.00 0.01 0.00 0.00 42.46 38.82 1u4f s ILE 250 CO 0.43 0.00 1.85 0.21 0.00 0.00 0.00 174.94 177.44 1u4f s ASN 251 N 1.54 6.42 -0.15 3.58 3.84 -1.26 -4.23 114.94 124.67 1u4f s ASN 251 Ca 0.03 2.36 0.14 0.00 0.21 0.00 0.00 52.86 55.60 1u4f s ASN 251 Cb -0.18 -2.53 0.38 0.00 -0.55 0.00 0.00 41.25 38.37 1u4f s ASN 251 CO 0.04 -1.11 1.19 1.33 -2.79 0.00 0.00 177.10 175.76 1u4f n VAL 252 N 5.81 1.73 0.00 -5.21 0.24 -1.26 -4.25 118.33 115.38 1u4f n VAL 252 Ca 0.20 -2.59 0.00 0.00 -2.04 0.00 0.00 64.34 59.91 1u4f n VAL 252 Cb 0.42 -0.03 0.00 0.00 -1.47 0.00 0.00 33.84 32.77 1u4f n VAL 252 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1u4f n GLY 253 N -0.90 0.95 0.25 7.63 0.00 -1.26 -3.98 105.19 107.89 1u4f n GLY 253 Ca 0.16 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.20 1u4f n GLY 253 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1u4f h PHE 254 N 0.00 -0.13 -0.42 1.61 3.57 -1.92 -0.97 116.94 118.68 1u4f h PHE 254 Ca 0.00 0.05 0.12 0.00 3.53 0.00 0.00 57.97 61.67 1u4f h PHE 254 Cb 0.00 0.16 -0.02 0.00 2.79 0.00 0.00 35.95 38.89 1u4f h PHE 254 CO 0.00 -0.22 0.31 -0.44 -2.23 0.00 0.00 178.31 175.73 1u4f h ASP 255 N 0.08 0.00 -0.13 0.41 3.32 -2.01 -1.38 116.42 116.71 1u4f h ASP 255 Ca 0.35 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.40 1u4f h ASP 255 Cb 0.57 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.12 1u4f h ASP 255 CO -0.61 0.00 0.00 -1.54 -1.72 0.00 0.00 179.24 175.37 1u4f n SER 256 N -4.36 2.21 0.00 6.45 3.41 -0.91 -4.97 113.62 115.44 1u4f n SER 256 Ca 0.07 -1.65 0.00 0.00 -0.26 0.00 0.00 58.87 57.03 1u4f n SER 256 Cb 0.51 -0.08 0.00 0.00 -0.26 0.00 0.00 64.21 64.37 1u4f n SER 256 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1u4f n GLY 257 N 0.46 0.50 0.76 5.00 0.00 -0.47 -4.88 105.19 106.56 1u4f n GLY 257 Ca 0.07 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.12 1u4f n GLY 257 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1u4f n ILE 258 N -2.75 0.66 0.47 -0.61 -5.35 -0.62 -2.47 119.36 108.69 1u4f n ILE 258 Ca 0.00 -0.38 0.12 0.00 -0.27 0.00 0.00 62.75 62.22 1u4f n ILE 258 Cb 0.05 -0.25 0.18 0.00 -1.74 0.00 0.00 39.64 37.88 1u4f n ILE 258 CO 0.00 0.00 0.00 -2.24 -1.76 0.00 0.00 176.55 172.55 1u4f h ASP 259 N 1.23 0.00 -3.45 7.28 2.03 -1.68 -3.44 116.42 118.39 1u4f h ASP 259 Ca 0.00 -0.12 -0.60 0.00 -0.73 0.00 0.00 57.03 55.58 1u4f h ASP 259 Cb 0.75 0.00 -0.10 0.00 -0.83 0.00 0.00 39.33 39.14 1u4f h ASP 259 CO 0.10 0.06 0.45 -0.13 -1.03 0.00 0.00 179.24 178.69 1u4f s ARG 260 N -3.19 3.91 0.28 4.15 0.52 -1.03 -1.70 118.95 121.88 1u4f s ARG 260 Ca 0.06 0.56 0.09 0.00 -0.52 0.00 0.00 55.73 55.91 1u4f s ARG 260 Cb 0.12 -3.76 -0.04 0.00 0.52 0.00 0.00 34.95 31.79 1u4f s ARG 260 CO 0.71 -0.76 0.08 0.96 0.02 0.00 0.00 175.30 176.30 1u4f s ILE 261 N 3.09 3.55 -0.31 1.52 -4.36 -0.15 -4.95 121.20 119.60 1u4f s ILE 261 Ca 0.34 -1.75 0.01 0.00 -0.26 0.00 0.00 60.65 58.99 1u4f s ILE 261 Cb -0.14 -3.00 0.07 0.00 1.25 0.00 0.00 42.46 40.65 1u4f s ILE 261 CO 0.14 -0.32 -0.00 0.12 0.24 0.00 0.00 174.94 175.12 1u4f s PHE 262 N -2.31 3.43 -0.32 1.37 5.36 -1.26 -4.15 117.98 120.10 1u4f s PHE 262 Ca 0.33 -2.38 -0.08 0.00 -0.96 0.00 0.00 56.93 53.85 1u4f s PHE 262 Cb -0.06 -2.38 0.01 0.00 -0.34 0.00 0.00 43.02 40.26 1u4f s PHE 262 CO 0.22 -0.89 0.12 -1.17 -1.46 0.00 0.00 175.22 172.04 1u4f s LEU 263 N 1.10 4.12 0.00 6.12 0.20 -1.26 -4.82 118.68 124.14 1u4f s LEU 263 Ca -0.01 -0.80 0.00 0.00 0.69 0.00 0.00 54.13 54.01 1u4f s LEU 263 Cb -0.20 -1.92 0.00 0.00 -0.43 0.00 0.00 46.19 43.64 1u4f s LEU 263 CO -0.05 -0.25 0.00 0.52 -0.29 0.00 0.00 176.35 176.29 1u4f n VAL 264 N 4.90 0.00 -4.58 1.68 0.31 -1.26 -4.53 118.33 114.85 1u4f n VAL 264 Ca -0.14 0.00 -0.24 0.00 -0.01 0.00 0.00 64.34 63.95 1u4f n VAL 264 Cb 0.47 -0.32 -0.14 0.00 -0.91 0.00 0.00 33.84 32.94 1u4f n VAL 264 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1u4f