#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rk2 n GLY 5 N 0.00 -2.12 3.85 0.00 0.00 -1.25 -4.87 105.19 100.80 1rk2 n GLY 5 Ca 0.00 -0.96 -0.36 0.00 0.00 0.00 0.00 46.02 44.70 1rk2 n GLY 5 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1rk2 s SER 6 N -2.16 6.75 -0.06 1.61 1.04 -1.26 -4.52 113.70 115.11 1rk2 s SER 6 Ca 0.63 0.93 0.03 0.00 0.48 0.00 0.00 55.95 58.02 1rk2 s SER 6 Cb -0.20 -2.23 -0.03 0.00 0.10 0.00 0.00 66.02 63.66 1rk2 s SER 6 CO 0.65 0.20 -0.13 -0.22 0.98 0.00 0.00 173.24 174.72 1rk2 s LEU 7 N -1.68 2.82 -0.17 2.42 2.96 0.11 -0.39 118.68 124.75 1rk2 s LEU 7 Ca 0.32 -0.17 0.01 0.00 -0.22 0.00 0.00 54.13 54.06 1rk2 s LEU 7 Cb -0.15 -1.59 0.02 0.00 0.50 0.00 0.00 46.19 44.98 1rk2 s LEU 7 CO 0.17 0.34 -0.16 -0.69 -1.32 0.00 0.00 176.35 174.69 1rk2 s VAL 8 N -0.66 1.77 -0.17 1.68 1.01 -0.46 -0.96 120.40 122.59 1rk2 s VAL 8 Ca 0.10 -0.79 -0.07 0.00 0.00 0.00 0.00 61.98 61.22 1rk2 s VAL 8 Cb -0.11 -1.65 -0.04 0.00 0.00 0.00 0.00 36.38 34.58 1rk2 s VAL 8 CO 0.01 0.46 0.05 -0.69 0.00 0.00 0.00 175.10 174.93 1rk2 s VAL 9 N 1.40 4.66 -0.18 2.92 1.01 -0.26 -1.00 120.40 128.96 1rk2 s VAL 9 Ca 0.04 -0.08 0.01 0.00 0.00 0.00 0.00 61.98 61.95 1rk2 s VAL 9 Cb -0.13 -3.09 0.03 0.00 0.00 0.00 0.00 36.38 33.19 1rk2 s VAL 9 CO -0.11 0.47 -0.15 -0.22 0.00 0.00 0.00 175.10 175.09 1rk2 s LEU 10 N 0.30 2.06 0.00 3.92 0.20 -0.51 -0.40 118.68 124.26 1rk2 s LEU 10 Ca 0.02 -0.68 0.00 0.00 0.69 0.00 0.00 54.13 54.17 1rk2 s LEU 10 Cb -0.13 -1.31 0.00 0.00 -0.43 0.00 0.00 46.19 44.32 1rk2 s LEU 10 CO 0.01 -0.06 0.00 0.61 -0.29 0.00 0.00 176.35 176.61 1rk2 n GLY 11 N 4.68 0.51 3.88 7.98 0.00 -0.96 -3.97 105.19 117.31 1rk2 n GLY 11 Ca -0.18 -0.74 -0.30 0.00 0.00 0.00 0.00 46.02 44.81 1rk2 n GLY 11 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1rk2 s SER 12 N -0.05 5.91 -0.06 1.61 1.04 -1.26 -4.45 113.70 116.44 1rk2 s SER 12 Ca 0.00 1.23 -0.01 0.00 0.48 0.00 0.00 55.95 57.65 1rk2 s SER 12 Cb 0.00 -2.21 0.03 0.00 0.10 0.00 0.00 66.02 63.94 1rk2 s SER 12 CO 0.00 -1.02 -0.01 -0.63 0.98 0.00 0.00 173.24 172.56 1rk2 s ILE 13 N -3.19 0.38 0.16 -1.02 1.01 -1.26 -0.53 121.20 116.75 1rk2 s ILE 13 Ca 0.55 0.08 0.06 0.00 0.00 0.00 0.00 60.65 61.34 1rk2 s ILE 13 Cb -0.11 -0.51 -0.04 0.00 0.01 0.00 0.00 42.46 41.80 1rk2 s ILE 13 CO 0.52 0.24 -0.12 0.20 0.00 0.00 0.00 174.94 175.78 1rk2 s ASN 14 N 1.71 2.06 -0.29 3.58 0.02 -0.59 -3.38 114.94 118.06 1rk2 s ASN 14 Ca 0.01 -1.00 -0.04 0.00 -1.02 0.00 0.00 52.86 50.81 1rk2 s ASN 