#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1udn n SER 3 N 0.00 -0.68 -0.84 0.55 3.41 -1.26 0.16 113.62 114.95 1udn n SER 3 Ca 0.00 1.54 0.02 0.00 -0.26 0.00 0.00 58.87 60.18 1udn n SER 3 Cb 0.00 -0.30 0.12 0.00 -0.26 0.00 0.00 64.21 63.77 1udn n SER 3 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1udn n ASP 4 N -5.23 2.24 -0.75 4.04 3.85 -1.26 -4.88 116.55 114.56 1udn n ASP 4 Ca 0.07 -2.24 -0.10 0.00 -0.71 0.00 0.00 54.79 51.81 1udn n ASP 4 Cb 0.31 -0.49 -0.04 0.00 -1.35 0.00 0.00 41.12 39.55 1udn n ASP 4 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1udn n GLY 5 N 0.30 1.10 3.84 6.12 0.00 0.12 -5.00 105.19 111.68 1udn n GLY 5 Ca 0.08 -0.35 -0.35 0.00 0.00 0.00 0.00 46.02 45.40 1udn n GLY 5 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1udn s ARG 6 N -2.66 4.00 1.05 1.61 3.52 -1.26 -4.88 118.95 120.33 1udn s ARG 6 Ca 0.00 0.52 -0.12 0.00 -0.13 0.00 0.00 55.73 56.00 1udn s ARG 6 Cb 0.00 -2.93 0.22 0.00 -1.56 0.00 0.00 34.95 30.68 1udn s ARG 6 CO 0.00 0.47 1.07 0.15 -0.81 0.00 0.00 175.30 176.18 1udn s LYS 7 N -1.96 0.03 0.24 5.12 1.02 -1.26 -3.77 119.74 119.15 1udn s LYS 7 Ca 0.38 0.71 0.06 0.00 0.02 0.00 0.00 55.97 57.14 1udn s LYS 7 Cb -0.15 -1.67 0.24 0.00 -0.52 0.00 0.00 37.83 35.72 1udn s LYS 7 CO 0.19 -3.05 1.55 0.93 -0.92 0.00 0.00 175.35 174.05 1udn h GLU 8 N -2.13 0.17 -0.68 1.68 5.08 -1.96 -3.11 114.58 113.63 1udn h GLU 8 Ca -0.56 -0.13 -0.27 0.00 -1.00 0.00 0.00 59.36 57.40 1udn h GLU 8 Cb 1.32 0.02 -0.16 0.00 0.50 0.00 0.00 28.75 30.44 1udn h GLU 8 CO 0.54 0.76 0.28 -0.40 -1.00 0.00 0.00 179.01 179.18 1udn n ASP 9 N -3.82 3.98 -4.31 1.42 5.75 -1.26 -0.99 116.55 117.32 1udn n ASP 9 Ca -0.02 -3.42 -0.32 0.00 -0.01 0.00 0.00 54.79 51.02 1udn n ASP 9 Cb 0.64 -0.73 -0.16 0.00 -1.03 0.00 0.00 41.12 39.85 1udn n ASP 9 CO 0.00 0.00 0.00 -1.58 -0.11 0.00 0.00 177.20 175.51 1udn s GLN 10 N -3.11 3.15 0.76 0.11 0.74 -1.18 -4.96 119.66 115.17 1udn s GLN 10 Ca 0.52 -0.78 -0.11 0.00 0.05 0.00 0.00 55.36 55.04 1udn s GLN 10 Cb 0.43 -2.45 0.05 0.00 1.10 0.00 0.00 33.01 32.14 1udn s GLN 10 CO 0.10 0.23 1.09 -0.51 -0.55 0.00 0.00 175.29 175.65 1udn s LEU 11 N 0.26 2.73 0.90 3.68 1.43 -1.26 -4.72 118.68 121.69 1udn s LEU 11 Ca -0.13 1.28 -0.14 0.00 -1.03 0.00 0.00 54.13 54.12 1udn s LEU 11 Cb -0.16 -3.97 0.16 0.00 0.03 0.00 0.00 46.19 42.25 1udn s LEU 11 CO 0.07 -1.75 1.26 -0.13 0.23 0.00 0.00 176.35 176.03 1udn s ARG 12 N -5.20 1.10 0.01 1.70 3.00 -1.26 -4.95 118.95 113.34 1udn s ARG 12 Ca 0.60 -0.29 -0.30 0.00 0.00 0.00 0.00 55.73 55.73 1udn s ARG 12 Cb -0.13 -1.91 -0.07 0.00 0.00 0.00 0.00 34.95 32.84 1udn s ARG 12 CO 0.54 -2.11 1.77 -2.14 0.00 0.00 0.00 175.30 173.35 1udn s PRO 13 N -5.75 4.17 -0.06 3.54 0.02 -1.26 -4.75 135.00 130.91 1udn s PRO 13 Ca 0.70 2.38 -0.03 0.00 0.02 0.00 0.00 61.00 64.07 1udn s PRO 13 Cb -0.06 -3.95 -0.04 0.00 0.02 0.00 0.00 34.50 30.47 1udn s PRO 13 CO 0.51 -0.86 0.11 0.08 -0.33 0.00 0.00 177.00 176.51 1udn s VAL 14 N 3.84 5.07 -0.07 3.83 1.01 -1.26 -2.13 120.40 130.69 1udn s VAL 14 Ca 0.79 -0.13 -0.03 0.00 0.00 0.00 0.00 61.98 62.62 1udn s VAL 14 Cb -0.38 -3.27 0.04 0.00 0.00 0.00 0.00 36.38 32.77 1udn s VAL 14 CO 0.35 0.47 0.15 -0.55 0.00 0.00 0.00 175.10 175.52 1udn s SER 15 N -1.41 0.12 -0.12 3.32 0.15 -0.61 -0.74 113.70 114.40 1udn s SER 15 Ca 0.20 0.30 0.01 0.00 0.70 0.00 0.00 55.95 57.16 1udn s SER 15 Cb -0.12 0.20 0.02 0.00 -1.71 0.00 0.00 66.02 64.41 1udn s SER 15 CO 0.10 -0.17 -0.13 -0.63 1.20 0.00 0.00 173.24 173.60 1udn s ILE 16 N 1.47 1.40 -0.24 6.45 1.01 -0.02 -0.72 121.20 130.56 1udn s ILE 16 Ca -0.06 -0.56 0.01 0.00 0.00 0.00 0.00 60.65 60.05 1udn s ILE 16 Cb -0.12 -1.31 0.04 0.00 0.01 0.00 0.00 42.46 41.08 1udn s ILE 16 CO -0.06 0.43 -0.12 -1.58 0.00 0.00 0.00 174.94 173.60 1udn s GLN 17 N 1.27 2.58 0.62 2.79 0.74 -0.21 -1.57 119.66 125.88 1udn s GLN 17 Ca -0.01 -1.12 -0.05 0.00 0.05 0.00 0.00 55.36 54.23 1udn s GLN 17 Cb -0.14 -2.82 0.03 0.00 1.10 0.00 0.00 33.01 31.18 1udn s GLN 17 CO -0.05 -0.43 0.92 -0.98 -0.55 0.00 0.00 175.29 174.19 1udn s ARG 18 N 1.20 2.62 -1.52 1.67 1.70 -0.21 -1.14 118.95 123.27 1udn s ARG 18 Ca -0.03 -0.21 -0.06 0.00 -0.47 0.00 0.00 55.73 54.96 1udn s ARG 18 Cb -0.17 -2.27 0.01 0.00 -0.57 0.00 0.00 34.95 31.94 1udn s ARG 18 CO -0.07 -0.87 0.69 -0.25 -1.08 0.00 0.00 175.30 173.72 1udn n ASP 19 N -2.65 -6.03 -0.17 -2.89 10.43 -0.09 -4.86 116.55 110.28 1udn n ASP 19 Ca 0.06 -0.34 -0.05 0.00 2.57 0.00 0.00 54.79 57.03 1udn n ASP 19 Cb 0.59 -4.86 0.12 0.00 1.84 0.00 0.00 41.12 38.81 1udn n ASP 19 CO 0.00 0.00 0.00 0.15 -1.07 0.00 0.00 177.20 176.28 1udn h PHE 20 N -1.57 0.99 -2.82 1.24 3.57 -1.71 -3.44 116.94 113.20 1udn h PHE 20 Ca -0.53 -0.12 -0.50 0.00 3.53 0.00 0.00 57.97 60.34 1udn h PHE 20 Cb 1.36 -0.28 -0.15 0.00 2.79 0.00 0.00 35.95 39.68 1udn h PHE 20 CO 0.54 0.85 -0.75 -0.51 -2.23 0.00 0.00 178.31 176.20 1udn s LEU 21 N -9.34 2.54 -0.06 0.59 1.43 -1.26 -5.04 118.68 107.54 1udn s LEU 21 Ca -0.11 -0.99 -0.11 0.00 -1.03 0.00 0.00 54.13 51.89 1udn s LEU 21 Cb 0.15 -0.80 -0.30 0.00 0.03 0.00 0.00 46.19 45.26 1udn s LEU 21 CO 0.82 -0.10 0.64 -0.33 0.23 0.00 0.00 176.35 177.62 1udn h GLU 22 N 2.64 0.39 -0.39 1.70 3.07 -2.01 -3.41 114.58 116.57 1udn h GLU 22 Ca -0.39 -0.66 -0.14 0.00 -0.50 0.00 0.00 59.36 57.67 1udn h GLU 22 Cb 1.23 0.25 -0.01 0.00 -0.84 0.00 0.00 28.75 29.37 1udn h GLU 22 CO 0.59 1.32 -0.30 1.88 -1.40 0.00 0.00 179.01 181.09 1udn h TYR 23 N 0.09 1.00 -4.08 4.33 0.99 -2.00 -3.45 116.97 113.85 1udn h TYR 23 Ca -0.35 -0.26 -0.47 0.00 2.00 0.00 0.00 58.73 59.65 1udn h TYR 23 Cb 2.09 -0.22 0.02 0.00 1.00 0.00 0.00 36.73 39.62 1udn h TYR 23 CO 0.10 1.05 0.38 -2.14 -0.00 0.00 0.00 178.16 177.55 1udn s PRO 24 N -4.49 3.81 0.46 4.88 0.02 -1.26 -4.92 135.00 133.49 1udn s PRO 24 Ca -0.10 1.35 0.15 0.00 0.02 0.00 0.00 61.00 62.42 1udn s PRO 24 Cb 0.12 -2.10 1.09 0.00 0.02 0.00 0.00 34.50 33.63 1udn s PRO 24 CO 0.86 -0.43 2.01 0.93 -0.33 0.00 0.00 177.00 180.04 1udn h GLU 25 N 1.55 0.31 -3.33 5.54 3.07 -1.74 -3.42 114.58 116.55 1udn h GLU 25 Ca -0.49 -0.02 -0.16 0.00 -0.50 0.00 0.00 59.36 58.18 1udn h GLU 25 Cb 1.22 -0.07 -0.24 0.00 -0.84 0.00 0.00 28.75 28.82 1udn h GLU 25 CO 0.59 0.21 -0.48 0.20 -1.40 0.00 0.00 179.01 178.13 1udn s GLY 26 N -3.84 -0.08 -0.17 -3.84 0.00 -0.98 -3.93 107.32 94.47 1udn s GLY 26 Ca -0.07 0.31 -0.29 0.00 0.00 0.00 0.00 44.72 44.67 1udn s GLY 26 CO 0.73 0.21 0.90 -1.35 0.00 0.00 0.00 173.10 173.59 1udn s SER 27 N -0.46 -0.50 0.15 1.64 1.04 -1.26 0.05 113.70 114.36 1udn s SER 27 Ca -0.06 0.68 -0.18 0.00 0.48 0.00 0.00 55.95 56.88 1udn s SER 27 Cb -0.04 0.60 0.04 0.00 0.10 0.00 0.00 66.02 66.72 1udn s SER 27 CO 0.01 -0.36 0.47 0.00 0.98 0.00 0.00 173.24 174.34 1udn s LEU 29 N -2.82 2.96 0.07 0.00 2.96 -0.29 -0.39 118.68 121.17 1udn s LEU 29 Ca 0.05 -0.73 0.07 0.00 -0.22 0.00 0.00 54.13 53.29 1udn s LEU 29 Cb 0.00 -1.65 -0.04 0.00 0.50 0.00 0.00 46.19 45.01 1udn s LEU 29 CO -0.09 -0.08 -0.15 -0.51 -1.32 0.00 0.00 176.35 174.20 1udn s ILE 30 N 1.35 3.05 -0.05 6.68 2.07 -0.91 -1.04 121.20 132.36 1udn s ILE 30 Ca 0.02 -1.24 -0.04 0.00 -1.41 0.00 0.00 60.65 57.98 1udn s ILE 30 Cb -0.16 -2.36 0.01 0.00 0.13 0.00 0.00 42.46 40.09 1udn s ILE 30 CO -0.06 0.23 0.12 -0.94 -1.91 0.00 0.00 174.94 172.38 1udn s SER 31 N -1.81 -0.12 -0.42 4.50 1.04 0.10 -1.65 113.70 115.35 1udn s SER 31 Ca 0.17 0.24 0.04 0.00 0.48 0.00 0.00 55.95 56.88 1udn s SER 31 Cb -0.11 0.22 0.11 0.00 0.10 0.00 0.00 66.02 66.35 1udn s SER 31 CO 0.09 -0.05 0.15 -0.36 0.98 0.00 0.00 173.24 174.04 1udn s PHE 32 N 0.22 3.29 0.00 5.02 0.40 -0.34 -1.58 117.98 124.99 1udn s PHE 32 Ca -0.01 -2.96 0.00 0.00 -0.60 0.00 0.00 56.93 53.35 1udn s PHE 32 Cb -0.02 -2.75 0.00 0.00 0.51 0.00 0.00 43.02 40.76 1udn s PHE 32 CO -0.01 -0.85 0.00 0.41 0.70 0.00 0.00 175.22 175.47 1udn n GLY 33 N 3.78 2.69 0.13 4.36 0.00 -0.91 -1.72 105.19 113.53 1udn n GLY 33 Ca 0.04 -0.29 0.13 0.00 0.00 0.00 0.00 46.02 45.90 1udn n GLY 33 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1udn h LYS 34 N 0.00 0.00 -6.23 1.61 1.79 -1.93 -3.44 116.57 108.37 1udn h LYS 34 Ca 0.00 0.00 -0.56 0.00 -2.18 0.00 0.00 60.65 57.91 1udn h LYS 34 Cb 0.00 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 30.62 1udn h LYS 34 CO 0.00 0.00 1.02 0.99 -1.08 0.00 0.00 179.45 180.38 1udn s THR 35 N -3.13 3.90 -0.04 -0.16 2.01 -0.70 -4.40 115.64 113.12 1udn s THR 35 Ca 0.10 1.07 0.04 0.00 0.31 0.00 0.00 61.69 63.21 1udn s THR 35 Cb 0.11 -3.76 -0.00 0.00 0.01 0.00 0.00 72.50 68.85 1udn s THR 35 CO 0.61 -0.17 -0.15 -0.54 -0.69 0.00 0.00 174.62 173.68 1udn s LYS 36 N 3.99 1.58 -0.04 4.92 1.02 0.82 -1.20 119.74 130.83 1udn s LYS 36 Ca 0.65 -0.53 -0.01 0.00 0.02 0.00 0.00 55.97 56.10 1udn s LYS 36 Cb -0.26 -1.39 0.03 0.00 -0.52 0.00 0.00 37.83 35.69 1udn s LYS 36 CO 0.23 0.20 0.02 0.08 -0.92 0.00 0.00 175.35 174.97 1udn s VAL 37 N 0.11 0.12 -0.21 3.17 1.01 -0.66 -0.87 120.40 123.07 1udn s VAL 37 Ca -0.04 0.22 -0.24 0.00 0.00 0.00 0.00 61.98 61.92 1udn s VAL 37 Cb -0.11 -0.28 -0.01 0.00 0.00 0.00 0.00 36.38 35.97 1udn s VAL 37 CO 0.02 0.18 0.79 -0.63 0.00 0.00 0.00 175.10 175.46 1udn s ILE 38 N 1.65 4.89 -0.21 2.22 1.01 0.12 -2.13 121.20 128.75 1udn s ILE 38 Ca -0.01 1.52 -0.01 0.00 0.00 0.00 0.00 60.65 62.15 1udn s ILE 38 Cb -0.13 -4.09 0.01 0.00 0.01 0.00 0.00 42.46 38.27 1udn s ILE 38 CO -0.03 -0.00 -0.12 0.00 0.00 0.00 0.00 174.94 174.79 1udn s THR 40 N 1.35 2.09 -0.11 0.00 -4.23 -0.21 -0.86 115.64 113.67 1udn s THR 40 Ca 0.04 -1.81 0.00 0.00 -1.18 0.00 0.00 61.69 58.74 1udn s THR 40 Cb -0.14 -1.91 0.02 0.00 1.34 0.00 0.00 72.50 71.81 1udn s THR 40 CO -0.08 -0.07 -0.08 0.00 -0.54 0.00 0.00 174.62 173.85 1udn s ALA 41 N -1.41 1.31 -0.04 3.99 0.00 0.11 -1.10 121.76 124.62 1udn s ALA 41 Ca 0.14 -0.52 0.06 0.00 0.00 0.00 0.00 51.96 51.63 1udn s ALA 41 Cb -0.09 -0.85 -0.01 0.00 0.00 0.00 0.00 23.12 22.17 1udn s ALA 41 CO 0.07 -0.33 -0.21 -1.12 0.00 0.00 0.00 175.76 174.16 1udn s SER 42 N 1.53 2.62 -0.16 0.00 0.01 -0.45 -2.11 113.70 115.14 1udn s SER 42 Ca 0.02 -0.43 -0.21 0.00 1.31 0.00 0.00 55.95 56.64 1udn s SER 42 Cb -0.13 -0.64 -0.03 0.00 0.21 0.00 0.00 66.02 65.43 1udn s SER 42 CO -0.06 0.21 0.62 -0.69 0.41 0.00 0.00 173.24 173.73 1udn s VAL 43 N -0.15 5.05 -0.21 3.43 1.01 -1.26 0.11 120.40 128.37 1udn s VAL 43 Ca -0.01 1.21 -0.04 0.00 0.00 0.00 0.00 61.98 63.13 1udn s VAL 43 Cb -0.12 -3.95 -0.02 0.00 0.00 0.00 0.00 36.38 32.30 1udn s VAL 43 CO 0.02 0.17 -0.02 -0.63 0.00 0.00 0.00 175.10 174.64 1udn s ILE 44 N 1.50 3.64 0.00 2.22 -1.09 0.13 -4.96 121.20 122.63 1udn s ILE 44 Ca 0.30 -0.41 -0.01 0.00 -2.23 0.00 0.00 60.65 58.30 1udn s ILE 44 Cb -0.16 -2.65 -0.06 0.00 -1.58 0.00 0.00 42.46 38.00 1udn s ILE 44 CO 0.12 0.42 1.64 -0.62 -1.23 0.00 0.00 174.94 175.27 1udn n GLU 45 N 4.59 0.82 -3.43 2.79 -0.58 -1.26 -0.87 120.64 122.70 1udn n GLU 45 Ca -0.18 -0.24 -0.10 0.00 -0.42 0.00 0.00 57.16 56.23 1udn n GLU 45 Cb 0.51 -1.44 0.00 0.00 -0.57 0.00 0.00 31.44 29.94 1udn n GLU 45 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 1udn n ASN 46 N 2.11 -1.57 -3.99 1.62 5.15 -1.26 -4.91 115.26 112.40 1udn n ASN 46 Ca 0.10 -2.45 -0.08 0.00 -0.60 0.00 0.00 54.58 51.55 1udn n ASN 46 Cb 0.39 2.72 -0.10 0.00 -0.53 0.00 0.00 39.78 42.27 1udn n ASN 46 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 1udn s VAL 47 N -2.48 0.17 0.72 3.44 1.01 -1.26 -1.49 120.40 120.51 1udn s VAL 47 Ca 0.18 -1.37 -0.16 0.00 0.00 0.00 0.00 61.98 60.64 1udn s VAL 47 Cb -0.03 -1.11 0.03 0.00 0.00 0.00 0.00 36.38 35.28 1udn s VAL 47 CO 0.13 -0.76 1.25 -2.84 0.00 0.00 0.00 175.10 172.89 1udn s PRO 48 N -3.11 2.13 0.33 2.72 0.02 -1.26 -4.80 135.00 131.02 1udn s PRO 48 Ca -0.01 1.91 0.01 0.00 0.02 0.00 0.00 61.00 62.93 1udn s PRO 48 Cb 0.02 -1.81 0.57 0.00 0.02 0.00 0.00 34.50 33.30 1udn s PRO 48 CO -0.07 -1.88 1.97 -0.91 -0.33 0.00 0.00 177.00 175.78 1udn h ASN 49 N -0.14 0.82 0.14 2.53 2.35 -2.01 -1.78 115.58 117.49 1udn h ASN 49 Ca -0.49 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.25 1udn h ASN 49 Cb 1.32 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 39.49 1udn h ASN 49 CO 0.50 0.57 0.00 -2.67 -1.65 0.00 0.00 177.43 174.18 1udn n TRP 50 N -4.44 0.00 -0.01 1.19 4.27 -1.26 -2.54 117.44 114.65 1udn n TRP 50 Ca 0.09 0.00 0.04 0.00 -3.89 0.00 0.00 57.50 53.74 1udn n TRP 50 Cb 0.09 -0.16 -0.08 0.00 -1.36 0.00 0.00 31.31 29.79 1udn n TRP 50 CO 0.00 0.00 0.00 1.28 -2.29 0.00 0.00 177.69 176.68 1udn n LEU 51 N -1.16 0.00 -3.96 5.67 4.77 -0.68 -4.98 117.00 116.66 1udn n LEU 51 Ca 0.08 0.00 -0.41 0.00 -0.03 0.00 0.00 56.01 55.65 1udn n LEU 51 Cb 0.08 0.04 -0.02 0.00 -2.33 0.00 0.00 43.42 41.19 1udn n LEU 51 CO 0.09 0.04 -0.18 0.29 -1.33 0.00 0.00 177.39 176.30 1udn n LYS 52 N -1.95 0.00 -0.34 3.23 4.76 -1.05 -1.08 118.16 121.73 1udn n LYS 52 Ca -0.04 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.40 1udn n LYS 52 Cb 0.37 -0.91 0.00 0.00 -1.84 0.00 0.00 35.03 32.65 1udn n LYS 52 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1udn n GLY 53 N 1.95 0.10 0.99 0.72 0.00 -1.26 -4.79 105.19 102.90 1udn n GLY 53 Ca 0.14 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.18 1udn n GLY 53 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1udn n LYS 54 N -2.00 2.40 -4.05 1.61 5.02 -0.24 -4.92 118.16 115.98 1udn n LYS 54 Ca 0.00 -1.15 -0.28 0.00 -2.02 0.00 0.00 58.31 54.87 1udn n LYS 54 Cb 0.00 -1.76 -0.04 0.00 -0.02 0.00 0.00 35.03 33.21 1udn n LYS 54 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1udn n GLY 55 N 0.26 -0.24 3.29 0.72 0.00 -1.26 -4.97 105.19 102.99 1udn n GLY 55 Ca 0.10 0.17 -0.12 0.00 0.00 0.00 0.00 46.02 46.18 1udn n GLY 55 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1udn s GLN 56 N -6.78 0.89 0.35 1.61 0.74 -1.26 -4.72 119.66 110.49 1udn s GLN 56 Ca 0.03 -0.48 0.04 0.00 0.05 0.00 0.00 55.36 55.01 1udn s GLN 56 Cb -0.02 0.39 0.04 0.00 1.10 0.00 0.00 33.01 34.53 1udn s GLN 56 CO 0.92 -0.30 0.37 0.41 -0.55 0.00 0.00 175.29 176.14 1udn n GLY 57 N 0.44 2.44 3.22 2.59 0.00 -0.03 -4.14 105.19 109.72 1udn n GLY 57 Ca -0.18 -2.22 -0.09 0.00 0.00 0.00 0.00 46.02 43.53 1udn n GLY 57 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1udn s TRP 58 N -1.51 0.27 -0.03 1.61 -0.11 -0.44 -4.88 118.94 113.85 1udn s TRP 58 Ca 0.28 -0.70 0.01 0.00 1.22 0.00 0.00 56.10 56.91 1udn s TRP 58 Cb -0.02 -0.11 0.02 0.00 -1.50 0.00 0.00 33.47 31.86 1udn s TRP 58 CO 0.18 -0.57 -0.02 0.42 -4.62 0.00 0.00 176.95 172.34 1udn s ILE 59 N -3.90 0.29 0.02 5.86 1.01 -1.26 -0.80 121.20 122.43 1udn s ILE 59 Ca 0.09 -0.02 0.00 0.00 0.00 0.00 0.00 60.65 60.72 1udn s ILE 59 Cb 0.05 -0.34 -0.02 0.00 0.01 0.00 0.00 42.46 42.16 1udn s ILE 59 CO -0.08 0.15 -0.04 0.28 0.00 0.00 0.00 174.94 175.26 1udn s THR 60 N 0.74 0.17 0.08 2.92 -1.32 -1.04 -4.88 115.64 112.30 1udn s THR 60 Ca -0.08 -0.94 0.08 0.00 -1.21 0.00 0.00 61.69 59.54 1udn s THR 60 Cb -0.11 -0.32 -0.03 0.00 -1.51 0.00 0.00 72.50 70.53 1udn s THR 60 CO -0.01 -0.49 -0.22 0.00 -2.21 0.00 0.00 174.62 171.70 1udn s ALA 61 N -1.46 1.89 -0.08 11.08 0.00 -1.26 -1.19 121.76 130.73 1udn s ALA 61 Ca -0.15 -1.20 0.04 0.00 0.00 0.00 0.00 51.96 50.65 1udn s ALA 61 Cb -0.10 -0.32 0.00 0.00 0.00 0.00 0.00 23.12 22.71 1udn s ALA 61 CO -0.01 0.41 -0.21 -2.00 0.00 0.00 0.00 175.76 173.95 1udn s GLU 62 N -1.58 2.61 0.04 0.00 2.12 0.35 -4.81 118.70 117.43 1udn s GLU 62 Ca 0.08 -0.76 0.09 0.00 0.36 0.00 0.00 54.97 54.74 1udn s GLU 62 Cb -0.10 -2.04 -0.03 0.00 0.26 0.00 0.00 34.13 32.23 1udn s GLU 62 CO 0.03 0.17 -0.25 -0.47 -0.54 0.00 0.00 175.26 174.21 1udn s TYR 63 N 0.34 2.20 -0.10 5.30 5.04 -1.26 -0.48 117.35 128.38 1udn s TYR 63 Ca -0.15 -0.40 -0.16 0.00 -2.44 0.00 0.00 57.07 53.91 1udn s TYR 63 Cb -0.17 -1.33 0.04 0.00 0.35 0.00 0.00 41.96 40.86 1udn s TYR 63 CO 0.07 0.10 0.41 -1.54 -1.34 0.00 0.00 175.55 173.25 1udn s SER 64 N -1.16 -0.37 -0.34 4.32 1.04 -0.52 -4.97 113.70 111.68 1udn s SER 64 Ca 0.11 0.57 0.01 0.00 0.48 0.00 0.00 55.95 57.12 1udn s SER 64 Cb -0.10 0.64 0.09 0.00 0.10 0.00 0.00 66.02 66.76 1udn s SER 64 CO 0.02 -0.29 0.06 -0.32 0.98 0.00 0.00 173.24 173.68 1udn s MET 65 N -0.45 1.85 0.16 4.02 1.75 -1.26 -1.41 119.30 123.96 1udn s MET 65 Ca -0.06 -1.71 -0.32 0.00 -1.25 0.00 0.00 55.69 52.36 1udn s MET 65 Cb -0.03 -3.26 -0.17 0.00 2.84 0.00 0.00 34.83 34.21 1udn s MET 65 CO 0.03 -0.88 0.87 1.28 -0.65 0.00 0.00 175.02 175.67 1udn n LEU 66 N 4.42 0.15 -0.17 4.11 4.77 -1.12 -4.57 117.00 124.59 1udn n LEU 66 Ca -0.02 1.15 0.25 0.00 -0.03 0.00 0.00 56.01 57.35 1udn n LEU 66 Cb 0.42 -1.06 0.38 0.00 -2.33 0.00 0.00 43.42 40.83 1udn n LEU 66 CO 0.25 -2.10 1.17 -2.65 -1.33 0.00 0.00 177.39 172.73 1udn n PRO 67 N 1.28 0.01 -3.33 3.23 -0.02 -0.94 -3.27 135.00 131.97 1udn n PRO 67 Ca 0.17 0.96 -0.45 0.00 -2.02 0.00 0.00 63.50 62.16 1udn n PRO 67 Cb 0.22 -2.40 -0.00 0.00 -0.02 0.00 0.00 33.50 31.30 1udn n PRO 67 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 1udn n ARG 68 N -3.08 3.59 -4.45 -0.52 3.00 -1.26 0.18 116.66 114.12 1udn n ARG 68 Ca 0.20 -4.46 -0.25 0.00 -0.00 0.00 0.00 57.85 53.34 1udn n ARG 68 Cb 1.42 -2.55 -0.13 0.00 0.00 0.00 0.00 32.46 31.20 1udn n ARG 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1udn s ALA 69 N -1.37 1.77 -1.31 5.13 0.00 -1.18 -4.45 121.76 120.35 1udn s ALA 69 Ca 0.31 -1.16 -0.07 0.00 0.00 0.00 0.00 51.96 51.04 1udn s ALA 69 Cb -0.09 -0.29 0.05 0.00 0.00 0.00 0.00 23.12 22.79 1udn s ALA 69 CO -0.07 0.37 0.45 0.25 0.00 0.00 0.00 175.76 176.76 1udn n THR 70 N 1.44 -1.17 -1.95 0.00 -2.24 -0.12 0.50 114.28 110.74 1udn n THR 70 Ca -0.18 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.47 1udn n THR 70 Cb 0.53 -2.18 -0.03 0.00 -2.10 0.00 0.00 70.33 66.56 1udn n THR 70 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1udn n GLN 71 N -3.67 -1.79 0.00 -0.78 -0.00 -1.26 -4.88 117.38 104.99 1udn n GLN 71 Ca -0.05 0.66 0.00 0.00 -0.00 0.00 0.00 57.00 57.61 1udn n GLN 71 Cb 0.57 -5.10 0.00 0.00 -0.00 0.00 0.00 30.24 25.71 1udn n GLN 71 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.06 178.00 1udn n GLN 72 N -2.36 2.79 -4.51 2.61 -0.06 0.18 -5.13 117.38 110.90 1udn n GLN 72 Ca -0.14 0.00 -0.33 0.00 -2.00 0.00 0.00 57.00 54.53 1udn n GLN 72 Cb 0.52 0.00 -0.14 0.00 -4.06 0.00 0.00 30.24 26.56 1udn n GLN 72 CO 0.00 0.00 0.00 0.50 -0.20 0.00 0.00 177.06 177.36 1udn s ARG 73 N 1.67 3.39 -0.45 3.69 6.06 -1.24 -3.10 118.95 128.97 1udn s ARG 73 Ca 0.00 -0.66 0.09 0.00 -2.50 0.00 0.00 55.73 52.66 1udn s ARG 73 Cb 0.00 -2.74 0.34 0.00 0.06 0.00 0.00 34.95 32.61 1udn s ARG 73 CO 0.00 0.10 0.79 2.41 -2.50 0.00 0.00 175.30 176.10 1udn n THR 74 N 3.87 0.95 -1.65 4.11 -1.04 0.49 -4.88 114.28 116.13 1udn n THR 74 Ca -0.18 -4.91 -0.47 0.00 -2.04 0.00 0.00 64.05 56.45 1udn n THR 74 Cb 0.52 -0.79 -0.04 0.00 -1.82 0.00 0.00 70.33 68.20 1udn n THR 74 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1udn n ILE 75 N 0.19 0.18 -0.64 12.58 3.06 -1.26 -2.22 119.36 131.24 1udn n ILE 75 Ca 0.27 -0.05 -0.31 0.00 -2.50 0.00 0.00 62.75 60.16 1udn n ILE 75 Cb 0.56 -1.34 0.19 0.00 0.54 0.00 0.00 39.64 39.58 1udn n ILE 75 CO 0.00 0.00 0.00 0.54 -2.50 0.00 0.00 176.55 174.59 1udn n ARG 76 N 2.94 -1.45 -0.19 9.51 1.74 -1.26 -4.83 116.66 123.11 1udn n ARG 76 Ca 0.16 -0.39 -0.02 0.00 -0.77 0.00 0.00 57.85 56.84 1udn n ARG 76 Cb 0.27 -1.94 0.01 0.00 -1.02 0.00 0.00 32.46 29.78 1udn n ARG 76 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1udn n GLU 77 N -3.03 1.08 0.00 5.56 -0.58 -1.26 -4.34 120.64 118.07 1udn n GLU 77 Ca 0.04 -0.18 0.00 0.00 -0.42 0.00 0.00 57.16 56.60 1udn n GLU 77 Cb 0.57 -1.07 0.00 0.00 -0.57 0.00 0.00 31.44 30.37 1udn n GLU 77 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 1udn n SER 78 N 0.66 0.00 -1.56 1.62 2.88 -1.26 -4.67 113.62 111.28 1udn n SER 78 Ca 0.03 0.00 -0.00 0.00 -1.33 0.00 0.00 58.87 57.57 1udn n SER 78 Cb 0.55 0.00 -0.00 0.00 -0.75 0.00 0.00 64.21 64.01 1udn n SER 78 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 1udn n VAL 79 N -0.60 1.79 0.00 2.46 0.31 -1.26 -3.11 118.33 117.91 1udn n VAL 79 Ca 0.00 -0.46 0.00 0.00 -0.01 0.00 0.00 64.34 63.87 1udn n VAL 79 Cb 0.00 -1.45 0.00 0.00 -0.91 0.00 0.00 33.84 31.48 1udn n VAL 79 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 1udn n GLN 80 N 1.57 0.25 0.00 5.55 7.27 -1.26 -5.04 117.38 125.72 1udn n GLN 80 Ca 0.01 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.08 1udn n GLN 80 Cb 0.45 -0.69 0.00 0.00 2.41 0.00 0.00 30.24 32.41 1udn n GLN 80 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1udn n GLY 81 N 2.14 1.36 3.43 1.69 0.00 -1.18 -5.05 105.19 107.58 1udn n GLY 81 Ca 0.00 -0.79 -0.43 0.00 0.00 0.00 0.00 46.02 44.79 1udn n GLY 81 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1udn n ARG 82 N 0.00 0.46 -3.88 1.61 5.12 -1.26 -4.83 116.66 113.87 1udn n ARG 82 Ca 0.00 0.16 -0.35 0.00 -1.93 0.00 0.00 57.85 55.73 1udn n ARG 82 Cb 0.00 -1.36 -0.13 0.00 -1.16 0.00 0.00 32.46 29.81 1udn n ARG 82 CO 0.00 0.00 0.00 -1.50 -1.93 0.00 0.00 177.63 174.20 1udn s ILE 83 N -1.36 3.09 0.23 0.55 2.07 -1.26 -4.83 121.20 119.68 1udn s ILE 83 Ca 0.62 -1.45 -0.31 0.00 -1.41 0.00 0.00 60.65 58.10 1udn s ILE 83 Cb -0.69 -2.82 -0.15 0.00 0.13 0.00 0.00 42.46 38.94 1udn s ILE 83 CO 0.59 -0.19 1.15 0.61 -1.91 0.00 0.00 174.94 175.19 1udn n GLY 84 N 4.63 0.07 0.24 1.50 0.00 -1.26 -4.88 105.19 105.49 1udn n GLY 84 Ca -0.12 0.45 0.14 0.00 0.00 0.00 0.00 46.02 46.49 1udn n GLY 84 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1udn n GLY 85 N 1.74 -0.48 0.11 -0.02 0.00 -1.26 -3.57 105.19 101.71 1udn n GLY 85 Ca 0.12 -0.31 -0.20 0.00 0.00 0.00 0.00 46.02 45.64 1udn n GLY 85 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1udn h ARG 86 N 1.14 0.25 -0.75 1.61 2.43 -1.99 -2.93 114.38 114.13 1udn h ARG 86 Ca 0.00 -0.43 0.02 0.00 -0.81 0.00 0.00 59.98 58.76 1udn h ARG 86 Cb 0.24 0.16 -0.04 0.00 -0.42 0.00 0.00 29.97 29.91 1udn h ARG 86 CO 0.00 1.20 0.49 1.15 -1.51 0.00 0.00 179.97 181.31 1udn h THR 87 N -0.45 1.16 -0.05 0.20 2.02 -1.96 -1.90 112.91 111.93 1udn h THR 87 Ca -0.16 -0.33 -0.20 0.00 0.77 0.00 0.00 66.41 66.49 1udn h THR 87 Cb 1.59 0.11 -0.00 0.00 -1.74 0.00 0.00 68.15 68.10 1udn h THR 87 CO 0.11 0.18 -0.80 0.45 0.37 0.00 0.00 175.52 175.83 1udn h HIS 88 N 0.96 0.53 -0.54 3.16 3.86 -1.67 -0.77 115.15 120.68 1udn h HIS 88 Ca 0.28 -0.25 -0.01 0.00 -1.16 0.00 0.00 60.37 59.23 1udn h HIS 88 Cb -0.04 -0.07 -0.03 0.00 1.06 0.00 0.00 27.41 28.33 1udn h HIS 88 CO -0.00 1.03 0.31 1.49 0.86 0.00 0.00 177.93 181.62 1udn h GLU 89 N 0.24 0.74 -0.20 2.45 4.81 -1.20 -0.96 114.58 120.46 1udn h GLU 89 Ca -0.04 -0.08 -0.20 0.00 -0.13 0.00 0.00 59.36 58.91 1udn h GLU 89 Cb 1.39 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 30.63 1udn h GLU 89 CO 0.14 0.56 -0.66 0.82 -0.73 0.00 0.00 179.01 179.13 1udn h ILE 90 N 0.72 1.29 -0.84 2.32 2.04 -1.31 -2.42 117.51 119.31 1udn h ILE 90 Ca 0.19 -1.88 -0.03 0.00 1.00 0.00 0.00 64.86 64.14 1udn h ILE 90 Cb 0.02 1.84 -0.04 0.00 -0.74 0.00 0.00 36.82 37.90 1udn h ILE 90 CO -0.03 0.60 0.42 1.56 0.00 0.00 0.00 178.15 180.70 1udn h GLN 91 N 0.55 1.20 -0.10 2.37 4.20 -0.92 -0.79 115.11 121.62 1udn h GLN 91 Ca -0.02 -0.16 -0.08 0.00 0.06 0.00 0.00 58.65 58.45 1udn h GLN 91 Cb 1.26 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 28.81 1udn h GLN 91 CO 0.14 0.91 -0.30 0.00 -0.67 0.00 0.00 178.83 178.91 1udn h ARG 92 N 1.19 0.18 0.02 1.46 3.08 -1.12 -1.54 114.38 117.64 1udn h ARG 92 Ca 0.29 -0.06 -0.00 0.00 0.07 0.00 0.00 59.98 60.28 1udn h ARG 92 Cb 0.09 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.13 1udn h ARG 92 CO -0.04 0.47 -0.01 1.98 -1.07 0.00 0.00 179.97 181.29 1udn h MET 93 N 0.16 -0.03 -0.76 0.04 4.05 -0.78 -1.73 114.93 115.88 1udn h MET 93 Ca 0.02 0.00 0.01 0.00 -0.28 0.00 0.00 59.70 59.46 1udn h MET 93 Cb 0.61 0.01 -0.04 0.00 -0.80 0.00 0.00 31.60 31.38 1udn h MET 93 CO 0.04 0.40 0.51 0.82 0.23 0.00 0.00 176.91 178.91 1udn h ILE 94 N -0.47 1.18 -0.29 1.77 2.04 -1.04 -0.51 117.51 120.20 1udn h ILE 94 Ca -0.00 -0.35 -0.16 0.00 1.00 0.00 0.00 64.86 65.35 1udn h ILE 94 Cb 0.44 0.07 -0.01 0.00 -0.74 0.00 0.00 36.82 36.59 1udn h ILE 94 CO 0.00 0.19 -0.45 1.23 0.00 0.00 0.00 178.15 179.12 1udn h GLY 95 N 1.02 0.82 1.15 5.37 0.00 -1.22 -1.79 103.07 108.42 1udn h GLY 95 Ca 0.28 -0.87 -0.09 0.00 0.00 0.00 0.00 47.33 46.65 1udn h GLY 95 CO -0.07 0.78 -0.02 3.21 0.00 0.00 0.00 176.54 180.45 1udn h ARG 96 N 0.60 1.01 -0.12 4.80 3.08 -0.73 -1.26 114.38 121.75 1udn h ARG 96 Ca 0.04 -0.32 -0.02 0.00 0.07 0.00 0.00 59.98 59.75 1udn h ARG 96 Cb 1.01 -0.09 -0.00 0.00 0.08 0.00 0.00 29.97 30.97 1udn h ARG 96 CO 0.10 1.00 -0.02 0.00 -1.07 0.00 0.00 179.97 179.98 1udn h ALA 97 N 1.05 0.17 -0.58 0.04 0.00 -0.88 -2.03 119.26 117.03 1udn h ALA 97 Ca 0.16 -0.21 0.01 0.00 0.00 0.00 0.00 54.91 54.87 1udn h ALA 97 Cb 0.56 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.27 1udn h ALA 97 CO 0.03 -0.11 0.38 0.52 0.00 0.00 0.00 179.25 180.07 1udn h MET 98 N -0.07 0.74 -0.24 0.00 2.86 -1.27 -2.64 114.93 114.32 1udn h MET 98 Ca 0.03 -0.04 -0.06 0.00 -2.06 0.00 0.00 59.70 57.57 1udn h MET 98 Cb 0.41 -0.17 -0.01 0.00 0.06 0.00 0.00 31.60 31.89 1udn h MET 98 CO 0.01 0.49 -0.12 0.00 1.06 0.00 0.00 176.91 178.35 1udn h ARG 99 N 0.76 0.38 -0.11 1.72 3.08 -1.20 -2.02 114.38 117.00 1udn h ARG 99 Ca 0.22 -0.10 -0.07 0.00 0.07 0.00 0.00 59.98 60.10 1udn h ARG 99 Cb -0.06 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 29.94 1udn h ARG 