s SER 265 N -3.02 2.24 -0.02 4.52 0.15 -1.26 -4.91 113.70 111.41 1u4f s SER 265 Ca 0.00 -0.49 -0.34 0.00 0.70 0.00 0.00 55.95 55.82 1u4f s SER 265 Cb 0.00 -0.18 -0.17 0.00 -1.71 0.00 0.00 66.02 63.96 1u4f s SER 265 CO 0.00 0.13 0.93 -2.65 1.20 0.00 0.00 173.24 172.85 1u4f n PRO 266 N 1.91 0.00 -4.85 5.44 -0.02 -1.26 -4.95 135.00 131.27 1u4f n PRO 266 Ca -0.17 0.00 -0.32 0.00 -2.02 0.00 0.00 63.50 60.99 1u4f n PRO 266 Cb 0.54 -1.27 -0.13 0.00 -0.02 0.00 0.00 33.50 32.61 1u4f n PRO 266 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1u4f s ILE 267 N 0.11 2.85 -0.39 4.25 1.01 -0.01 -4.95 121.20 124.06 1u4f s ILE 267 Ca 0.78 -0.95 -0.17 0.00 0.00 0.00 0.00 60.65 60.31 1u4f s ILE 267 Cb -1.09 -2.14 0.01 0.00 0.01 0.00 0.00 42.46 39.26 1u4f s ILE 267 CO 0.49 0.49 0.44 -0.89 0.00 0.00 0.00 174.94 175.47 1u4f s THR 268 N -0.80 5.08 0.06 2.92 2.01 -1.26 -0.68 115.64 122.97 1u4f s THR 268 Ca 0.13 -0.14 -0.30 0.00 0.31 0.00 0.00 61.69 61.69 1u4f s THR 268 Cb -0.10 -3.99 -0.05 0.00 0.01 0.00 0.00 72.50 68.37 1u4f s THR 268 CO 0.02 -0.33 1.01 -0.63 -0.69 0.00 0.00 174.62 174.00 1u4f s ILE 269 N 2.19 4.56 -0.13 1.82 1.09 0.71 -4.91 121.20 126.52 1u4f s ILE 269 Ca 0.13 1.95 0.01 0.00 -1.10 0.00 0.00 60.65 61.65 1u4f s ILE 269 Cb -0.17 -4.25 -0.01 0.00 -1.06 0.00 0.00 42.46 36.98 1u4f s ILE 269 CO 0.13 0.22 -0.16 -0.69 -0.10 0.00 0.00 174.94 174.34 1u4f s VAL 270 N 0.58 2.70 -0.25 2.92 1.01 -1.26 -2.30 120.40 123.79 1u4f s VAL 270 Ca 0.51 -0.78 -0.01 0.00 0.00 0.00 0.00 61.98 61.70 1u4f s VAL 270 Cb -0.23 -2.12 0.03 0.00 0.00 0.00 0.00 36.38 34.06 1u4f s VAL 270 CO 0.29 0.53 -0.06 -2.28 0.00 0.00 0.00 175.10 173.58 1u4f s HIS 271 N 0.51 3.09 -0.34 5.22 5.04 -0.39 -4.61 115.29 123.80 1u4f s HIS 271 Ca -0.11 -1.61 -0.29 0.00 -1.54 0.00 0.00 55.06 51.52 1u4f s HIS 271 Cb -0.16 -2.06 0.02 0.00 0.04 0.00 0.00 32.58 30.42 1u4f s HIS 271 CO 0.04 -0.74 1.10 -1.21 -2.34 0.00 0.00 174.74 171.59 1u4f s GLU 272 N 1.31 4.00 -0.99 2.88 2.02 -1.26 -1.54 118.70 125.13 1u4f s GLU 272 Ca -0.01 1.01 -0.23 0.00 0.02 0.00 0.00 54.97 55.76 1u4f s GLU 272 Cb -0.17 -3.77 0.02 0.00 0.10 0.00 0.00 34.13 30.31 1u4f s GLU 272 CO -0.04 -0.99 1.61 0.42 0.02 0.00 0.00 175.26 176.28 1u4f s ILE 273 N 3.82 3.78 0.00 -1.63 1.01 -0.93 -4.81 121.20 122.43 1u4f s ILE 273 Ca 0.46 -0.66 0.00 0.00 0.00 0.00 0.00 60.65 60.45 1u4f s ILE 273 Cb -0.12 -4.74 0.00 0.00 0.01 0.00 0.00 42.46 37.61 1u4f s ILE 273 CO 0.18 -1.64 0.00 -0.90 0.00 0.00 0.00 174.94 172.59 1u4f n ASP 274 N 10.45 0.67 0.31 3.58 5.68 -1.26 -4.76 116.55 131.22 1u4f n ASP 274 Ca 0.36 -0.51 0.21 0.00 -0.50 0.00 0.00 54.79 54.34 1u4f n ASP 274 Cb 0.50 0.00 1.02 0.00 -1.14 0.00 0.00 41.12 41.50 1u4f n ASP 274 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 1u4f h GLU 275 N 0.00 0.00 -0.09 0.11 9.09 -1.97 -1.88 114.58 119.84 1u4f h GLU 275 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1u4f h GLU 275 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.10 1u4f h GLU 275 CO 0.00 0.00 0.00 -0.25 0.05 0.00 0.00 179.01 178.81 1u4f n ASP 276 N -3.04 2.86 -4.76 3.06 8.00 -1.26 -4.93 116.55 116.48 1u4f n ASP 276 Ca -0.02 -1.93 -0.40 0.00 0.71 0.00 0.00 54.79 53.16 1u4f n ASP 276 Cb 0.14 -0.05 -0.05 0.00 -0.02 0.00 0.00 41.12 41.14 1u4f n ASP 276 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 1u4f s SER 277 N -1.90 7.23 0.00 -2.24 0.15 -0.71 -4.94 113.70 111.29 1u4f s SER 277 Ca 0.31 1.46 0.12 0.00 0.70 0.00 0.00 55.95 58.55 1u4f s SER 277 Cb 0.21 -2.46 0.62 0.00 -1.71 0.00 0.00 66.02 62.68 1u4f s SER 277 CO 0.31 0.10 1.31 -0.81 1.20 0.00 0.00 173.24 175.36 1u4f n PRO 278 N 2.34 0.16 -0.20 5.44 -0.04 -1.26 -1.54 135.00 139.90 1u4f n PRO 278 Ca -0.05 0.18 0.09 0.00 -0.04 0.00 0.00 63.50 63.68 1u4f n PRO 278 Cb 0.50 -1.50 0.19 0.00 -0.04 0.00 0.00 33.50 32.65 1u4f n PRO 278 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1u4f n LEU 279 N -1.30 3.17 -0.33 1.53 4.77 -1.26 -4.62 117.00 118.95 1u4f n LEU 279 Ca 0.06 -1.75 0.08 0.00 -0.03 0.00 0.00 56.01 54.37 1u4f n LEU 279 Cb 0.10 -0.27 0.25 0.00 -2.33 0.00 0.00 43.42 41.18 1u4f n LEU 279 CO 0.10 0.75 1.18 0.22 -1.33 0.00 0.00 177.39 178.30 1u4f h TYR 280 N 3.17 0.99 -0.93 -1.77 3.20 -1.50 -2.16 116.97 117.97 1u4f h TYR 280 Ca 0.00 0.03 -0.58 0.00 3.14 0.00 0.00 58.73 61.32 1u4f h TYR 280 Cb 0.82 -0.30 -0.28 0.00 1.54 0.00 0.00 36.73 38.51 1u4f h TYR 280 CO 0.27 0.31 0.75 -0.25 -1.64 0.00 0.00 178.16 177.59 1u4f n ASP 281 N -4.74 6.21 -4.09 -2.11 8.00 -1.26 -1.96 116.55 116.60 1u4f n ASP 281 Ca 0.19 -3.63 -0.32 0.00 0.71 0.00 0.00 54.79 51.74 1u4f n ASP 281 Cb 0.43 -0.93 -0.16 0.00 -0.02 0.00 0.00 41.12 40.44 1u4f n ASP 281 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1u4f s LEU 282 N -3.40 2.71 0.66 0.64 1.43 -0.81 -4.96 118.68 114.95 1u4f s LEU 282 Ca 0.58 -0.99 0.02 0.00 -1.03 0.00 0.00 54.13 52.71 1u4f s LEU 282 Cb 0.47 -1.49 0.10 0.00 0.03 0.00 0.00 46.19 45.30 1u4f s LEU 282 CO 0.03 -0.09 0.91 -0.94 0.23 0.00 0.00 176.35 176.49 1u4f s SER 283 N 1.22 4.67 0.09 2.29 1.04 -1.26 -4.14 113.70 117.60 1u4f s SER 283 Ca -0.01 -0.42 -0.33 0.00 0.48 0.00 0.00 55.95 55.66 1u4f s SER 283 Cb -0.16 -0.08 -0.15 0.00 0.10 0.00 0.00 66.02 65.72 1u4f s SER 283 CO -0.09 -1.62 1.60 0.50 0.98 0.00 0.00 173.24 174.60 1u4f h LYS 284 N -0.26 -0.85 -0.99 4.02 3.64 -1.50 -1.54 116.57 119.10 1u4f h LYS 284 Ca -0.36 0.06 0.27 0.00 -1.27 0.00 0.00 60.65 59.35 1u4f h LYS 284 Cb 1.28 0.19 -0.13 0.00 -0.41 0.00 0.00 32.23 33.15 1u4f h LYS 284 CO 0.42 -0.57 0.55 0.37 -2.27 0.00 0.00 179.45 177.95 1u4f h GLN 285 N -0.88 0.44 -0.06 1.90 4.15 -1.96 0.25 115.11 118.95 1u4f h GLN 285 Ca -0.05 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.34 1u4f h GLN 285 Cb 0.76 -0.10 -0.00 0.00 0.21 0.00 0.00 27.48 28.34 1u4f h GLN 285 CO -0.01 0.29 0.04 -0.44 -1.93 0.00 0.00 178.83 176.78 1u4f h ASP 286 N 0.45 0.07 0.29 -0.69 3.32 -1.68 -2.27 116.42 115.92 1u4f h ASP 286 Ca 0.66 -0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.70 1u4f h ASP 286 Cb 1.37 -0.02 -0.00 0.00 0.22 0.00 0.00 39.33 40.90 1u4f h ASP 286 CO -0.54 0.05 -0.05 0.40 -1.72 0.00 0.00 179.24 177.39 1u4f h ILE 287 N 0.08 0.31 0.00 0.35 1.08 -0.23 0.26 117.51 119.37 1u4f h ILE 287 Ca 0.02 -0.28 -0.01 0.00 -0.39 0.00 0.00 64.86 64.20 1u4f h ILE 287 Cb -0.01 1.21 -0.00 0.00 -3.07 0.00 0.00 36.82 34.94 1u4f h ILE 287 CO -0.01 0.05 -0.05 0.44 -0.69 0.00 0.00 178.15 177.89 1u4f h ASP 288 N 0.00 0.00 0.00 1.72 3.32 -0.76 -3.20 116.42 117.50 1u4f h ASP 288 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1u4f h ASP 288 Cb 0.20 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.75 1u4f h ASP 288 CO 0.01 0.05 -1.39 0.59 -1.72 0.00 0.00 179.24 176.78 1u4f n ASN 289 N -3.14 1.40 -4.61 6.45 3.02 -0.48 -5.01 115.26 112.89 1u4f n ASN 289 Ca 0.02 -0.23 -0.30 0.00 -0.03 0.00 0.00 54.58 54.04 1u4f n ASN 289 Cb 0.43 1.48 0.19 0.00 -0.61 0.00 0.00 39.78 41.27 1u4f n ASN 289 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1u4f s ALA 290 N -2.82 0.82 -0.01 5.41 0.00 -0.04 -4.98 121.76 120.14 1u4f s ALA 290 Ca -0.02 0.34 0.01 0.00 0.00 0.00 0.00 51.96 52.28 1u4f s ALA 290 Cb 0.10 -3.38 0.02 0.00 0.00 0.00 0.00 23.12 19.86 1u4f s ALA 290 CO 0.60 -3.11 0.94 -3.47 0.00 0.00 0.00 175.76 170.71 1u4f n ASP 291 N -4.46 0.15 -4.21 0.00 4.64 -1.26 -4.77 116.55 106.64 1u4f n ASP 291 Ca 0.09 -1.92 -0.30 0.00 -1.38 0.00 0.00 54.79 51.28 1u4f n ASP 291 Cb 0.53 -0.18 0.18 0.00 -1.04 0.00 0.00 41.12 40.60 1u4f n ASP 291 CO 0.00 0.00 0.00 0.72 -0.82 0.00 0.00 177.20 177.10 1u4f s PHE 292 N -0.17 1.68 -0.01 -0.67 -0.12 -1.26 -4.84 117.98 112.58 1u4f s PHE 292 Ca 0.02 0.40 0.00 0.00 -0.05 0.00 0.00 56.93 57.30 1u4f s PHE 292 Cb 0.02 -3.96 0.01 0.00 -0.63 0.00 0.00 43.02 38.46 1u4f s PHE 292 CO 0.00 -2.66 -0.00 -2.00 -0.05 0.00 0.00 