14 Cb -0.13 -0.06 0.03 0.00 0.02 0.00 0.00 41.25 41.12 1rk2 s ASN 14 CO -0.04 -0.26 0.01 0.00 0.02 0.00 0.00 177.10 176.83 1rk2 s ALA 15 N -3.13 2.87 0.12 0.60 0.00 -0.75 0.06 121.76 121.53 1rk2 s ALA 15 Ca 0.18 -1.58 -0.24 0.00 0.00 0.00 0.00 51.96 50.32 1rk2 s ALA 15 Cb 0.01 -1.95 -0.07 0.00 0.00 0.00 0.00 23.12 21.11 1rk2 s ALA 15 CO 0.03 -1.03 0.74 -0.51 0.00 0.00 0.00 175.76 174.98 1rk2 s ASP 16 N 1.36 7.29 -0.35 0.00 1.01 0.27 -2.49 116.67 123.76 1rk2 s ASP 16 Ca -0.01 1.53 -0.02 0.00 0.71 0.00 0.00 52.55 54.76 1rk2 s ASP 16 Cb -0.18 -2.47 0.08 0.00 1.01 0.00 0.00 42.92 41.36 1rk2 s ASP 16 CO -0.01 0.17 0.09 -1.00 0.21 0.00 0.00 175.17 174.63 1rk2 s HIS 17 N -0.87 3.46 -0.14 4.23 3.76 -0.14 -1.55 115.29 124.04 1rk2 s HIS 17 Ca 0.35 -2.24 -0.02 0.00 -0.15 0.00 0.00 55.06 53.01 1rk2 s HIS 17 Cb -0.22 -2.67 -0.02 0.00 1.11 0.00 0.00 32.58 30.78 1rk2 s HIS 17 CO 0.24 -0.89 -0.09 0.42 -0.85 0.00 0.00 174.74 173.57 1rk2 s ILE 18 N 1.16 3.38 -0.18 0.60 1.01 0.19 -0.36 121.20 127.00 1rk2 s ILE 18 Ca 0.02 -0.54 0.01 0.00 0.00 0.00 0.00 60.65 60.14 1rk2 s ILE 18 Cb -0.21 -2.45 0.04 0.00 0.01 0.00 0.00 42.46 39.84 1rk2 s ILE 18 CO -0.03 0.51 -0.11 -0.22 0.00 0.00 0.00 174.94 175.08 1rk2 s LEU 19 N 0.41 2.00 0.03 2.97 2.96 -0.01 0.57 118.68 127.61 1rk2 s LEU 19 Ca -0.08 -0.72 -0.27 0.00 -0.22 0.00 0.00 54.13 52.84 1rk2 s LEU 19 Cb -0.15 -1.18 -0.05 0.00 0.50 0.00 0.00 46.19 45.31 1rk2 s LEU 19 CO 0.04 -0.12 0.87 0.20 -1.32 0.00 0.00 176.35 176.02 1rk2 s ASN 20 N 1.45 7.30 0.24 3.68 -0.87 -0.57 -1.63 114.94 124.54 1rk2 s ASN 20 Ca 0.01 1.56 0.02 0.00 -1.57 0.00 0.00 52.86 52.88 1rk2 s ASN 20 Cb -0.15 -2.52 -0.05 0.00 -0.02 0.00 0.00 41.25 38.51 1rk2 s ASN 20 CO -0.09 -0.10 0.06 -0.76 -2.57 0.00 0.00 177.10 173.64 1rk2 s LEU 21 N 0.38 1.85 -0.06 0.60 1.02 0.12 -1.50 118.68 121.08 1rk2 s LEU 21 Ca 0.44 -1.31 -0.26 0.00 0.02 0.00 0.00 54.13 53.02 1rk2 s LEU 21 Cb -0.21 -0.06 -0.21 0.00 0.02 0.00 0.00 46.19 45.73 1rk2 s LEU 21 CO 0.26 -0.66 1.03 -0.61 0.02 0.00 0.00 176.35 176.39 1rk2 h GLN 22 N 2.46 -0.04 -3.75 1.70 4.15 -1.88 -0.25 115.11 117.49 1rk2 h GLN 22 Ca -0.38 0.00 -0.20 0.00 0.77 0.00 0.00 58.65 58.84 1rk2 h GLN 22 Cb 1.23 0.01 -0.25 0.00 0.21 0.00 0.00 27.48 28.68 1rk2 h GLN 22 CO 0.62 0.59 -0.68 -1.12 -1.93 0.00 0.00 178.83 176.32 1rk2 s SER 23 N -5.82 0.06 0.35 -0.69 0.01 -1.26 -2.06 113.70 104.30 1rk2 s SER 23 Ca -0.16 -0.14 -0.26 0.00 1.31 0.00 0.00 55.95 56.69 1rk2 s SER 23 Cb -0.00 0.08 -0.12 0.00 0.21 