99 CO -0.06 0.51 -0.25 1.15 -1.07 0.00 0.00 179.97 180.24 1udn h THR 100 N 0.36 1.23 -0.00 2.04 2.02 -1.02 -3.00 112.91 114.55 1udn h THR 100 Ca 0.07 -1.08 0.00 0.00 0.77 0.00 0.00 66.41 66.17 1udn h THR 100 Cb 0.43 1.43 0.00 0.00 -1.74 0.00 0.00 68.15 68.28 1udn h THR 100 CO 0.02 0.32 -0.17 0.00 0.37 0.00 0.00 175.52 176.07 1udn n ALA 101 N -2.48 2.77 -2.37 6.16 0.00 -0.78 -4.89 120.51 118.92 1udn n ALA 101 Ca -0.01 -0.20 -0.29 0.00 0.00 0.00 0.00 53.44 52.94 1udn n ALA 101 Cb 0.35 -1.34 -0.14 0.00 0.00 0.00 0.00 19.45 18.32 1udn n ALA 101 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1udn s VAL 102 N -2.95 2.11 -1.10 0.00 1.01 -1.11 0.26 120.40 118.63 1udn s VAL 102 Ca 0.15 -1.46 -0.12 0.00 0.00 0.00 0.00 61.98 60.54 1udn s VAL 102 Cb 0.19 -1.83 0.22 0.00 0.00 0.00 0.00 36.38 34.96 1udn s VAL 102 CO 0.58 0.28 1.19 -0.70 0.00 0.00 0.00 175.10 176.45 1udn s GLU 103 N -1.44 4.04 0.64 2.72 2.12 -0.20 -4.84 118.70 121.74 1udn s GLU 103 Ca 0.12 -2.77 0.24 0.00 0.36 0.00 0.00 54.97 52.92 1udn s GLU 103 Cb -0.10 -4.76 1.33 0.00 0.26 0.00 0.00 34.13 30.86 1udn s GLU 103 CO 0.03 -1.49 1.74 -0.07 -0.54 0.00 0.00 175.26 174.93 1udn h LEU 104 N 8.25 0.00 -0.60 2.70 3.38 -1.88 0.74 115.31 127.90 1udn h LEU 104 Ca 0.22 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.19 1udn h LEU 104 Cb 0.91 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.63 1udn h LEU 104 CO 1.08 0.00 0.38 0.74 0.09 0.00 0.00 178.44 180.72 1udn h THR 105 N 0.00 1.17 -0.29 0.22 2.02 -1.88 0.01 112.91 114.16 1udn h THR 105 Ca 0.00 -0.36 0.00 0.00 0.77 0.00 0.00 66.41 66.82 1udn h THR 105 Cb 0.84 0.32 0.00 0.00 -1.74 0.00 0.00 68.15 67.58 1udn h THR 105 CO 0.00 0.17 0.00 0.29 0.37 0.00 0.00 175.52 176.35 1udn n LYS 106 N -4.63 1.85 0.07 6.66 5.02 0.25 -3.96 118.16 123.43 1udn n LYS 106 Ca 0.04 -1.30 0.12 0.00 -2.02 0.00 0.00 58.31 55.15 1udn n LYS 106 Cb 0.04 -1.36 0.09 0.00 -0.02 0.00 0.00 35.03 33.79 1udn n LYS 106 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 1udn h ILE 107 N 2.36 0.00 0.00 -0.18 1.08 -1.59 -3.45 117.51 115.72 1udn h ILE 107 Ca 0.00 -0.67 0.00 0.00 -0.39 0.00 0.00 64.86 63.80 1udn h ILE 107 Cb 0.53 1.19 0.00 0.00 -3.07 0.00 0.00 36.82 35.47 1udn h ILE 107 CO 0.00 0.00 0.00 0.61 -0.69 0.00 0.00 178.15 178.07 1udn n GLY 108 N 1.28 -0.19 2.54 5.37 0.00 -1.25 -4.55 105.19 108.39 1udn n GLY 108 Ca 0.02 -1.83 -0.41 0.00 0.00 0.00 0.00 46.02 43.80 1udn n GLY 108 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1udn n GLU 109 N -0.20 3.55 -4.20 1.61 1.02 -1.26 -1.83 120.64 119.33 1udn n GLU 109 Ca 0.00 -2.69 -0.12 0.00 -0.02 0.00 0.00 57.16 54.33 1udn n GLU 109 Cb 0.00 -2.95 -0.10 0.00 -0.02 0.00 0.00 31.44 28.37 1udn n GLU 109 CO 0.00 0.00 0.00 -0.98 1.18 0.00 0.00 177.13 177.33 1udn s ARG 110 N 1.78 1.13 -0.03 3.49 1.70 -1.26 -4.15 118.95 121.62 1udn s ARG 110 Ca 0.56 -1.58 0.05 0.00 -0.47 0.00 0.00 55.73 54.29 1udn s ARG 110 Cb 0.16 0.18 -0.01 0.00 -0.57 0.00 0.00 34.95 34.71 1udn s ARG 110 CO -0.07 -0.33 -0.17 0.99 -1.08 0.00 0.00 175.30 174.64 1udn s THR 111 N -4.06 1.42 -0.38 4.99 2.01 -0.05 -1.33 115.64 118.25 1udn s THR 111 Ca 0.34 -0.74 -0.16 0.00 0.31 0.00 0.00 61.69 61.44 1udn s THR 111 Cb 0.07 -1.21 0.00 0.00 0.01 0.00 0.00 72.50 71.38 1udn s THR 111 CO 0.09 0.41 0.38 -0.63 -0.69 0.00 0.00 174.62 174.17 1udn s ILE 112 N -0.16 5.15 -0.49 1.82 1.01 0.02 0.17 121.20 128.73 1udn s ILE 112 Ca 0.01 -0.21 -0.20 0.00 0.00 0.00 0.00 60.65 60.25 1udn s ILE 112 Cb -0.10 -3.92 0.05 0.00 0.01 0.00 0.00 42.46 38.51 1udn s ILE 112 CO 0.01 -0.25 0.63 0.86 0.00 0.00 0.00 174.94 176.20 1udn s TRP 113 N 2.01 3.04 -0.12 3.97 -0.11 0.29 -2.50 118.94 125.52 1udn s TRP 113 Ca 0.11 -0.41 -0.19 0.00 1.22 0.00 0.00 56.10 56.83 1udn s TRP 113 Cb -0.17 -3.49 -0.04 0.00 -1.50 0.00 0.00 33.47 28.27 1udn s TRP 113 CO 0.12 -1.00 0.53 0.08 -4.62 0.00 0.00 176.95 172.06 1udn s VAL 114 N 2.71 5.15 -0.16 5.86 1.01 -0.34 -1.34 120.40 133.29 1udn s VAL 114 Ca 0.17 1.05 0.01 0.00 0.00 0.00 0.00 61.98 63.21 1udn s VAL 114 Cb -0.18 -3.86 0.02 0.00 0.00 0.00 0.00 36.38 32.36 1udn s VAL 114 CO 0.14 0.29 -0.15 -0.62 0.00 0.00 0.00 175.10 174.75 1udn s ASP 115 N 0.74 2.84 -0.28 3.32 2.15 -0.25 -0.49 116.67 124.68 1udn s ASP 115 Ca 0.28 -0.55 -0.04 0.00 0.43 0.00 0.00 52.55 52.67 1udn s ASP 115 Cb -0.16 -1.26 0.03 0.00 -0.30 0.00 0.00 42.92 41.24 1udn s ASP 115 CO 0.12 -0.05 0.01 0.00 -0.17 0.00 0.00 175.17 175.08 1udn s ASP 117 N 1.36 5.34 -0.31 0.00 2.15 -0.19 -1.45 116.67 123.58 1udn s ASP 117 Ca -0.01 -1.50 -0.29 0.00 0.43 0.00 0.00 52.55 51.19 1udn s ASP 117 Cb -0.18 -1.87 0.00 0.00 -0.30 0.00 0.00 42.92 40.57 1udn s ASP 117 CO -0.01 -0.44 1.33 -0.69 -0.17 0.00 0.00 175.17 175.19 1udn s VAL 118 N 1.32 4.09 -1.50 1.11 1.01 -0.50 -0.70 120.40 125.24 1udn s VAL 118 Ca 0.02 1.22 0.22 0.00 0.00 0.00 0.00 61.98 63.44 1udn s VAL 118 Cb -0.21 -4.14 -0.09 0.00 0.00 0.00 0.00 36.38 31.93 1udn s VAL 118 CO 0.00 -0.50 1.05 2.30 0.00 0.00 0.00 175.10 177.95 1udn n ILE 119 N 6.32 0.00 -3.63 2.22 -5.35 -0.05 -2.80 119.36 116.06 1udn n ILE 119 Ca 0.15 -0.12 -0.05 0.00 -0.27 0.00 0.00 62.75 62.46 1udn n ILE 119 Cb 0.47 1.03 -0.07 0.00 -1.74 0.00 0.00 39.64 39.33 1udn n ILE 119 CO 0.00 0.00 0.00 -1.58 -1.76 0.00 0.00 176.55 173.21 1udn s GLN 120 N -2.74 0.59 -0.13 6.28 0.74 -1.08 -4.93 119.66 118.38 1udn s GLN 120 Ca 0.14 1.07 0.02 0.00 0.05 0.00 0.00 55.36 56.63 1udn s GLN 120 Cb 0.17 0.18 -0.00 0.00 1.10 0.00 0.00 33.01 34.47 1udn s GLN 120 CO 0.71 -0.13 -0.20 0.00 -0.55 0.00 0.00 175.29 175.12 1udn s ALA 121 N 1.67 2.34 -0.34 1.58 0.00 -1.26 -0.13 121.76 125.62 1udn s ALA 121 Ca -0.09 -1.01 0.16 0.00 0.00 0.00 0.00 51.96 51.02 1udn s ALA 121 Cb -0.05 -1.02 0.44 0.00 0.00 0.00 0.00 23.12 22.49 1udn s ALA 121 CO -0.18 0.13 1.13 -3.47 0.00 0.00 0.00 175.76 173.36 1udn n ASP 122 N 3.79 0.27 0.00 0.00 2.03 -1.26 -0.94 116.55 120.43 1udn n ASP 122 Ca -0.19 -2.53 0.00 0.00 0.52 0.00 0.00 54.79 52.59 1udn n ASP 122 Cb 0.52 0.02 0.00 0.00 -0.72 0.00 0.00 41.12 40.94 1udn n ASP 122 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1udn n GLY 123 N -0.37 -1.12 2.38 0.27 0.00 -1.26 -1.60 105.19 103.49 1udn n GLY 123 Ca 0.04 -1.43 -0.18 0.00 0.00 0.00 0.00 46.02 44.45 1udn n GLY 123 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1udn n GLY 124 N -0.26 -0.36 0.21 -0.02 0.00 -1.23 -4.75 105.19 98.77 1udn n GLY 124 Ca 0.00 -0.13 0.07 0.00 0.00 0.00 0.00 46.02 45.96 1udn n GLY 124 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1udn h THR 125 N -0.10 0.90 0.00 2.61 1.35 -1.93 -2.39 112.91 113.34 1udn h THR 125 Ca -0.42 -1.23 -0.13 0.00 -0.55 0.00 0.00 66.41 64.08 1udn h THR 125 Cb 1.31 1.73 -0.02 0.00 -1.73 0.00 0.00 68.15 69.45 1udn h THR 125 CO 0.50 0.31 -0.84 0.08 -0.25 0.00 0.00 175.52 175.31 1udn h ARG 126 N 0.00 0.00 0.13 4.72 0.11 -1.99 -2.18 114.38 115.18 1udn h ARG 126 Ca -0.00 0.00 -0.29 0.00 0.10 0.00 0.00 59.98 59.78 1udn h ARG 126 Cb 0.71 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.79 1udn h ARG 126 CO 0.04 0.43 -1.38 1.79 0.10 0.00 0.00 179.97 180.95 1udn h THR 127 N 0.00 1.34 -0.46 0.08 1.35 -1.86 -2.09 112.91 111.27 1udn h THR 127 Ca -0.06 -2.93 -0.03 0.00 -0.55 0.00 0.00 66.41 62.85 1udn h THR 127 Cb 1.46 2.87 -0.02 0.00 -1.73 0.00 0.00 68.15 70.73 1udn h THR 127 CO 0.06 0.85 0.18 0.00 -0.25 0.00 0.00 175.52 176.36 1udn h ALA 128 N 0.52 0.60 -0.81 6.62 0.00 -1.50 -1.39 119.26 123.29 1udn h ALA 128 Ca -0.19 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.57 1udn h ALA 128 Cb 2.00 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 19.58 1udn h ALA 128 CO 0.19 0.21 0.50 0.00 0.00 0.00 0.00 179.25 180.15 1udn h ALA 129 N 1.02 1.34 -0.17 0.00 0.00 -1.37 0.03 119.26 120.11 1udn h ALA 129 Ca 0.15 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 1udn h ALA 129 Cb 0.20 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1udn h ALA 129 CO -0.01 0.57 -0.03 0.82 0.00 0.00 0.00 179.25 180.60 1udn h ILE 130 N 1.12 1.28 -0.55 0.00 2.04 -1.05 0.97 117.51 121.32 1udn h ILE 130 Ca 0.29 -0.96 0.03 0.00 1.00 0.00 0.00 64.86 65.22 1udn h ILE 130 Cb -0.06 1.56 -0.04 0.00 -0.74 0.00 0.00 36.82 37.55 1udn h ILE 130 CO -0.06 0.29 0.33 0.74 0.00 0.00 0.00 178.15 179.45 1udn h THR 131 N 0.05 1.05 -0.01 -0.27 2.02 -1.00 -1.96 112.91 112.79 1udn h THR 131 Ca 0.05 -0.22 -0.21 0.00 0.77 0.00 0.00 66.41 66.79 1udn h THR 131 Cb 0.45 0.35 -0.00 0.00 -1.74 0.00 0.00 68.15 67.20 1udn h THR 131 CO 0.01 0.12 -0.90 1.23 0.37 