175.22 170.51 1u4f s GLU 293 N -5.79 0.14 -0.26 1.99 2.12 -0.98 -2.44 118.70 113.48 1u4f s GLU 293 Ca 0.72 0.03 -0.04 0.00 0.36 0.00 0.00 54.97 56.04 1u4f s GLU 293 Cb -0.06 -0.25 0.01 0.00 0.26 0.00 0.00 34.13 34.09 1u4f s GLU 293 CO 0.53 -0.06 0.00 0.42 -0.54 0.00 0.00 175.26 175.62 1u4f s ILE 294 N 0.50 3.48 -0.18 -3.70 1.01 0.08 0.90 121.20 123.29 1u4f s ILE 294 Ca -0.05 -0.74 -0.17 0.00 0.00 0.00 0.00 60.65 59.70 1u4f s ILE 294 Cb -0.07 -2.73 -0.04 0.00 0.01 0.00 0.00 42.46 39.63 1u4f s ILE 294 CO -0.01 0.21 0.44 -0.69 0.00 0.00 0.00 174.94 174.89 1u4f s VAL 295 N 1.44 5.18 0.00 2.92 1.01 0.81 -0.51 120.40 131.26 1u4f s VAL 295 Ca 0.03 0.81 0.04 0.00 0.00 0.00 0.00 61.98 62.86 1u4f s VAL 295 Cb -0.16 -3.77 -0.03 0.00 0.00 0.00 0.00 36.38 32.42 1u4f s VAL 295 CO -0.01 0.26 -0.10 0.68 0.00 0.00 0.00 175.10 175.93 1u4f s VAL 296 N 1.18 3.39 0.06 2.92 -7.23 -0.32 -0.51 120.40 119.88 1u4f s VAL 296 Ca 0.22 -0.85 0.04 0.00 -1.81 0.00 0.00 61.98 59.58 1u4f s VAL 296 Cb -0.15 -2.44 -0.03 0.00 0.56 0.00 0.00 36.38 34.32 1u4f s VAL 296 CO 0.09 0.41 -0.12 -0.63 -0.31 0.00 0.00 175.10 174.54 1u4f s ILE 297 N -0.94 0.89 -0.02 -0.62 1.01 0.04 -1.93 121.20 119.63 1u4f s ILE 297 Ca 0.16 -1.17 -0.00 0.00 0.00 0.00 0.00 60.65 59.63 1u4f s ILE 297 Cb -0.11 -0.88 0.03 0.00 0.01 0.00 0.00 42.46 41.51 1u4f s ILE 297 CO 0.06 -0.25 0.03 -0.22 0.00 0.00 0.00 174.94 174.56 1u4f s LEU 298 N -1.59 0.92 0.05 2.97 2.96 -0.49 -2.31 118.68 121.18 1u4f s LEU 298 Ca -0.04 0.05 0.04 0.00 -0.22 0.00 0.00 54.13 53.95 1u4f s LEU 298 Cb -0.10 -0.08 -0.02 0.00 0.50 0.00 0.00 46.19 46.49 1u4f s LEU 298 CO 0.01 -0.15 -0.12 -1.61 -1.32 0.00 0.00 176.35 173.17 1u4f s GLU 299 N 1.25 0.74 0.00 1.98 2.02 -0.58 -0.95 118.70 123.16 1u4f s GLU 299 Ca -0.07 -0.78 0.00 0.00 0.02 0.00 0.00 54.97 54.15 1u4f s GLU 299 Cb -0.13 -0.68 0.00 0.00 0.10 0.00 0.00 34.13 33.42 1u4f s GLU 299 CO -0.03 0.16 0.00 0.41 0.02 0.00 0.00 175.26 175.82 1u4f n GLY 300 N 1.66 0.15 3.69 -1.39 0.00 -1.09 -1.57 105.19 106.63 1u4f n GLY 300 Ca -0.20 -0.90 -0.35 0.00 0.00 0.00 0.00 46.02 44.57 1u4f n GLY 300 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1u4f s MET 301 N -2.00 3.67 0.04 1.61 -1.94 -0.30 -0.38 119.30 120.00 1u4f s MET 301 Ca 0.00 -0.32 -0.30 0.00 -1.71 0.00 0.00 55.69 53.36 1u4f s MET 301 Cb 0.00 -3.12 -0.06 0.00 2.01 0.00 0.00 34.83 33.66 1u4f s MET 301 CO 0.00 0.46 1.31 0.08 -0.01 0.00 0.00 175.02 176.86 1u4f s VAL 302 N -0.15 3.79 0.11 -6.03 1.01 -1.19 -0.25 120.40 117.69 1u4f s VAL 302 Ca 0.07 1.23 -0.36 0.00 0.00 0.00 0.00 61.98 62.93 1u4f s VAL 302 Cb -0.12 -3.79 -0.17 0.00 0.00 0.00 0.00 36.38 32.30 1u4f s VAL 302 CO 0.01 0.05 1.27 1.21 0.00 0.00 0.00 175.10 177.64 1u4f n GLU 303 N 4.62 1.11 -0.95 2.72 2.13 -0.18 -1.31 120.64 128.77 1u4f n GLU 303 Ca 0.11 0.40 0.00 0.00 0.66 0.00 0.00 57.16 58.33 1u4f n GLU 303 Cb 0.44 -1.99 0.00 0.00 0.27 0.00 0.00 31.44 30.16 1u4f n GLU 303 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1u4f n ALA 304 N 2.17 0.00 -2.56 4.31 0.00 -1.26 -4.90 120.51 118.28 1u4f n ALA 304 Ca 0.17 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.33 1u4f n ALA 304 Cb 0.20 -0.21 -0.07 0.00 0.00 0.00 0.00 19.45 19.38 1u4f n ALA 304 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1u4f s THR 305 N -2.82 1.79 -0.39 0.00 -4.23 -0.43 -5.03 115.64 104.53 1u4f s THR 305 Ca 0.00 -1.80 0.14 0.00 -1.18 0.00 0.00 61.69 58.85 1u4f s THR 305 Cb 0.00 -2.59 0.39 0.00 1.34 0.00 0.00 72.50 71.65 1u4f s THR 305 CO 0.00 0.00 1.31 0.00 -0.54 0.00 0.00 174.62 175.39 1u4f n ALA 306 N -1.30 2.58 -2.73 3.99 0.00 -1.26 -4.80 120.51 116.99 1u4f n ALA 306 Ca -0.07 -1.88 -0.35 0.00 0.00 0.00 0.00 53.44 51.13 1u4f n ALA 306 Cb 0.66 -0.53 -0.09 0.00 0.00 0.00 0.00 19.45 19.48 1u4f n ALA 306 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1u4f s MET 307 N -2.13 3.16 -0.23 0.00 -1.94 -1.26 -5.08 119.30 