0.00 0.00 66.02 66.19 1rk2 s SER 23 CO 0.64 -0.13 1.04 0.49 0.41 0.00 0.00 173.24 175.68 1rk2 n PHE 24 N 2.46 1.34 -2.24 2.43 3.72 -1.26 -4.88 117.46 119.03 1rk2 n PHE 24 Ca -0.17 0.62 -0.40 0.00 -0.05 0.00 0.00 57.45 57.45 1rk2 n PHE 24 Cb 0.58 -2.26 -0.03 0.00 -0.94 0.00 0.00 39.48 36.83 1rk2 n PHE 24 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 1rk2 s PRO 25 N -1.78 4.38 0.43 -1.08 0.04 -1.26 -5.00 135.00 130.72 1rk2 s PRO 25 Ca 0.60 2.05 -0.09 0.00 0.04 0.00 0.00 61.00 63.60 1rk2 s PRO 25 Cb -0.62 -3.04 -0.05 0.00 0.04 0.00 0.00 34.50 30.83 1rk2 s PRO 25 CO 0.59 -0.11 0.78 0.95 0.04 0.00 0.00 177.00 179.25 1rk2 s THR 26 N -1.19 4.83 0.23 1.26 -4.23 -1.26 -4.95 115.64 110.33 1rk2 s THR 26 Ca 0.49 0.49 -0.29 0.00 -1.18 0.00 0.00 61.69 61.19 1rk2 s THR 26 Cb -0.36 -3.78 -0.15 0.00 1.34 0.00 0.00 72.50 69.55 1rk2 s THR 26 CO 0.48 -0.63 0.93 -2.65 -0.54 0.00 0.00 174.62 172.20 1rk2 n PRO 27 N -1.62 0.95 0.00 3.99 -0.02 -1.26 -0.70 135.00 136.34 1rk2 n PRO 27 Ca 0.02 0.33 0.00 0.00 -2.02 0.00 0.00 63.50 61.83 1rk2 n PRO 27 Cb 0.54 -1.65 0.00 0.00 -0.02 0.00 0.00 33.50 32.38 1rk2 n PRO 27 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1rk2 n GLY 28 N 1.59 2.52 3.78 -1.23 0.00 -1.26 -4.97 105.19 105.61 1rk2 n GLY 28 Ca 0.13 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.78 1rk2 n GLY 28 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1rk2 s GLU 29 N 0.00 4.53 -0.34 1.61 2.12 0.12 -5.03 118.70 121.71 1rk2 s GLU 29 Ca 0.00 1.37 -0.02 0.00 0.36 0.00 0.00 54.97 56.68 1rk2 s GLU 29 Cb 0.00 -2.78 0.07 0.00 0.26 0.00 0.00 34.13 31.67 1rk2 s GLU 29 CO 0.00 0.22 0.07 0.99 -0.54 0.00 0.00 175.26 176.01 1rk2 s THR 30 N -1.60 3.13 0.07 -1.70 2.01 -1.26 -4.66 115.64 111.64 1rk2 s THR 30 Ca 0.51 -1.60 0.02 0.00 0.31 0.00 0.00 61.69 60.93 1rk2 s THR 30 Cb -0.20 -2.92 -0.04 0.00 0.01 0.00 0.00 72.50 69.35 1rk2 s THR 30 CO 0.25 -0.31 0.12 -0.69 -0.69 0.00 0.00 174.62 173.30 1rk2 s VAL 31 N 1.22 4.80 -0.04 3.82 1.01 -1.26 -5.11 120.40 124.84 1rk2 s VAL 31 Ca -0.00 -0.65 0.00 0.00 0.00 0.00 0.00 61.98 61.33 1rk2 s VAL 31 Cb -0.21 -3.33 -0.03 0.00 0.00 0.00 0.00 36.38 32.82 1rk2 s VAL 31 CO -0.02 0.13 -0.02 -0.89 0.00 0.00 0.00 175.10 174.30 1rk2 s THR 32 N -1.43 4.09 0.40 3.92 2.01 -1.26 -5.07 115.64 118.30 1rk2 s THR 32 Ca 0.31 -0.46 0.05 0.00 0.31 0.00 0.00 61.69 61.90 1rk2 s THR 32 Cb -0.12 -2.76 -0.06 0.00 0.01 0.00 0.00 72.50 69.56 1rk2 s THR 32 CO 0.24 0.50 0.03 -0.83 -0.69 0.00 0.00 174.62 173.87 1rk2 s