0.00 0.00 175.52 176.35 1udn h GLY 132 N 0.65 0.40 1.60 2.16 0.00 -0.98 -3.19 103.07 103.71 1udn h GLY 132 Ca 0.22 -0.68 -0.03 0.00 0.00 0.00 0.00 47.33 46.84 1udn h GLY 132 CO -0.10 0.60 0.12 0.00 0.00 0.00 0.00 176.54 177.16 1udn h ALA 133 N 0.82 1.53 -0.75 3.60 0.00 -0.57 -2.47 119.26 121.41 1udn h ALA 133 Ca -0.07 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 1udn h ALA 133 Cb 1.53 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 19.13 1udn h ALA 133 CO 0.15 0.36 0.39 0.35 0.00 0.00 0.00 179.25 180.50 1udn h PHE 134 N 0.52 1.06 -0.58 0.00 3.57 -1.34 -0.78 116.94 119.38 1udn h PHE 134 Ca 0.13 -0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.56 1udn h PHE 134 Cb 0.16 -0.33 -0.03 0.00 2.79 0.00 0.00 35.95 38.53 1udn h PHE 134 CO 0.01 0.77 0.28 0.28 -2.23 0.00 0.00 178.31 177.41 1udn h VAL 135 N 1.05 1.21 -0.24 1.41 2.07 -1.57 0.22 116.25 120.40 1udn h VAL 135 Ca 0.26 -0.60 -0.12 0.00 0.82 0.00 0.00 66.70 67.07 1udn h VAL 135 Cb 0.08 0.53 -0.01 0.00 -1.52 0.00 0.00 31.29 30.36 1udn h VAL 135 CO -0.04 0.24 -0.35 0.00 0.02 0.00 0.00 177.57 177.44 1udn h ALA 136 N 1.11 0.96 -0.10 1.67 0.00 -1.05 -1.27 119.26 120.58 1udn h ALA 136 Ca 0.20 -0.41 -0.14 0.00 0.00 0.00 0.00 54.91 54.57 1udn h ALA 136 Cb 0.12 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 17.81 1udn h ALA 136 CO -0.02 0.61 -0.47 0.28 0.00 0.00 0.00 179.25 179.65 1udn h VAL 137 N 0.43 1.38 -0.06 0.00 2.07 -0.81 -1.56 116.25 117.70 1udn h VAL 137 Ca 0.05 -1.81 0.00 0.00 0.82 0.00 0.00 66.70 65.76 1udn h VAL 137 Cb 0.82 2.22 -0.01 0.00 -1.52 0.00 0.00 31.29 32.80 1udn h VAL 137 CO 0.07 0.54 0.03 0.00 0.02 0.00 0.00 177.57 178.22 1udn h ALA 138 N 0.47 0.07 -0.87 1.67 0.00 -0.50 -1.28 119.26 118.81 1udn h ALA 138 Ca -0.03 0.00 0.07 0.00 0.00 0.00 0.00 54.91 54.95 1udn h ALA 138 Cb 1.12 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.85 1udn h ALA 138 CO 0.10 -0.45 0.57 -0.44 0.00 0.00 0.00 179.25 179.03 1udn h ASP 139 N 0.06 0.85 0.03 0.00 5.19 -1.24 -0.52 116.42 120.79 1udn h ASP 139 Ca 0.02 0.01 -0.13 0.00 -0.62 0.00 0.00 57.03 56.31 1udn h ASP 139 Cb 0.01 -0.17 -0.01 0.00 0.18 0.00 0.00 39.33 39.33 1udn h ASP 139 CO -0.02 0.54 -0.42 0.00 -3.12 0.00 0.00 179.24 176.22 1udn h ALA 140 N 1.53 0.89 -0.25 3.45 0.00 -0.76 0.45 119.26 124.57 1udn h ALA 140 Ca 0.38 -0.44 -0.17 0.00 0.00 0.00 0.00 54.91 54.68 1udn h ALA 140 Cb 0.23 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 1udn h ALA 140 CO -0.14 0.64 -0.52 0.82 0.00 0.00 0.00 179.25 180.05 1udn h ILE 141 N 0.40 1.29 -0.28 0.00 2.04 -0.50 -0.57 117.51 119.90 1udn h ILE 141 Ca 0.03 -1.73 -0.10 0.00 1.00 0.00 0.00 64.86 64.06 1udn h ILE 141 Cb 0.91 1.65 -0.01 0.00 -0.74 0.00 0.00 36.82 38.63 1udn h ILE 141 CO 0.08 0.55 -0.24 0.40 0.00 0.00 0.00 178.15 178.94 1udn h ILE 142 N 0.57 1.27 -0.08 -0.67 2.04 -0.90 -0.76 117.51 118.97 1udn h ILE 142 Ca 0.02 -1.28 -0.02 0.00 1.00 0.00 0.00 64.86 64.58 1udn h ILE 142 Cb 1.09 1.32 -0.00 0.00 -0.74 0.00 0.00 36.82 38.49 1udn h ILE 142 CO 0.11 0.41 -0.03 0.50 0.00 0.00 0.00 178.15 179.14 1udn h LYS 143 N 0.48 0.17 -0.93 2.37 1.63 -0.76 -0.91 116.57 118.62 1udn h LYS 143 Ca 0.07 -0.07 0.09 0.00 -0.85 0.00 0.00 60.65 59.89 1udn h LYS 143 Cb 0.68 -0.01 -0.07 0.00 -0.60 0.00 0.00 32.23 32.24 1udn h LYS 143 CO 0.05 0.51 0.60 -0.07 -3.45 0.00 0.00 179.45 177.09 1udn h LEU 144 N -0.18 0.89 0.00 5.20 3.38 -0.81 0.14 115.31 123.92 1udn h LEU 144 Ca 0.02 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 1udn h LEU 144 Cb 0.45 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.04 1udn h LEU 144 CO 0.01 0.53 -0.00 -0.74 0.09 0.00 0.00 178.44 178.33 1udn h HIS 145 N 0.99 -0.00 -0.10 1.13 2.76 -0.96 -1.41 115.15 117.56 1udn h HIS 145 Ca 0.43 -0.00 0.03 0.00 -2.20 0.00 0.00 60.37 58.62 1udn h HIS 145 Cb 0.33 0.00 -0.00 0.00 1.55 0.00 0.00 27.41 29.29 1udn h HIS 145 CO -0.00 0.31 0.10 -0.22 -1.30 0.00 0.00 177.93 176.82 1udn h LYS 146 N -0.32 0.00 -0.09 5.26 3.64 -0.39 0.25 116.57 124.93 1udn h LYS 146 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1udn h LYS 146 Cb 0.32 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.14 1udn h LYS 146 CO 0.00 0.00 0.00 0.39 -2.27 0.00 0.00 179.45 177.57 1udn n GLU 147 N -3.92 1.63 -1.00 1.90 1.02 -0.04 -4.91 120.64 115.34 1udn n GLU 147 Ca -0.01 -0.94 0.00 0.00 -0.02 0.00 0.00 57.16 56.19 1udn n GLU 147 Cb 0.20 -1.43 0.00 0.00 -0.02 0.00 0.00 31.44 30.20 1udn n GLU 147 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1udn n GLY 148 N 1.13 0.37 0.15 0.62 0.00 0.89 -4.88 105.19 103.47 1udn n GLY 148 Ca 0.18 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.18 1udn n GLY 148 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1udn h ILE 149 N 0.00 1.40 -3.86 -0.61 1.08 -1.45 -3.45 117.51 110.63 1udn h ILE 149 Ca 0.00 -1.96 -0.29 0.00 -0.39 0.00 0.00 64.86 62.22 1udn h ILE 149 Cb 0.28 2.04 -0.19 0.00 -3.07 0.00 0.00 36.82 35.88 1udn h ILE 149 CO 0.00 0.57 -0.73 0.27 -0.69 0.00 0.00 178.15 177.57 1udn s ILE 150 N -3.74 0.74 0.01 -0.67 -4.36 -1.22 -5.02 121.20 106.94 1udn s ILE 150 Ca -0.02 -1.46 -0.23 0.00 -0.26 0.00 0.00 60.65 58.67 1udn s ILE 150 Cb 0.13 -1.12 -0.13 0.00 1.25 0.00 0.00 42.46 42.59 1udn s ILE 150 CO 0.77 -0.54 1.03 -0.33 0.24 0.00 0.00 174.94 176.10 1udn h GLU 151 N 3.84 -0.81 0.00 0.37 4.39 -1.87 -3.40 114.58 117.10 1udn h GLU 151 Ca -0.36 0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.39 1udn h GLU 151 Cb 1.19 0.18 0.00 0.00 -0.10 0.00 0.00 28.75 30.02 1udn h GLU 151 CO 0.50 -0.54 0.00 0.39 -1.16 0.00 0.00 179.01 178.20 1udn n GLU 152 N -5.09 1.84 -3.80 2.33 1.02 -1.26 -5.00 120.64 110.68 1udn n GLU 152 Ca -0.10 0.00 -0.28 0.00 -0.02 0.00 0.00 57.16 56.75 1udn n GLU 152 Cb 0.33 0.00 -0.12 0.00 -0.02 0.00 0.00 31.44 31.63 1udn n GLU 152 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 1udn s THR 153 N 0.60 2.27 0.00 2.62 -4.23 -1.26 -4.71 115.64 110.93 1udn s THR 153 Ca 0.00 -3.74 -0.01 0.00 -1.18 0.00 0.00 61.69 56.76 1udn s THR 153 Cb 0.00 -2.51 -0.05 0.00 1.34 0.00 0.00 72.50 71.28 1udn s THR 153 CO 0.00 -1.02 1.09 -0.81 -0.54 0.00 0.00 174.62 173.34 1udn n PRO 154 N 2.38 0.38 -3.43 3.99 -0.04 -1.26 -4.64 135.00 132.39 1udn n PRO 154 Ca 0.19 -0.19 -0.39 0.00 -0.04 0.00 0.00 63.50 63.07 1udn n PRO 154 Cb 0.37 -1.59 -0.09 0.00 -0.04 0.00 0.00 33.50 32.14 1udn n PRO 154 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1udn s ILE 155 N 2.58 5.20 0.07 0.52 1.01 -1.26 -1.03 121.20 128.29 1udn s ILE 155 Ca 0.13 0.37 -0.16 0.00 0.00 0.00 0.00 60.65 60.99 1udn s ILE 155 Cb 0.06 -3.70 -0.13 0.00 0.01 0.00 0.00 42.46 38.71 1udn s ILE 155 CO 0.00 0.11 1.34 0.11 0.00 0.00 0.00 174.94 176.51 1udn h LYS 156 N 8.28 0.61 -1.67 2.79 1.57 -0.52 -3.49 116.57 124.14 1udn h LYS 156 Ca -0.32 -0.39 0.28 0.00 -1.87 0.00 0.00 60.65 58.36 1udn h LYS 156 Cb 1.16 0.04 -0.12 0.00 0.08 0.00 0.00 32.23 33.40 1udn h LYS 156 CO 0.64 1.00 0.74 0.34 -0.57 0.00 0.00 179.45 181.60 1udn s ASP 157 N -6.58 -0.10 0.71 0.86 2.15 -1.24 -5.07 116.67 107.40 1udn s ASP 157 Ca -0.13 -0.18 -0.13 0.00 0.43 0.00 0.00 52.55 52.55 1udn s ASP 157 Cb 0.07 0.24 0.02 0.00 -0.30 0.00 0.00 42.92 42.95 1udn s ASP 157 CO 0.83 -0.44 1.10 -0.36 -0.17 0.00 0.00 175.17 176.13 1udn s PHE 158 N -2.64 2.64 -0.06 -5.34 0.40 -1.26 -4.84 117.98 106.89 1udn s PHE 158 Ca 0.13 1.54 -0.03 0.00 -0.60 0.00 0.00 56.93 57.98 1udn s PHE 158 Cb 0.03 -3.10 0.04 0.00 0.51 0.00 0.00 43.02 40.50 1udn s PHE 158 CO -0.03 -1.69 0.13 0.08 0.70 0.00 0.00 175.22 174.42 1udn s VAL 159 N -2.61 -0.10 0.20 -0.44 1.01 -1.26 -1.71 120.40 115.48 1udn s VAL 159 Ca 0.64 0.24 -0.03 0.00 0.00 0.00 0.00 61.98 62.82 1udn s VAL 159 Cb -0.19 -0.23 -0.03 0.00 0.00 0.00 0.00 36.38 35.93 1udn s VAL 159 CO 0.48 0.10 0.19 0.00 0.00 0.00 0.00 175.10 175.86 1udn s ALA 160 N 1.46 0.88 0.02 5.51 0.00 -0.61 -4.58 121.76 124.43 1udn s ALA 160 Ca -0.06 -1.52 -0.05 0.00 0.00 0.00 0.00 51.96 50.33 1udn s ALA 160 Cb -0.12 1.28 -0.01 0.00 0.00 0.00 0.00 23.12 24.27 1udn s ALA 160 CO -0.05 -0.63 0.09 0.00 0.00 0.00 0.00 175.76 175.17 1udn s ALA 161 N -4.12 -0.15 0.08 0.00 0.00 -1.26 -1.23 121.76 115.07 1udn s ALA 161 Ca 0.34 -0.35 -0.15 0.00 0.00 0.00 0.00 51.96 51.80 1udn s ALA 161 Cb 0.06 0.16 0.03 0.00 0.00 0.00 0.00 23.12 23.36 1udn s ALA 161 CO 0.10 -0.23 0.34 0.54 0.00 0.00 0.00 175.76 176.52 1udn s VAL 162 N -1.74 0.08 0.19 0.00 0.11 -0.75 -4.61 120.40 113.68 1udn s VAL 162 Ca -0.12 -0.68 0.06 0.00 -2.93 0.00 0.00 61.98 58.31 1udn s