111.82 1u4f s MET 307 Ca 0.32 -0.38 -0.11 0.00 -1.71 0.00 0.00 55.69 53.80 1u4f s MET 307 Cb 0.24 -2.88 -0.05 0.00 2.01 0.00 0.00 34.83 34.16 1u4f s MET 307 CO 0.10 0.64 0.20 0.95 -0.01 0.00 0.00 175.02 176.90 1u4f s THR 308 N -0.71 5.33 0.19 2.05 -4.23 -1.26 -3.19 115.64 113.82 1u4f s THR 308 Ca 0.11 0.28 0.01 0.00 -1.18 0.00 0.00 61.69 60.91 1u4f s THR 308 Cb -0.12 -3.54 -0.04 0.00 1.34 0.00 0.00 72.50 70.14 1u4f s THR 308 CO 0.02 0.33 0.35 -0.89 -0.54 0.00 0.00 174.62 173.90 1u4f s THR 309 N 1.06 5.25 -0.10 3.99 2.01 0.49 -4.95 115.64 123.39 1u4f s THR 309 Ca 0.10 -0.51 -0.02 0.00 0.31 0.00 0.00 61.69 61.57 1u4f s THR 309 Cb -0.14 -3.74 0.04 0.00 0.01 0.00 0.00 72.50 68.67 1u4f s THR 309 CO 0.05 -0.16 0.02 -1.58 -0.69 0.00 0.00 174.62 172.26 1u4f s GLN 310 N -3.33 0.55 -0.10 4.92 0.74 -1.26 -2.69 119.66 118.49 1u4f s GLN 310 Ca 0.37 -0.00 -0.02 0.00 0.05 0.00 0.00 55.36 55.76 1u4f s GLN 310 Cb -0.11 -1.24 -0.03 0.00 1.10 0.00 0.00 33.01 32.72 1u4f s GLN 310 CO 0.29 -0.40 -0.01 0.00 -0.55 0.00 0.00 175.29 174.62 1u4f s ARG 312 N -0.61 0.99 0.15 0.00 0.52 -1.26 -1.40 118.95 117.33 1u4f s ARG 312 Ca 0.10 -1.37 -0.13 0.00 -0.52 0.00 0.00 55.73 53.81 1u4f s ARG 312 Cb -0.12 -0.57 0.05 0.00 0.52 0.00 0.00 34.95 34.82 1u4f s ARG 312 CO 0.02 0.07 0.62 0.45 0.02 0.00 0.00 175.30 176.48 1u4f n SER 313 N -0.01 -1.18 -3.56 0.23 2.88 -0.81 -4.99 113.62 106.18 1u4f n SER 313 Ca -0.12 -1.67 -0.10 0.00 -1.33 0.00 0.00 58.87 55.65 1u4f n SER 313 Cb 0.60 1.93 -0.02 0.00 -0.75 0.00 0.00 64.21 65.97 1u4f n SER 313 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1u4f s SER 314 N -2.49 -0.43 -0.04 -3.46 1.04 -1.26 -1.17 113.70 105.88 1u4f s SER 314 Ca 0.13 -0.17 0.01 0.00 0.48 0.00 0.00 55.95 56.40 1u4f s SER 314 Cb -0.02 0.59 0.02 0.00 0.10 0.00 0.00 66.02 66.71 1u4f s SER 314 CO 0.04 -1.00 -0.04 -0.31 0.98 0.00 0.00 173.24 172.92 1u4f s TYR 315 N -3.65 0.69 0.65 5.02 2.02 0.33 -4.97 117.35 117.44 1u4f s TYR 315 Ca 0.05 -0.18 -0.05 0.00 -0.37 0.00 0.00 57.07 56.52 1u4f s TYR 315 Cb -0.02 -0.65 0.05 0.00 -0.40 0.00 0.00 41.96 40.94 1u4f s TYR 315 CO -0.07 -0.20 0.94 -0.51 -1.57 0.00 0.00 175.55 174.15 1u4f s LEU 316 N 1.01 2.99 0.54 -1.29 1.43 -1.26 -0.74 118.68 121.36 1u4f s LEU 316 Ca -0.10 0.37 0.23 0.00 -1.03 0.00 0.00 54.13 53.60 1u4f s LEU 316 Cb -0.14 -3.10 1.43 0.00 0.03 0.00 0.00 46.19 44.41 1u4f s LEU 316 CO -0.01 -1.41 2.09 0.00 0.23 0.00 0.00 176.35 177.25 1u4f h ALA 317 N -0.37 2.12 -0.01 4.21 0.00 -1.78 -0.02 119.26 123.41 1u4f h ALA 317 Ca -0.44 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1u4f h ALA 317 Cb 1.30 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.11 1u4f h ALA 317 CO 0.58 -0.31 -0.07 0.27 0.00 0.00 0.00 179.25 179.73 1u4f n ASN 318 N -4.29 0.84 -1.10 0.00 6.94 -1.26 -3.37 115.26 113.01 1u4f n ASN 318 Ca 0.03 -1.05 0.10 0.00 -0.02 0.00 0.00 54.58 53.64 1u4f n ASN 318 Cb 0.33 -0.00 0.25 0.00 -2.36 0.00 0.00 39.78 38.00 1u4f n ASN 318 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 1u4f n GLU 319 N -0.50 2.67 -3.57 -3.83 1.02 -0.02 -4.87 120.64 111.54 1u4f n GLU 319 Ca 0.18 -2.40 -0.37 0.00 -0.02 0.00 0.00 57.16 54.55 1u4f n GLU 319 Cb 0.28 -1.47 -0.09 0.00 -0.02 0.00 0.00 31.44 30.15 1u4f n GLU 319 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1u4f s ILE 320 N -1.07 5.31 -0.47 -3.67 -1.09 -1.22 -2.19 121.20 116.81 1u4f s ILE 320 Ca 0.39 0.35 -0.17 0.00 -2.23 0.00 0.00 60.65 59.00 1u4f s ILE 320 Cb 0.21 -3.57 0.05 0.00 -1.58 0.00 0.00 42.46 37.57 1u4f s ILE 320 CO 0.28 0.31 0.45 -0.76 -1.23 0.00 0.00 174.94 173.99 1u4f s LEU 321 N 1.16 5.27 0.11 2.97 1.43 0.28 -4.95 118.68 124.94 1u4f s LEU 321 Ca 0.11 -1.06 -0.30 0.00 -1.03 0.00 0.00 54.13 51.85 1u4f s LEU 321 Cb -0.14 -2.28 -0.06 0.00 0.03 0.00 0.00 46.19 43.74 1u4f s LEU 321 CO 0.06 -0.68 0.98 0.86 0.23 0.00 0.00 176.35 177.79 1u4f s TRP 322 N 1.99 3.78 -0.19 0.29 -0.11 -1.26 -1.77 118.94 121.67 1u4f s TRP 322 Ca 0.08 1.77 -0.00 0.00 1.22 0.00 0.00 56.10 59.18 1u4f s TRP 322 Cb -0.21 -3.08 0.00 0.00 -1.50 0.00 0.00 33.47 28.68 1u4f s TRP 322 CO 0.10 0.11 0.01 0.41 -4.62 0.00 0.00 176.95 172.96 1u4f n GLY 323 N 2.30 0.32 3.25 5.86 0.00 -0.25 -4.93 105.19 111.74 1u4f n GLY 323 Ca 0.03 -0.78 -0.17 0.00 0.00 0.00 0.00 46.02 45.10 1u4f n GLY 323 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1u4f s HIS 324 N -2.18 1.39 0.06 1.61 3.76 -1.21 -0.33 115.29 118.40 1u4f s HIS 324 Ca 0.00 -0.61 0.00 0.00 -0.15 0.00 0.00 55.06 54.31 1u4f s HIS 324 Cb -0.00 -0.71 -0.04 0.00 1.11 0.00 0.00 32.58 32.94 1u4f s HIS 324 CO 0.01 0.15 -0.05 1.03 -0.85 0.00 0.00 174.74 175.03 1u4f s ARG 325 N -3.08 0.62 0.44 1.40 0.52 -0.85 -4.34 118.95 113.66 1u4f s ARG 325 Ca 0.13 -1.11 -0.20 0.00 -0.52 0.00 0.00 55.73 54.03 1u4f s ARG 325 Cb -0.02 0.00 -0.10 0.00 0.52 0.00 0.00 34.95 35.34 1u4f s ARG 325 CO 0.03 -0.05 0.94 0.71 0.02 0.00 0.00 175.30 176.95 1u4f s TYR 326 N -3.14 3.33 0.26 -0.53 1.51 -1.26 -0.85 117.35 116.68 1u4f s TYR 326 Ca 0.03 1.57 -0.29 0.00 -1.01 0.00 0.00 57.07 57.37 1u4f s TYR 326 Cb 0.02 -2.83 -0.09 0.00 -0.11 0.00 0.00 41.96 38.95 1u4f s TYR 326 CO -0.06 -0.13 0.96 -1.21 -1.11 0.00 0.00 175.55 174.00 1u4f s GLU 327 N -3.29 4.77 0.43 -0.62 0.41 -0.28 -4.79 118.70 115.33 1u4f s GLU 327 Ca 0.61 1.48 -0.25 0.00 -0.41 0.00 0.00 54.97 56.41 1u4f s GLU 327 Cb -0.09 -3.15 -0.08 0.00 -1.78 0.00 0.00 34.13 29.03 1u4f s GLU 327 CO 0.16 0.43 1.23 -2.14 -0.49 0.00 0.00 175.26 174.44 1u4f s PRO 328 N -1.42 3.87 0.00 0.39 0.02 -1.26 -4.81 135.00 131.79 1u4f s PRO 328 Ca 0.44 1.96 0.01 0.00 0.02 0.00 0.00 61.00 63.42 1u4f s PRO 328 Cb -0.25 -2.60 -0.01 0.00 0.02 0.00 0.00 34.50 31.67 1u4f s PRO 328 CO 0.31 -0.51 0.09 1.33 -0.33 0.00 0.00 177.00 177.89 1u4f n VAL 329 N -0.15 0.00 -3.78 3.83 0.24 -1.26 -4.86 118.33 112.34 1u4f n VAL 329 Ca 0.05 -0.48 -0.36 0.00 -2.04 0.00 0.00 64.34 61.51 1u4f n VAL 329 Cb 0.46 1.00 -0.13 0.00 -1.47 0.00 0.00 33.84 33.70 1u4f n VAL 329 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 1u4f s LEU 330 N -1.88 3.35 -0.01 1.34 2.96 -1.26 0.61 118.68 123.80 1u4f s LEU 330 Ca 0.00 -0.23 0.06 0.00 -0.22 0.00 0.00 54.13 53.74 1u4f s LEU 330 Cb 0.01 -1.89 -0.02 0.00 0.50 0.00 0.00 46.19 44.79 1u4f s LEU 330 CO 0.04 -0.03 -0.19 -0.36 -1.32 0.00 0.00 176.35 174.49 1u4f s PHE 331 N 1.58 1.68 -0.10 5.38 0.08 -0.40 -5.00 117.98 121.20 1u4f s PHE 331 Ca 0.06 -0.32 -0.25 0.00 0.12 0.00 0.00 56.93 56.54 1u4f s PHE 331 Cb -0.15 -1.07 -0.03 0.00 -0.57 0.00 0.00 43.02 41.20 1u4f s PHE 331 CO 0.03 -0.02 0.78 -2.00 -0.10 0.00 0.00 175.22 173.90 1u4f s GLU 332 N -0.49 4.40 0.09 0.44 2.12 -1.26 -1.62 118.70 122.39 1u4f s GLU 332 Ca 0.07 0.98 0.02 0.00 0.36 0.00 0.00 54.97 56.40 1u4f s GLU 332 Cb -0.07 -3.50 0.02 0.00 0.26 0.00 0.00 34.13 30.84 1u4f s GLU 332 CO -0.01 -0.09 0.13 0.39 -0.54 0.00 0.00 175.26 175.14 1u4f n GLU 333 N 4.33 0.95 -0.16 4.30 -0.58 -0.60 -4.97 120.64 123.91 1u4f n GLU 333 Ca 0.02 -0.50 -0.10 0.00 -0.42 0.00 0.00 57.16 56.15 1u4f n GLU 333 Cb 0.50 -0.03 -0.00 0.00 -0.57 0.00 0.00 31.44 31.34 1u4f n GLU 333 CO 0.00 0.00 0.00 -0.22 -0.48 0.00 0.00 177.13 176.43 1u4f h LYS 334 N 0.00 0.84 0.00 3.49 3.64 -2.03 -3.39 116.57 119.12 1u4f h LYS 334 Ca -0.04 -0.29 -0.05 0.00 -1.27 0.00 0.00 60.65 59.00 1u4f h LYS 334 Cb 0.20 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.95 1u4f h LYS 334 CO 0.06 0.92 -1.17 0.72 -2.27 0.00 0.00 179.45 177.71 1u4f n HIS 335 N -4.32 0.00 -3.62 1.91 8.25 -1.26 -4.91 115.22 111.26 1u4f n HIS 335 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1u4f n HIS 335 Cb 0.34 -0.12 0.00 0.00 1.12 0.00 0.00 29.99 31.33 1u4f n HIS 335 CO 0.00 0.00 0.00 2.48 0.64 0.00 0.00 176.34 179.46 1u4f n TYR 336 N -2.25 -0.11 -4.67 4.41 0.18 -1.26 -4.51 117.16 108.94 1u4f n TYR 336 Ca -0.04 0.00 -0.23 0.00 