GLY 33 N -1.16 2.46 0.00 4.40 0.00 -1.26 -4.85 107.32 106.91 1rk2 s GLY 33 Ca 0.16 -1.95 0.00 0.00 0.00 0.00 0.00 44.72 42.92 1rk2 s GLY 33 CO 0.06 -2.03 0.00 1.16 0.00 0.00 0.00 173.10 172.29 1rk2 n ASN 34 N -0.95 0.00 -4.39 1.64 0.23 -0.56 -4.95 115.26 106.28 1rk2 n ASN 34 Ca -0.06 0.00 -0.39 0.00 -0.53 0.00 0.00 54.58 53.60 1rk2 n ASN 34 Cb 0.67 0.00 0.03 0.00 -2.08 0.00 0.00 39.78 38.39 1rk2 n ASN 34 CO 0.00 0.00 0.00 1.57 -0.93 0.00 0.00 177.26 177.90 1rk2 n HIS 35 N 0.00 -1.50 -3.66 -2.53 -0.00 -1.26 -4.69 115.22 101.58 1rk2 n HIS 35 Ca 0.00 0.45 -0.21 0.00 -0.00 0.00 0.00 57.72 57.96 1rk2 n HIS 35 Cb 0.00 -1.86 -0.18 0.00 -0.00 0.00 0.00 29.99 27.96 1rk2 n HIS 35 CO 0.00 0.00 0.00 -0.47 -0.00 0.00 0.00 176.34 175.87 1rk2 s TYR 36 N -1.82 0.11 0.06 1.57 5.04 -1.26 -1.51 117.35 119.54 1rk2 s TYR 36 Ca 0.64 0.14 0.07 0.00 -2.44 0.00 0.00 57.07 55.48 1rk2 s TYR 36 Cb -0.47 -0.53 -0.03 0.00 0.35 0.00 0.00 41.96 41.28 1rk2 s TYR 36 CO 0.59 -0.25 -0.20 -1.14 -1.34 0.00 0.00 175.55 173.20 1rk2 s GLN 37 N 2.15 1.31 -0.33 4.97 0.74 0.19 -4.98 119.66 123.72 1rk2 s GLN 37 Ca 0.04 -0.98 0.03 0.00 0.05 0.00 0.00 55.36 54.50 1rk2 s GLN 37 Cb -0.13 -1.46 0.10 0.00 1.10 0.00 0.00 33.01 32.63 1rk2 s GLN 37 CO -0.04 0.36 0.06 0.08 -0.55 0.00 0.00 175.29 175.21 1rk2 s VAL 38 N -0.88 1.91 0.36 1.34 1.01 -1.26 0.55 120.40 123.44 1rk2 s VAL 38 Ca 0.07 -2.10 0.03 0.00 0.00 0.00 0.00 61.98 59.98 1rk2 s VAL 38 Cb -0.09 -2.42 -0.04 0.00 0.00 0.00 0.00 36.38 33.83 1rk2 s VAL 38 CO 0.02 -0.62 0.11 0.00 0.00 0.00 0.00 175.10 174.61 1rk2 s ALA 39 N 1.09 2.59 0.13 5.51 0.00 -0.59 -4.94 121.76 125.53 1rk2 s ALA 39 Ca 0.11 -1.55 -0.30 0.00 0.00 0.00 0.00 51.96 50.21 1rk2 s ALA 39 Cb -0.19 0.79 -0.07 0.00 0.00 0.00 0.00 23.12 23.66 1rk2 s ALA 39 CO -0.13 -0.36 1.13 -0.06 0.00 0.00 0.00 175.76 176.34 1rk2 s PHE 40 N -3.32 3.54 0.00 0.00 0.08 -1.26 0.95 117.98 117.97 1rk2 s PHE 40 Ca 0.29 1.50 0.00 0.00 0.12 0.00 0.00 56.93 58.85 1rk2 s PHE 40 Cb 0.05 -3.32 0.00 0.00 -0.57 0.00 0.00 43.02 39.18 1rk2 s PHE 40 CO 0.15 -0.80 0.00 0.41 -0.10 0.00 0.00 175.22 174.88 1rk2 n GLY 41 N 2.50 5.45 0.01 4.36 0.00 0.11 -2.81 105.19 114.81 1rk2 n GLY 41 Ca 0.05 -1.42 0.00 0.00 0.00 0.00 0.00 46.02 44.65 1rk2 n GLY 41 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rk2 n GLY 42 N 0.53 1.30 0.35 -0.02 0.00 -1.26 -1.54 105.19 104.55 1rk2 n GLY 42 Ca 0.00 -1.21 0.11 0.00 0.00 0.00 0.00 46.02 44.91 1rk2 n GLY 42 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1rk2 