VAL 162 Cb -0.06 -1.09 -0.04 0.00 -1.53 0.00 0.00 36.38 33.66 1udn s VAL 162 CO -0.01 -0.37 0.15 -0.94 -3.33 0.00 0.00 175.10 170.60 1udn s SER 163 N -2.45 5.51 -0.00 3.54 1.04 -1.26 -1.69 113.70 118.39 1udn s SER 163 Ca -0.01 -0.17 -0.15 0.00 0.48 0.00 0.00 55.95 56.10 1udn s SER 163 Cb 0.01 -1.42 0.02 0.00 0.10 0.00 0.00 66.02 64.73 1udn s SER 163 CO -0.07 0.03 0.31 0.54 0.98 0.00 0.00 173.24 175.03 1udn s VAL 164 N -1.88 0.06 0.32 5.02 0.11 -0.81 0.34 120.40 123.58 1udn s VAL 164 Ca 0.31 -0.51 -0.11 0.00 -2.93 0.00 0.00 61.98 58.75 1udn s VAL 164 Cb -0.09 -0.67 0.02 0.00 -1.53 0.00 0.00 36.38 34.10 1udn s VAL 164 CO 0.24 -0.28 0.58 -0.83 -3.33 0.00 0.00 175.10 171.48 1udn s GLY 165 N -1.45 0.77 -0.23 6.54 0.00 0.80 -0.32 107.32 113.43 1udn s GLY 165 Ca -0.12 -1.02 -0.00 0.00 0.00 0.00 0.00 44.72 43.58 1udn s GLY 165 CO 0.03 -0.63 -0.11 -0.42 0.00 0.00 0.00 173.10 171.98 1udn s ILE 166 N -3.21 2.54 -0.12 0.90 1.01 0.12 0.71 121.20 123.16 1udn s ILE 166 Ca 0.22 -1.10 0.00 0.00 0.00 0.00 0.00 60.65 59.78 1udn s ILE 166 Cb -0.02 -2.27 0.02 0.00 0.01 0.00 0.00 42.46 40.20 1udn s ILE 166 CO 0.13 0.25 -0.11 -0.69 0.00 0.00 0.00 174.94 174.53 1udn s VAL 167 N 1.28 1.27 -1.47 2.92 1.01 0.17 -1.42 120.40 124.16 1udn s VAL 167 Ca -0.00 -0.46 -0.04 0.00 0.00 0.00 0.00 61.98 61.48 1udn s VAL 167 Cb -0.16 -1.22 0.03 0.00 0.00 0.00 0.00 36.38 35.03 1udn s VAL 167 CO -0.07 0.41 0.48 0.59 0.00 0.00 0.00 175.10 176.51 1udn n ASN 168 N 4.67 -0.92 -0.77 3.32 5.03 -1.26 0.06 115.26 125.38 1udn n ASN 168 Ca -0.16 -1.02 -0.10 0.00 0.87 0.00 0.00 54.58 54.18 1udn n ASN 168 Cb 0.50 -2.95 -0.04 0.00 -1.02 0.00 0.00 39.78 36.27 1udn n ASN 168 CO 0.00 0.00 0.00 0.47 -1.83 0.00 0.00 177.26 175.90 1udn n ASP 169 N -2.92 -5.46 -4.70 6.41 9.92 -1.26 -4.97 116.55 113.57 1udn n ASP 169 Ca -0.23 0.25 -0.35 0.00 -0.53 0.00 0.00 54.79 53.93 1udn n ASP 169 Cb 0.65 -3.85 -0.09 0.00 -0.64 0.00 0.00 41.12 37.18 1udn n ASP 169 CO 0.00 0.00 0.00 -0.13 0.13 0.00 0.00 177.20 177.20 1udn s ARG 170 N -2.76 3.13 -0.39 -1.24 1.81 0.11 -5.07 118.95 114.54 1udn s ARG 170 Ca 0.00 -0.37 -0.20 0.00 -1.72 0.00 0.00 55.73 53.44 1udn s ARG 170 Cb 0.00 -2.88 0.01 0.00 -0.45 0.00 0.00 34.95 31.63 1udn s ARG 170 CO 0.00 0.67 0.60 0.42 -0.68 0.00 0.00 175.30 176.31 1udn s ILE 171 N -0.77 4.90 0.04 1.52 1.01 -1.26 0.46 121.20 127.10 1udn s ILE 171 Ca 0.12 0.30 0.05 0.00 0.00 0.00 0.00 60.65 61.12 1udn s ILE 171 Cb -0.12 -4.10 -0.04 0.00 0.01 0.00 0.00 42.46 38.21 1udn s ILE 171 CO 0.02 -0.41 -0.07 -0.76 0.00 0.00 0.00 174.94 173.72 1udn s LEU 172 N 2.66 3.16 -0.07 2.97 1.43 0.22 -4.73 118.68 124.32 1udn s LEU 172 Ca 0.22 -0.22 -0.05 0.00 -1.03 0.00 0.00 54.13 53.05 1udn s LEU 172 Cb -0.15 -1.87 -0.04 0.00 0.03 0.00 0.00 46.19 44.16 1udn s LEU 172 CO 0.16 0.24 0.15 -0.22 0.23 0.00 0.00 176.35 176.91 1udn s LEU 173 N -1.77 4.35 -0.44 1.79 2.96 -0.16 -0.14 118.68 125.27 1udn s LEU 173 Ca 0.19 0.40 -0.28 0.00 -0.22 0.00 0.00 54.13 54.23 1udn s LEU 173 Cb -0.11 -2.30 0.04 0.00 0.50 0.00 0.00 46.19 44.32 1udn s LEU 173 CO 0.11 0.34 0.63 -0.67 -1.32 0.00 0.00 176.35 175.44 1udn n ASP 174 N 1.53 -6.75 -4.73 3.68 2.03 0.15 -4.75 116.55 107.71 1udn n ASP 174 Ca -0.16 0.20 -0.41 0.00 0.52 0.00 0.00 54.79 54.94 1udn n ASP 174 Cb 0.54 -3.55 -0.05 0.00 -0.72 0.00 0.00 41.12 37.34 1udn n ASP 174 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1udn s LEU 175 N -2.53 4.51 0.00 -2.67 1.43 -1.26 -4.78 118.68 113.38 1udn s LEU 175 Ca 0.32 1.81 -0.08 0.00 -1.03 0.00 0.00 54.13 55.15 1udn s LEU 175 Cb -0.06 -3.59 0.13 0.00 0.03 0.00 0.00 46.19 42.71 1udn s LEU 175 CO 0.82 -0.04 0.81 -0.46 0.23 0.00 0.00 176.35 177.71 1udn n ASN 176 N 2.65 0.31 0.16 2.29 0.23 -1.26 -3.57 115.26 116.07 1udn n ASN 176 Ca 0.02 -1.44 0.03 0.00 -0.53 0.00 0.00 54.58 52.65 1udn n ASN 176 Cb 0.49 -0.59 0.39 0.00 -2.08 0.00 0.00 39.78 37.99 1udn n ASN 176 CO 0.00 0.00 0.00 0.15 -0.93 0.00 0.00 177.26 176.48 1udn h PHE 177 N -1.22 0.11 0.06 -2.53 3.57 -1.60 -2.28 116.94 113.05 1udn h PHE 177 Ca -0.26 -0.02 -0.28 0.00 3.53 0.00 0.00 57.97 60.94 1udn h PHE 177 Cb 0.78 -0.03 0.02 0.00 2.79 0.00 0.00 35.95 39.51 1udn h PHE 177 CO 0.00 0.35 -1.13 0.93 -2.23 0.00 0.00 178.31 176.23 1udn h GLU 178 N 0.10 0.62 -0.25 1.11 5.08 -1.93 -2.60 114.58 116.71 1udn h GLU 178 Ca 0.02 -0.75 -0.08 0.00 -1.00 0.00 0.00 59.36 57.54 1udn h GLU 178 Cb 0.50 0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.96 1udn h GLU 178 CO 0.03 1.32 -0.21 0.93 -1.00 0.00 0.00 179.01 180.09 1udn h GLU 179 N 0.32 0.45 -0.14 2.33 5.08 -1.92 -2.30 114.58 118.40 1udn h GLU 179 Ca -0.15 -0.15 -0.19 0.00 -1.00 0.00 0.00 59.36 57.87 1udn h GLU 179 Cb 1.79 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 31.00 1udn h GLU 179 CO 0.22 0.64 -0.69 0.22 -1.00 0.00 0.00 179.01 178.39 1udn h ASP 180 N 0.40 0.70 0.78 1.42 -0.00 -1.41 -2.42 116.42 115.90 1udn h ASP 180 Ca 0.07 -0.43 -0.10 0.00 -0.00 0.00 0.00 57.03 56.57 1udn h ASP 180 Cb 0.60 -0.20 -0.01 0.00 -0.00 0.00 0.00 39.33 39.71 1udn h ASP 180 CO 0.04 1.19 -0.46 0.77 -0.00 0.00 0.00 179.24 180.78 1udn h SER 181 N 0.43 0.00 -0.37 2.28 4.64 -1.33 -2.79 113.55 116.41 1udn h SER 181 Ca -0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 1udn h SER 181 Cb 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 1udn h SER 181 CO 0.13 0.46 0.00 0.00 -0.87 0.00 0.00 176.83 176.55 1udn n ALA 182 N -2.34 2.45 -2.24 5.18 0.00 -0.88 -4.95 120.51 117.73 1udn n ALA 182 Ca -0.00 -0.68 -0.38 0.00 0.00 0.00 0.00 53.44 52.38 1udn n ALA 182 Cb 0.55 -0.98 -0.06 0.00 0.00 0.00 0.00 19.45 18.96 1udn n ALA 182 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1udn s ALA 183 N -1.51 3.55 -0.01 0.00 0.00 -0.92 -4.56 121.76 118.31 1udn s ALA 183 Ca 0.28 0.05 -0.18 0.00 0.00 0.00 0.00 51.96 52.11 1udn s ALA 183 Cb 0.14 -2.67 -0.33 0.00 0.00 0.00 0.00 23.12 20.26 1udn s ALA 183 CO 0.19 0.39 0.91 1.96 0.00 0.00 0.00 175.76 179.22 1udn h GLN 184 N 4.22 0.43 -3.99 0.00 4.20 -1.57 -3.43 115.11 114.98 1udn h GLN 184 Ca -0.49 -0.74 -0.28 0.00 0.06 0.00 0.00 58.65 57.20 1udn h GLN 184 Cb 1.21 0.27 -0.29 0.00 0.30 0.00 0.00 27.48 28.98 1udn h GLN 184 CO 0.64 1.35 -0.74 0.08 -0.67 0.00 0.00 178.83 179.50 1udn s VAL 185 N -2.53 0.19 0.06 -0.54 1.01 -1.19 0.20 120.40 117.60 1udn s VAL 185 Ca -0.12 -0.09 -0.09 0.00 0.00 0.00 0.00 61.98 61.68 1udn s VAL 185 Cb 0.03 -0.18 0.00 0.00 0.00 0.00 0.00 36.38 36.23 1udn s VAL 185 CO 0.89 0.06 0.20 1.51 0.00 0.00 0.00 175.10 177.76 1udn s ASP 186 N 0.01 0.06 0.21 3.32 -4.77 -1.06 0.14 116.67 114.59 1udn s ASP 186 Ca 0.00 -0.46 -0.15 0.00 -3.30 0.00 0.00 52.55 48.65 1udn s ASP 186 Cb -0.02 0.31 0.01 0.00 -1.09 0.00 0.00 42.92 42.13 1udn s ASP 186 CO -0.00 -0.62 0.48 0.00 0.70 0.00 0.00 175.17 175.73 1udn s MET 187 N -2.99 1.43 -0.06 2.11 0.23 0.56 -1.32 119.30 119.26 1udn s MET 187 Ca -0.02 -1.05 0.02 0.00 -1.03 0.00 0.00 55.69 53.61 1udn s MET 187 Cb 0.01 0.49 0.01 0.00 -1.53 0.00 0.00 34.83 33.81 1udn s MET 187 CO -0.06 -0.59 -0.12 -0.80 -2.03 0.00 0.00 175.02 171.41 1udn s ASN 188 N -2.94 1.71 -0.03 -1.18 0.02 -0.34 -1.92 114.94 110.26 1udn s ASN 188 Ca 0.15 -0.28 0.07 0.00 -1.02 0.00 0.00 52.86 51.77 1udn s ASN 188 Cb -0.01 -0.73 -0.02 0.00 0.02 0.00 0.00 41.25 40.52 1udn s ASN 188 CO 0.02 0.05 -0.23 -0.69 0.02 0.00 0.00 177.10 176.26 1udn s VAL 189 N 0.56 1.86 -0.23 1.60 1.01 -0.68 -1.13 120.40 123.38 1udn s VAL 189 Ca -0.12 -0.99 0.02 0.00 0.00 0.00 0.00 61.98 60.89 1udn s VAL 189 Cb -0.14 -1.55 0.05 0.00 0.00 0.00 0.00 36.38 34.73 1udn s VAL 189 CO 0.03 0.52 -0.12 -0.69 0.00 0.00 0.00 175.10 174.85 1udn s VAL 190 N -0.41 1.97 0.39 2.92 1.01 0.46 -1.81 120.40 124.93 1udn s VAL 190 Ca 0.05 -1.35 0.07 0.00 0.00 0.00 0.00 61.98 60.75 1udn s VAL 190 Cb -0.10 -2.05 -0.07 0.00 0.00 0.00 0.00 36.38 34.16 1udn s VAL 190 CO 0.00 0.09 -0.01 -0.83 0.00 0.00 0.00 175.10 174.36 1udn s GLY 191 N 1.22 2.39 0.38 4.51 0.00 -0.37 0.98 107.32 116.44 1udn s GLY 191 Ca -0.05 -2.23 0.08 0.00 0.00 0.00 0.00 44.72 42.52 1udn s GLY 191 CO -0.07 -2.05 0.26 -0.51 0.00 0.00 0.00 173.10 170.73 1udn s THR 192 N -2.76 2.85 0.27 0.90 -4.23 -0.29 -1.57 115.64 110.82 1udn s THR 192 Ca 0.35 -1.51 -0.03 0.00 -1.18 0.00 0.00 61.69 59.32 1udn s THR 192 Cb 0.08 -3.03 0.27 0.00 1.34 0.00 0.00 72.50 71.16 1udn s THR 192 CO 0.17 -0.08 1.92 1.23 -0.54 0.00 0.00 174.62 177.32 1udn h GLY 193 N 1.28 1.40 -0.98 3.99 0.00 -1.66 -1.50 103.07 105.61 1udn h GLY 193 Ca -0.43 -0.48 0.00 0.00 0.00 0.00 