1.88 0.00 0.00 57.90 59.51 1u4f n TYR 336 Cb 0.57 0.00 -0.15 0.00 -0.38 0.00 0.00 39.34 39.38 1u4f n TYR 336 CO 0.00 0.00 0.00 0.71 -2.08 0.00 0.00 176.86 175.49 1u4f s TYR 337 N -0.27 1.32 0.05 -3.48 1.51 -0.07 -1.56 117.35 114.85 1u4f s TYR 337 Ca 0.00 -0.25 0.06 0.00 -1.01 0.00 0.00 57.07 55.87 1u4f s TYR 337 Cb 0.00 -0.85 -0.03 0.00 -0.11 0.00 0.00 41.96 40.97 1u4f s TYR 337 CO 0.00 -0.02 -0.15 -1.59 -1.11 0.00 0.00 175.55 172.68 1u4f s LYS 338 N -0.39 2.15 -0.19 -0.62 -2.85 -0.64 -0.55 119.74 116.65 1u4f s LYS 338 Ca 0.06 -0.95 -0.02 0.00 -1.00 0.00 0.00 55.97 54.05 1u4f s LYS 338 Cb -0.06 -2.26 -0.00 0.00 -2.06 0.00 0.00 37.83 33.45 1u4f s LYS 338 CO -0.00 0.54 -0.09 0.08 0.10 0.00 0.00 175.35 175.98 1u4f s VAL 339 N -1.00 3.06 -0.68 1.79 1.01 0.42 -1.28 120.40 123.72 1u4f s VAL 339 Ca 0.16 -0.61 -0.11 0.00 0.00 0.00 0.00 61.98 61.42 1u4f s VAL 339 Cb -0.11 -2.35 0.18 0.00 0.00 0.00 0.00 36.38 34.10 1u4f s VAL 339 CO 0.07 0.47 0.59 -0.62 0.00 0.00 0.00 175.10 175.61 1u4f s ASP 340 N 1.20 6.20 0.35 3.32 -1.08 0.20 -1.29 116.67 125.57 1u4f s ASP 340 Ca 0.02 -2.45 0.24 0.00 -0.52 0.00 0.00 52.55 49.84 1u4f s ASP 340 Cb -0.14 -2.11 1.27 0.00 -1.46 0.00 0.00 42.92 40.48 1u4f s ASP 340 CO -0.03 -0.60 1.73 1.88 0.52 0.00 0.00 175.17 178.66 1u4f h TYR 341 N 7.93 0.00 0.00 -5.34 -1.99 -1.70 -1.12 116.97 114.75 1u4f h TYR 341 Ca -0.04 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.69 1u4f h TYR 341 Cb 1.04 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.77 1u4f h TYR 341 CO 0.86 0.00 0.00 -1.13 -0.00 0.00 0.00 178.16 177.89 1u4f n SER 342 N -2.33 0.35 -0.28 3.88 3.41 -1.25 -1.24 113.62 116.16 1u4f n SER 342 Ca -0.01 0.60 0.11 0.00 -0.26 0.00 0.00 58.87 59.31 1u4f n SER 342 Cb 0.05 -0.67 0.03 0.00 -0.26 0.00 0.00 64.21 63.36 1u4f n SER 342 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1u4f n ARG 343 N -1.90 0.70 -0.17 4.33 3.00 -0.42 -4.66 116.66 117.53 1u4f n ARG 343 Ca 0.02 -0.56 -0.13 0.00 -0.01 0.00 0.00 57.85 57.18 1u4f n ARG 343 Cb 0.15 -1.49 -0.09 0.00 0.00 0.00 0.00 32.46 31.04 1u4f n ARG 343 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.63 177.98 1u4f h PHE 344 N 1.35 -1.64 0.00 -1.55 3.57 -1.30 -2.29 116.94 115.08 1u4f h PHE 344 Ca 0.00 0.09 0.00 0.00 3.53 0.00 0.00 57.97 61.59 1u4f h PHE 344 Cb 0.63 0.78 0.00 0.00 2.79 0.00 0.00 35.95 40.15 1u4f h PHE 344 CO 0.00 -0.47 -0.05 0.72 -2.23 0.00 0.00 178.31 176.28 1u4f n HIS 345 N -5.37 0.51 -2.55 0.41 8.25 -1.26 -4.85 115.22 110.36 1u4f n HIS 345 Ca -0.02 0.15 -0.34 0.00 -0.26 0.00 0.00 57.72 57.24 1u4f n HIS 345 Cb 0.34 -0.73 -0.04 0.00 1.12 0.00 0.00 29.99 30.68 1u4f n HIS 345 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 1u4f s LYS 346 N -3.06 3.87 0.24 -0.41 -0.14 -0.86 -4.82 119.74 114.56 1u4f s LYS 346 Ca 0.12 1.39 0.01 0.00 -1.36 0.00 0.00 55.97 56.12 1u4f s LYS 346 Cb 0.15 -2.18 -0.04 0.00 -1.68 0.00 0.00 37.83 34.09 1u4f s LYS 346 CO 0.58 -0.37 0.19 0.95 -0.76 0.00 0.00 175.35 175.93 1u4f s THR 347 N -1.92 0.00 0.05 2.17 -4.23 -1.26 -1.13 115.64 109.32 1u4f s THR 347 Ca 0.65 -1.97 0.00 0.00 -1.18 0.00 0.00 61.69 59.20 1u4f s THR 347 Cb -0.17 -2.49 -0.03 0.00 1.34 0.00 0.00 72.50 71.14 1u4f s THR 347 CO 0.21 0.00 -0.04 -0.72 -0.54 0.00 0.00 174.62 173.53 1u4f s TYR 348 N -3.96 0.50 0.46 3.99 -0.85 -0.03 -4.81 117.35 112.65 1u4f s TYR 348 Ca 0.39 -0.79 -0.20 0.00 -0.52 0.00 0.00 57.07 55.95 1u4f s TYR 348 Cb 0.05 -0.34 -0.10 0.00 0.38 0.00 0.00 41.96 41.96 1u4f s TYR 348 CO 0.16 -0.25 0.97 -1.21 -1.52 0.00 0.00 175.55 173.71 1u4f s GLU 349 N -2.77 4.08 -0.47 -3.49 2.02 -1.26 -2.00 118.70 114.82 1u4f s GLU 349 Ca -0.02 1.13 0.04 0.00 0.02 0.00 0.00 54.97 56.14 1u4f s GLU 349 Cb -0.01 -2.15 0.17 0.00 0.10 0.00 0.00 34.13 32.23 1u4f s GLU 349 CO -0.05 -0.16 0.36 0.08 0.02 0.00 0.00 175.26 175.51 1u4f s VAL 350 N -2.24 0.91 0.47 2.63 1.01 0.56 -4.91 120.40 118.82 1u4f s