0.00 47.33 46.42 1udn h GLY 193 CO 0.61 0.41 0.00 -1.14 0.00 0.00 0.00 176.54 176.43 1udn n SER 194 N -4.44 0.84 0.00 0.19 3.41 -1.26 -4.82 113.62 107.54 1udn n SER 194 Ca 0.13 -1.72 0.00 0.00 -0.26 0.00 0.00 58.87 57.02 1udn n SER 194 Cb 0.10 -0.42 0.00 0.00 -0.26 0.00 0.00 64.21 63.63 1udn n SER 194 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1udn n GLY 195 N 0.08 0.63 2.64 5.00 0.00 -0.56 -5.04 105.19 107.93 1udn n GLY 195 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 1udn n GLY 195 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1udn n ARG 196 N -2.37 -0.16 -4.42 1.61 1.74 -1.25 -4.84 116.66 106.97 1udn n ARG 196 Ca 0.00 -1.73 -0.25 0.00 -0.77 0.00 0.00 57.85 55.10 1udn n ARG 196 Cb 0.03 -0.59 -0.13 0.00 -1.02 0.00 0.00 32.46 30.75 1udn n ARG 196 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1udn s LEU 197 N 0.00 2.26 -0.05 0.55 1.43 -1.26 -1.13 118.68 120.48 1udn s LEU 197 Ca 0.47 -0.64 0.04 0.00 -1.03 0.00 0.00 54.13 52.97 1udn s LEU 197 Cb -0.02 -0.95 -0.06 0.00 0.03 0.00 0.00 46.19 45.19 1udn s LEU 197 CO 0.32 0.10 0.01 -0.24 0.23 0.00 0.00 176.35 176.77 1udn n SER 198 N 1.32 3.84 -3.60 2.29 2.88 0.28 -4.89 113.62 115.73 1udn n SER 198 Ca -0.19 -0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.23 1udn n SER 198 Cb 0.53 0.58 -0.06 0.00 -0.75 0.00 0.00 64.21 64.51 1udn n SER 198 CO 0.00 0.00 0.00 -0.70 -1.23 0.00 0.00 175.04 173.11 1udn s GLU 199 N -2.11 0.67 -0.15 -1.46 2.12 -0.91 -4.96 118.70 111.90 1udn s GLU 199 Ca -0.03 0.52 -0.06 0.00 0.36 0.00 0.00 54.97 55.76 1udn s GLU 199 Cb 0.01 0.32 0.07 0.00 0.26 0.00 0.00 34.13 34.80 1udn s GLU 199 CO 0.19 -0.14 0.31 0.54 -0.54 0.00 0.00 175.26 175.62 1udn s VAL 200 N -0.28 -0.39 -0.19 3.70 0.11 -1.26 -0.40 120.40 121.70 1udn s VAL 200 Ca -0.01 0.22 0.01 0.00 -2.93 0.00 0.00 61.98 59.27 1udn s VAL 200 Cb -0.03 -0.50 0.04 0.00 -1.53 0.00 0.00 36.38 34.36 1udn s VAL 200 CO -0.00 0.09 -0.10 -2.28 -3.33 0.00 0.00 175.10 169.47 1udn s HIS 201 N 2.23 2.29 -0.13 1.54 5.04 -0.28 -4.99 115.29 120.99 1udn s HIS 201 Ca -0.02 -1.47 0.01 0.00 -1.54 0.00 0.00 55.06 52.04 1udn s HIS 201 Cb -0.11 -1.59 -0.01 0.00 0.04 0.00 0.00 32.58 30.90 1udn s HIS 201 CO -0.10 -0.72 -0.16 0.99 -2.34 0.00 0.00 174.74 172.41 1udn s THR 202 N 1.44 2.69 -0.08 0.89 2.01 -1.26 -1.20 115.64 120.13 1udn s THR 202 Ca 0.00 -0.78 0.01 0.00 0.31 0.00 0.00 61.69 61.23 1udn s THR 202 Cb -0.15 -2.11 0.02 0.00 0.01 0.00 0.00 72.50 70.27 1udn s THR 202 CO -0.09 0.53 -0.08 -0.04 -0.69 0.00 0.00 174.62 174.25 1udn s MET 203 N 0.47 1.40 0.15 4.92 -1.94 -0.43 -5.01 119.30 118.86 1udn s MET 203 Ca -0.11 -0.26 -0.30 0.00 -1.71 0.00 0.00 55.69 53.30 1udn s MET 203 Cb -0.16 -1.33 -0.07 0.00 2.01 0.00 0.00 34.83 35.27 1udn s MET 203 CO 0.05 -0.12 0.99 0.20 -0.01 0.00 0.00 175.02 176.13 1udn s GLY 204 N 1.17 2.99 -1.01 -0.03 0.00 -1.26 -2.57 107.32 106.61 1udn s GLY 204 Ca -0.06 0.64 -0.02 0.00 0.00 0.00 0.00 44.72 45.28 1udn s GLY 204 CO -0.02 1.45 1.37 1.18 0.00 0.00 0.00 173.10 177.09 1udn n GLU 205 N 2.44 4.18 -1.00 2.90 -0.58 0.13 -4.55 120.64 124.17 1udn n GLU 205 Ca 0.02 -4.58 0.00 0.00 -0.42 0.00 0.00 57.16 52.17 1udn n GLU 205 Cb 0.48 -2.47 0.00 0.00 -0.57 0.00 0.00 31.44 28.88 1udn n GLU 205 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 1udn n GLU 206 N 1.21 -0.33 -4.22 3.49 1.02 -1.26 -4.85 120.64 115.69 1udn n GLU 206 Ca 0.27 0.08 -0.19 0.00 -0.02 0.00 0.00 57.16 57.30 1udn n GLU 206 Cb 0.34 -3.32 -0.12 0.00 -0.02 0.00 0.00 31.44 28.33 1udn n GLU 206 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 1udn s TYR 207 N -1.91 1.39 0.33 -0.32 1.51 -1.26 -5.15 117.35 111.93 1udn s TYR 207 Ca 0.00 -0.50 0.09 0.00 -1.01 0.00 0.00 57.07 55.65 1udn s TYR 207 Cb 0.00 -0.75 -0.05 0.00 -0.11 0.00 0.00 41.96 41.05 1udn s TYR 207 CO 0.00 0.12 0.06 -1.54 -1.11 0.00 0.00 175.55 173.08 1udn s SER 208 N -2.10 4.42 0.26 2.29 1.04 -1.26 -4.32 113.70 114.03 1udn s SER 208 Ca 0.04 -0.86 0.01 0.00 0.48 0.00 0.00 55.95 55.62 1udn s SER 208 Cb -0.08 -0.64 -0.05 0.00 0.10 0.00 0.00 66.02 65.35 1udn s SER 208 CO 0.03 -0.23 0.12 0.72 0.98 0.00 0.00 173.24 174.85 1udn s PHE 209 N -2.46 1.48 0.24 5.02 -0.71 -1.26 -5.05 117.98 115.24 1udn s PHE 209 Ca 0.36 -1.27 0.05 0.00 -1.04 0.00 0.00 56.93 55.03 1udn s PHE 209 Cb -0.02 -0.82 -0.03 0.00 -1.21 0.00 0.00 43.02 40.94 1udn s PHE 209 CO 0.21 -0.44 0.32 0.95 -1.34 0.00 0.00 175.22 174.92 1udn s THR 210 N -3.80 5.09 0.28 -4.49 -4.23 -1.26 -4.99 115.64 102.24 1udn s THR 210 Ca 0.38 -1.07 0.01 0.00 -1.18 0.00 0.00 61.69 59.83 1udn s THR 210 Cb 0.07 -3.76 0.28 0.00 1.34 0.00 0.00 72.50 70.44 1udn s THR 210 CO 0.14 -0.32 1.85 0.50 -0.54 0.00 0.00 174.62 176.24 1udn h LYS 211 N 1.28 0.98 -0.26 3.99 3.64 -2.01 -1.11 116.57 123.07 1udn h LYS 211 Ca -0.51 -0.06 -0.12 0.00 -1.27 0.00 0.00 60.65 58.69 1udn h LYS 211 Cb 1.23 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 32.82 1udn h LYS 211 CO 0.61 0.65 -0.33 -0.44 -2.27 0.00 0.00 179.45 177.67 1udn h ASP 212 N 1.01 0.57 -0.65 4.20 3.32 -1.99 -1.45 116.42 121.43 1udn h ASP 212 Ca 0.49 -0.22 -0.06 0.00 0.02 0.00 0.00 57.03 57.26 1udn h ASP 212 Cb 0.45 -0.16 -0.03 0.00 0.22 0.00 0.00 39.33 39.82 1udn h ASP 212 CO -0.25 0.86 0.19 -0.33 -1.72 0.00 0.00 179.24 177.99 1udn h GLU 213 N 0.47 1.01 -0.71 3.56 5.08 -1.69 -1.02 114.58 121.28 1udn h GLU 213 Ca 0.05 -0.23 0.03 0.00 -1.00 0.00 0.00 59.36 58.22 1udn h GLU 213 Cb 0.80 -0.14 -0.04 0.00 0.50 0.00 0.00 28.75 29.86 1udn h GLU 213 CO 0.07 0.90 0.45 1.25 -1.00 0.00 0.00 179.01 180.67 1udn h LEU 214 N 0.94 0.73 -0.69 1.33 6.46 -0.82 -1.18 115.31 122.09 1udn h LEU 214 Ca 0.21 -0.00 -0.09 0.00 -0.12 0.00 0.00 57.88 57.88 1udn h LEU 214 Cb 0.32 -0.16 -0.02 0.00 -0.73 0.00 0.00 40.66 40.06 1udn h LEU 214 CO -0.00 0.51 0.05 0.40 -0.62 0.00 0.00 178.44 178.77 1udn h ILE 215 N 0.87 1.26 -0.69 4.05 1.08 -0.88 0.20 117.51 123.40 1udn h ILE 215 Ca 0.28 -1.09 0.01 0.00 -0.39 0.00 0.00 64.86 63.68 1udn h ILE 215 Cb 0.02 0.72 -0.03 0.00 -3.07 0.00 0.00 36.82 34.46 1udn h ILE 215 CO -0.11 0.40 0.46 0.11 -0.69 0.00 0.00 178.15 178.32 1udn h LYS 216 N 0.98 0.92 -0.07 2.37 1.57 -0.58 0.31 116.57 122.06 1udn h LYS 216 Ca 0.18 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.89 1udn h LYS 216 Cb 0.49 -0.21 -0.00 0.00 0.08 0.00 0.00 32.23 32.59 1udn h LYS 216 CO 0.02 0.61 -0.01 0.52 -0.57 0.00 0.00 179.45 180.02 1udn h MET 217 N 0.94 0.12 -0.21 3.15 2.86 -0.84 -2.06 114.93 118.89 1udn h MET 217 Ca 0.25 -0.04 0.06 0.00 -2.06 0.00 0.00 59.70 57.91 1udn h MET 217 Cb -0.10 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.54 1udn h MET 217 CO -0.05 0.44 0.16 1.25 1.06 0.00 0.00 176.91 179.76 1udn h LEU 218 N -0.20 0.00 -0.11 1.22 5.85 -0.28 0.03 115.31 121.81 1udn h LEU 218 Ca 0.02 0.00 -0.10 0.00 0.84 0.00 0.00 57.88 58.63 1udn h LEU 218 Cb 0.39 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.42 1udn h LEU 218 CO 0.01 0.00 -0.34 0.44 -0.34 0.00 0.00 178.44 178.21 1udn h ASP 219 N 0.00 0.49 -0.60 1.25 3.32 -0.59 -1.68 116.42 118.62 1udn h ASP 219 Ca 0.10 -0.60 -0.08 0.00 0.02 0.00 0.00 57.03 56.47 1udn h ASP 219 Cb 0.41 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.79 1udn h ASP 219 CO -0.00 1.00 0.07 0.25 -1.72 0.00 0.00 179.24 178.84 1udn h LEU 220 N 0.00 0.98 -0.22 1.55 5.85 -0.67 -2.65 115.31 120.16 1udn h LEU 220 Ca -0.01 -0.28 -0.00 0.00 0.84 0.00 0.00 57.88 58.43 1udn h LEU 220 Cb 0.95 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.71 1udn h LEU 220 CO 0.07 1.01 0.13 0.00 -0.34 0.00 0.00 178.44 179.32 1udn h ALA 221 N 1.00 0.28 -0.04 1.25 0.00 -1.02 -1.61 119.26 119.12 1udn h ALA 221 Ca 0.18 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.06 1udn h ALA 221 Cb 0.47 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 1udn h ALA 221 CO 0.02 -0.21 0.04 1.96 0.00 0.00 0.00 179.25 181.05 1udn h GLN 222 N 0.27 0.00 -0.01 0.00 4.20 -1.17 0.23 115.11 118.63 1udn h GLN 222 Ca 0.08 0.00 -0.19 0.00 0.06 0.00 0.00 58.65 58.60 1udn h GLN 222 Cb 0.02 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.79 1udn h GLN 222 CO -0.01 0.00 -0.84 0.87 -0.67 0.00 0.00 178.83 178.18 1udn h LYS 223 N 0.00 0.21 -0.33 1.46 1.57 -0.97 -2.34 116.57 116.16 1udn h LYS 223 Ca 0.02 -0.22 -0.13 0.00 -1.87 0.00 0.00 60.65 58.45 1udn h LYS 223 Cb 0.09 0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.45 1udn h LYS 223 CO -0.00 0.93 -0.33 0.78 -0.57 0.00 0.00 179.45 180.27 1udn h GLY 224 N 1.77 0.78 1.47 3.86 0.00 0.26 -2.46 