VAL 350 Ca 0.62 -2.91 0.25 0.00 0.00 0.00 0.00 61.98 59.95 1u4f s VAL 350 Cb -0.11 -1.62 0.44 0.00 0.00 0.00 0.00 36.38 35.09 1u4f s VAL 350 CO 0.18 -1.15 1.83 -0.65 0.00 0.00 0.00 175.10 175.31 1u4f h PRO 351 N 5.75 0.21 0.00 2.72 0.11 -1.97 -1.05 132.00 137.78 1u4f h PRO 351 Ca 0.21 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 66.31 1u4f h PRO 351 Cb 0.88 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 31.95 1u4f h PRO 351 CO 0.44 0.14 -0.00 -0.97 -0.21 0.00 0.00 178.00 177.40 1u4f h ASN 352 N 0.22 0.00 -1.89 -2.05 -0.00 -1.94 -3.45 115.58 106.47 1u4f h ASN 352 Ca 0.52 0.00 -0.65 0.00 -0.00 0.00 0.00 56.30 56.16 1u4f h ASN 352 Cb 1.63 0.00 0.03 0.00 -0.00 0.00 0.00 38.32 39.98 1u4f h ASN 352 CO -0.14 0.00 0.94 0.41 -0.00 0.00 0.00 177.43 178.64 1u4f n THR 353 N -3.37 0.36 -1.69 -3.57 -1.04 -0.40 -4.92 114.28 99.65 1u4f n THR 353 Ca -0.03 -0.06 -0.40 0.00 -2.04 0.00 0.00 64.05 61.52 1u4f n THR 353 Cb 0.08 -1.53 0.02 0.00 -1.82 0.00 0.00 70.33 67.08 1u4f n THR 353 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 1u4f n PRO 354 N 5.41 1.70 0.00 -2.82 -0.02 -1.26 -4.92 135.00 133.10 1u4f n PRO 354 Ca 0.23 0.61 0.10 0.00 -2.02 0.00 0.00 63.50 62.42 1u4f n PRO 354 Cb 0.23 -2.37 -0.09 0.00 -0.02 0.00 0.00 33.50 31.26 1u4f n PRO 354 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1u4f n LEU 355 N -0.14 0.98 -4.91 2.45 4.77 -1.26 -4.90 117.00 114.00 1u4f n LEU 355 Ca 0.08 -0.46 -0.28 0.00 -0.03 0.00 0.00 56.01 55.32 1u4f n LEU 355 Cb 0.42 -0.02 0.02 0.00 -2.33 0.00 0.00 43.42 41.50 1u4f n LEU 355 CO 0.56 0.24 0.53 0.00 -1.33 0.00 0.00 177.39 177.40 1u4f s SER 357 N -4.21 3.26 0.48 0.00 1.04 -1.26 -4.70 113.70 108.31 1u4f s SER 357 Ca 0.52 1.71 0.13 0.00 0.48 0.00 0.00 55.95 58.79 1u4f s SER 357 Cb -0.11 -2.35 1.12 0.00 0.10 0.00 0.00 66.02 64.79 1u4f s SER 357 CO 0.46 -2.80 2.10 0.00 0.98 0.00 0.00 173.24 173.98 1u4f h ALA 358 N -1.66 1.87 -0.27 5.32 0.00 -1.71 -1.93 119.26 120.88 1u4f h ALA 358 Ca -0.48 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.35 1u4f h ALA 358 Cb 1.28 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 1u4f h ALA 358 CO 0.51 0.11 0.01 -0.09 0.00 0.00 0.00 179.25 179.78 1u4f h ARG 359 N 0.13 0.47 -0.69 0.00 2.43 -1.74 -1.86 114.38 113.13 1u4f h ARG 359 Ca 0.03 -0.15 0.08 0.00 -0.81 0.00 0.00 59.98 59.14 1u4f h ARG 359 Cb 0.05 -0.04 -0.06 0.00 -0.42 0.00 0.00 29.97 29.49 1u4f h ARG 359 CO -0.00 0.63 0.35 -0.44 -1.51 0.00 0.00 179.97 179.00 1u4f h ASP 360 N 0.26 0.48 0.22 -3.80 3.45 -1.66 0.16 116.42 115.55 1u4f h ASP 360 Ca 0.08 0.05 -0.08 0.00 0.43 0.00 0.00 57.03 57.51 1u4f h ASP 360 Cb 0.41 -0.04 -0.01 0.00 -0.56 0.00 0.00 39.33 39.13 1u4f h ASP 360 CO 0.01 0.29 -0.31 -0.07 -1.57 0.00 0.00 179.24 177.59 1u4f h LEU 361 N 0.62 0.15 -0.02 1.55 3.38 -1.32 -0.88 115.31 118.78 1u4f h LEU 361 Ca 0.33 -0.05 -0.08 0.00 0.09 0.00 0.00 57.88 58.17 1u4f h LEU 361 Cb 0.30 -0.04 0.01 0.00 0.09 0.00 0.00 40.66 41.02 1u4f h LEU 361 CO -0.24 0.46 -0.29 0.00 0.09 0.00 0.00 178.44 178.46 1u4f h ALA 362 N 1.55 0.07 0.00 1.53 0.00 -0.32 -3.19 119.26 118.91 1u4f h ALA 362 Ca 0.02 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1u4f h ALA 362 Cb 0.63 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1u4f h ALA 362 CO 0.05 0.13 0.00 0.93 0.00 0.00 0.00 179.25 180.35 1u4f h GLU 363 N -0.35 0.00 -1.82 0.00 5.08 -0.70 -3.18 114.58 113.60 1u4f h GLU 363 Ca -0.03 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.22 1u4f h GLU 363 Cb 1.00 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.20 1u4f h GLU 363 CO 0.06 0.00 0.15 1.17 -1.00 0.00 0.00 179.01 179.39 1u4f n LYS 364 N -2.40 1.28 0.00 2.33 4.81 -0.34 -5.08 118.16 118.76 1u4f n LYS 364 Ca 0.03 -0.55 0.00 0.00 -0.87 0.00 0.00 58.31 56.91 1u4f n LYS 364 Cb 0.31 -1.22 0.00 0.00 0.02 0.00 0.00 35.03 34.14 1u4f n LYS 364 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20