103.07 108.76 1udn h GLY 224 Ca -0.04 -0.74 -0.08 0.00 0.00 0.00 0.00 47.33 46.48 1udn h GLY 224 CO 0.13 0.67 -0.08 -2.22 0.00 0.00 0.00 176.54 175.04 1udn h ILE 225 N 0.61 1.24 -0.35 2.60 1.08 -0.94 -1.70 117.51 120.05 1udn h ILE 225 Ca 0.07 -1.04 -0.03 0.00 -0.39 0.00 0.00 64.86 63.47 1udn h ILE 225 Cb 0.85 1.04 -0.01 0.00 -3.07 0.00 0.00 36.82 35.63 1udn h ILE 225 CO 0.07 0.35 0.09 0.78 -0.69 0.00 0.00 178.15 178.75 1udn h ASN 226 N 0.59 0.53 -0.53 1.72 2.35 -1.13 0.19 115.58 119.29 1udn h ASN 226 Ca 0.11 -0.23 -0.05 0.00 -0.55 0.00 0.00 56.30 55.59 1udn h ASN 226 Cb 0.49 -0.14 -0.02 0.00 0.05 0.00 0.00 38.32 38.70 1udn h ASN 226 CO 0.03 0.62 0.15 -0.33 -1.65 0.00 0.00 177.43 176.25 1udn h GLU 227 N 0.41 0.84 -0.20 0.81 5.08 -1.26 -0.23 114.58 120.03 1udn h GLU 227 Ca 0.11 -0.19 -0.08 0.00 -1.00 0.00 0.00 59.36 58.20 1udn h GLU 227 Cb 0.30 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 1udn h GLU 227 CO 0.00 0.78 -0.23 -0.07 -1.00 0.00 0.00 179.01 178.49 1udn h LEU 228 N 0.74 0.35 -0.24 1.33 3.38 -1.13 -2.23 115.31 117.50 1udn h LEU 228 Ca 0.17 -0.10 -0.07 0.00 0.09 0.00 0.00 57.88 57.96 1udn h LEU 228 Cb 0.30 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 1udn h LEU 228 CO -0.00 0.59 -0.35 0.40 0.09 0.00 0.00 178.44 179.16 1udn h ILE 229 N 0.32 0.64 -0.07 1.22 2.04 -0.13 -2.30 117.51 119.23 1udn h ILE 229 Ca 0.05 -1.77 -0.11 0.00 1.00 0.00 0.00 64.86 64.03 1udn h ILE 229 Cb 0.58 2.21 -0.01 0.00 -0.74 0.00 0.00 36.82 38.86 1udn h ILE 229 CO 0.04 0.35 -0.46 -0.33 0.00 0.00 0.00 178.15 177.75 1udn h GLU 230 N 0.00 0.18 0.33 2.37 4.39 -0.46 0.13 114.58 121.51 1udn h GLU 230 Ca -0.00 -0.09 -0.02 0.00 0.34 0.00 0.00 59.36 59.59 1udn h GLU 230 Cb 1.18 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.83 1udn h GLU 230 CO 0.05 0.61 -0.16 -0.07 -1.16 0.00 0.00 179.01 178.27 1udn h LEU 231 N 0.15 -0.37 -1.04 1.33 3.38 -1.28 -3.13 115.31 114.34 1udn h LEU 231 Ca 0.01 -0.17 0.24 0.00 0.09 0.00 0.00 57.88 58.05 1udn h LEU 231 Cb 0.87 0.10 -0.12 0.00 0.09 0.00 0.00 40.66 41.60 1udn h LEU 231 CO 0.07 0.07 0.61 1.56 0.09 0.00 0.00 178.44 180.83 1udn h GLN 232 N -0.93 0.58 0.00 1.13 4.20 -1.24 -0.68 115.11 118.18 1udn h GLN 232 Ca -0.05 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.60 1udn h GLN 232 Cb 0.52 -0.13 -0.00 0.00 0.30 0.00 0.00 27.48 28.16 1udn h GLN 232 CO 0.07 0.39 -0.12 0.87 -0.67 0.00 0.00 178.83 179.37 1udn h LYS 233 N 0.60 0.00 0.00 1.46 1.57 -0.69 -1.77 116.57 117.74 1udn h LYS 233 Ca 0.63 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.41 1udn h LYS 233 Cb 1.19 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.50 1udn h LYS 233 CO -0.44 0.12 0.00 1.63 -0.57 0.00 0.00 179.45 180.19 1udn n LYS 234 N -4.19 0.10 0.00 3.15 5.02 -0.26 -2.26 118.16 119.72 1udn n LYS 234 Ca -0.03 0.22 0.12 0.00 -2.02 0.00 0.00 58.31 56.60 1udn n LYS 234 Cb 0.20 -1.50 0.09 0.00 -0.02 0.00 0.00 35.03 33.79 1udn n LYS 234 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1udn n LEU 235 N -1.38 2.40 -4.26 -0.35 4.77 -0.66 -4.67 117.00 112.84 1udn n LEU 235 Ca 0.05 -0.83 -0.14 0.00 -0.03 0.00 0.00 56.01 55.05 1udn n LEU 235 Cb 0.12 -0.01 -0.10 0.00 -2.33 0.00 0.00 43.42 41.11 1udn n LEU 235 CO 0.11 0.42 -0.38 -0.31 -1.33 0.00 0.00 177.39 175.90 1udn s TYR 236 N -2.24 1.28 -0.18 -1.77 1.51 -0.96 -0.65 117.35 114.34 1udn s TYR 236 Ca 0.24 -0.85 -0.01 0.00 -1.01 0.00 0.00 57.07 55.44 1udn s TYR 236 Cb 0.19 -0.69 0.05 0.00 -0.11 0.00 0.00 41.96 41.40 1udn s TYR 236 CO 0.44 -0.01 -0.00 0.08 -1.11 0.00 0.00 175.55 174.94 1udn s VAL 237 N -3.43 0.82 0.05 0.71 1.01 -0.10 -4.55 120.40 114.91 1udn s VAL 237 Ca 0.20 -0.62 0.08 0.00 0.00 0.00 0.00 61.98 61.64 1udn s VAL 237 Cb 0.04 -1.17 -0.03 0.00 0.00 0.00 0.00 36.38 35.21 1udn s VAL 237 CO 0.02 -0.06 -0.21 -0.63 0.00 0.00 0.00 175.10 174.22 1udn s ILE 238 N 1.74 2.57 -0.24 2.22 1.09 -1.26 -2.29 121.20 125.03 1udn s ILE 238 Ca -0.01 -1.30 -0.12 0.00 -1.10 0.00 0.00 60.65 58.13 1udn s ILE 238 Cb -0.16 -2.07 0.08 0.00 -1.06 0.00 0.00 42.46 39.25 1udn s ILE 238 CO -0.07 0.32 0.57 -1.58 -0.10 0.00 0.00 174.94 174.07 1udn s GLN 239 N -1.45 0.54 -1.58 2.79 0.74 -0.75 -4.93 119.66 115.02 1udn s GLN 239 Ca 0.14 1.12 -0.10 0.00 0.05 0.00 0.00 55.36 56.58 1udn s GLN 239 Cb -0.10 0.26 0.08 0.00 1.10 0.00 0.00 33.01 34.35 1udn s GLN 239 CO 0.05 -0.18 0.56 -3.47 -0.55 0.00 0.00 175.29 171.70 1udn n ASP 240 N 4.66 -1.66 -0.26 6.67 4.64 -1.26 -0.36 116.55 128.98 1udn n ASP 240 Ca -0.18 -1.04 -0.03 0.00 -1.38 0.00 0.00 54.79 52.15 1udn n ASP 240 Cb 0.55 -2.72 -0.01 0.00 -1.04 0.00 0.00 41.12 37.89 1udn n ASP 240 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 1udn n GLY 241 N -1.74 0.61 3.50 0.27 0.00 -1.26 -5.01 105.19 101.56 1udn n GLY 241 Ca -0.12 -0.33 -0.36 0.00 0.00 0.00 0.00 46.02 45.21 1udn n GLY 241 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1udn s LYS 242 N -1.58 3.76 -0.15 1.61 1.02 0.51 -4.54 119.74 120.36 1udn s LYS 242 Ca 0.00 -0.43 -0.03 0.00 0.02 0.00 0.00 55.97 55.53 1udn s LYS 242 Cb 0.00 -3.32 -0.03 0.00 -0.52 0.00 0.00 37.83 33.97 1udn s LYS 242 CO 0.00 -0.07 -0.05 -1.58 -0.92 0.00 0.00 175.35 172.73 1udn s TRP 243 N 1.30 2.99 0.11 3.18 0.52 -1.26 -1.81 118.94 123.97 1udn s TRP 243 Ca 0.05 -0.36 0.03 0.00 0.02 0.00 0.00 56.10 55.84 1udn s TRP 243 Cb -0.15 -1.94 -0.04 0.00 -1.15 0.00 0.00 33.47 30.19 1udn s TRP 243 CO 0.04 -0.06 -0.08 -1.21 0.02 0.00 0.00 176.95 175.65 1udn s GLU 244 N 0.36 0.89 0.23 4.98 0.41 -0.97 -4.88 118.70 119.72 1udn s GLU 244 Ca -0.05 -1.30 -0.19 0.00 -0.41 0.00 0.00 54.97 53.01 1udn s GLU 244 Cb -0.14 -0.40 -0.08 0.00 -1.78 0.00 0.00 34.13 31.73 1udn s GLU 244 CO 0.03 0.03 0.72 1.03 -0.49 0.00 0.00 175.26 176.59 1udn s ARG 245 N -3.49 4.23 0.57 1.61 0.52 -1.26 -0.93 118.95 120.21 1udn s ARG 245 Ca 0.11 0.85 -0.10 0.00 -0.52 0.00 0.00 55.73 56.08 1udn s ARG 245 Cb 0.02 -2.85 0.13 0.00 0.52 0.00 0.00 34.95 32.77 1udn s ARG 245 CO -0.02 0.38 0.67 -1.13 0.02 0.00 0.00 175.30 175.22 1udn n SER 246 N 0.66 -0.51 -0.61 0.23 3.41 0.18 -4.65 113.62 112.33 1udn n SER 246 Ca -0.02 -1.12 0.10 0.00 -0.26 0.00 0.00 58.87 57.57 1udn n SER 246 Cb 0.51 -0.54 0.32 0.00 -0.26 0.00 0.00 64.21 64.24 1udn n SER 246 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1udn n GLU 247 N -2.77 1.79 -2.71 4.33 -0.58 -1.26 -4.88 120.64 114.56 1udn n GLU 247 Ca 0.09 -1.20 -0.41 0.00 -0.42 0.00 0.00 57.16 55.22 1udn n GLU 247 Cb 0.31 -1.38 -0.05 0.00 -0.57 0.00 0.00 31.44 29.75 1udn n GLU 247 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1udn s LEU 248 N -1.45 4.57 -0.02 -4.62 1.43 -1.26 -4.89 118.68 112.45 1udn s LEU 248 Ca 0.31 1.91 0.16 0.00 -1.03 0.00 0.00 54.13 55.48 1udn s LEU 248 Cb 0.17 -3.60 -0.23 0.00 0.03 0.00 0.00 46.19 42.56 1udn s LEU 248 CO 0.25 0.02 0.42 0.29 0.23 0.00 0.00 176.35 177.56 1udn n LYS 249 N 2.09 0.81 -3.75 1.70 4.76 -1.26 -4.91 118.16 117.59 1udn n LYS 249 Ca 0.00 -0.11 -0.13 0.00 -2.87 0.00 0.00 58.31 55.20 1udn n LYS 249 Cb 0.48 -1.35 -0.10 0.00 -1.84 0.00 0.00 35.03 32.21 1udn n LYS 249 CO 0.00 0.00 0.00 -2.00 -1.37 0.00 0.00 177.40 174.03 1udn s GLU 250 N -2.96 0.42 0.06 1.97 2.12 -1.26 -1.05 118.70 117.99 1udn s GLU 250 Ca -0.03 0.43 0.04 0.00 0.36 0.00 0.00 54.97 55.77 1udn s GLU 250 Cb 0.11 0.20 -0.03 0.00 0.26 0.00 0.00 34.13 34.68 1udn s GLU 250 CO 0.66 -0.06 -0.12 0.08 -0.54 0.00 0.00 175.26 175.28 1udn s VAL 251 N 0.07 0.91 0.01 3.70 1.01 -0.61 -5.01 120.40 120.48 1udn s VAL 251 Ca -0.01 -1.15 -0.17 0.00 0.00 0.00 0.00 61.98 60.65 1udn s VAL 251 Cb -0.03 -0.89 0.03 0.00 0.00 0.00 0.00 36.38 35.49 1udn s VAL 251 CO 0.01 -0.23 0.37 -0.94 0.00 0.00 0.00 175.10 174.31 1udn s SER 252 N -1.55 -0.25 0.33 3.32 1.04 -1.26 -0.84 113.70 114.50 1udn s SER 252 Ca -0.04 0.08 -0.27 0.00 0.48 0.00 0.00 55.95 56.20 1udn s SER 252 Cb -0.09 0.37 -0.09 0.00 0.10 0.00 0.00 66.02 66.30 1udn s SER 252 CO 0.01 -0.54 1.11 -0.94 0.98 0.00 0.00 173.24 173.87 1udn s SER 253 N -1.59 6.97 0.47 7.02 1.04 0.08 -4.88 113.70 122.81 1udn s SER 253 Ca -0.10 2.25 0.30 0.00 0.48 0.00 0.00 55.95 58.88 1udn s SER 253 Cb -0.03 -2.62 1.08 0.00 0.10 0.00 0.00 66.02 64.56 1udn s SER 253 CO 0.02 -0.35 1.86 0.00 0.98 0.00 0.00 173.24 175.75 1udn h THR 254 N 2.73 0.00 0.00 2.02 1.03 -2.00 -3.43 112.91 113.26 1udn h THR 254 Ca -0.48 -0.56 0.00 0.00 -0.01 0.00 0.00 66.41 65.36 1udn h THR 254 Cb 1.22 1.52 0.00 0.00 -1.07 0.00 0.00 68.15 69.82 1udn h THR 254 CO 0.65 0.00 0.00 0.41 -0.01 0.00 0.00 175.52 176.57