h LYS 43 N 0.00 0.80 0.08 1.61 1.57 -1.98 0.35 116.57 119.00 1rk2 h LYS 43 Ca 0.00 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1rk2 h LYS 43 Cb 0.00 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.13 1rk2 h LYS 43 CO 0.00 0.53 -0.04 0.78 -0.57 0.00 0.00 179.45 180.15 1rk2 h GLY 44 N 0.82 -0.12 1.09 3.86 0.00 -1.83 -0.92 103.07 105.97 1rk2 h GLY 44 Ca 0.55 0.04 -0.12 0.00 0.00 0.00 0.00 47.33 47.81 1rk2 h GLY 44 CO -0.35 -0.04 -0.12 0.00 0.00 0.00 0.00 176.54 176.03 1rk2 h ALA 45 N 0.74 0.72 -0.40 3.60 0.00 0.02 -1.12 119.26 122.83 1rk2 h ALA 45 Ca -0.01 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 54.54 1rk2 h ALA 45 Cb 0.14 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1rk2 h ALA 45 CO 0.02 0.65 0.24 -0.91 0.00 0.00 0.00 179.25 179.25 1rk2 h ASN 46 N 0.88 0.48 0.05 0.00 2.35 -0.26 -0.33 115.58 118.75 1rk2 h ASN 46 Ca 0.13 -0.05 -0.09 0.00 -0.55 0.00 0.00 56.30 55.74 1rk2 h ASN 46 Cb 0.69 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.93 1rk2 h ASN 46 CO 0.05 0.39 -0.29 1.56 -1.65 0.00 0.00 177.43 177.49 1rk2 h GLN 47 N 0.53 0.37 -0.48 0.81 4.20 -1.03 -1.15 115.11 118.36 1rk2 h GLN 47 Ca 0.14 -0.14 -0.13 0.00 0.06 0.00 0.00 58.65 58.58 1rk2 h GLN 47 Cb -0.00 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.75 1rk2 h GLN 47 CO -0.03 0.63 -0.21 0.00 -0.67 0.00 0.00 178.83 178.55 1rk2 h ALA 48 N 1.37 0.70 -0.50 3.87 0.00 -0.82 -1.51 119.26 122.37 1rk2 h ALA 48 Ca 0.04 -0.39 -0.11 0.00 0.00 0.00 0.00 54.91 54.45 1rk2 h ALA 48 Cb 0.69 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 1rk2 h ALA 48 CO 0.05 0.67 -0.12 0.28 0.00 0.00 0.00 179.25 180.13 1rk2 h VAL 49 N 0.86 1.27 -0.80 0.00 2.07 -0.84 0.12 116.25 118.93 1rk2 h VAL 49 Ca 0.11 -1.27 -0.04 0.00 0.82 0.00 0.00 66.70 66.32 1rk2 h VAL 49 Cb 0.79 1.05 -0.04 0.00 -1.52 0.00 0.00 31.29 31.58 1rk2 h VAL 49 CO 0.07 0.44 0.35 0.00 0.02 0.00 0.00 177.57 178.44 1rk2 h ALA 50 N 0.90 1.11 0.21 1.67 0.00 -1.07 0.20 119.26 122.27 1rk2 h ALA 50 Ca 0.13 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 1rk2 h ALA 50 Cb 0.69 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1rk2 h ALA 50 CO 0.05 0.65 -0.10 0.00 0.00 0.00 0.00 179.25 179.85 1rk2 h ALA 51 N 1.23 -0.28 0.16 0.00 0.00 -1.03 -1.63 119.26 117.71 1rk2 h ALA 51 Ca 0.27 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 55.02 1rk2 h ALA 51 Cb 0.17 0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 1rk2 h ALA 51 CO -0.03 -0.50 -0.28 0.78 0.00 0.00 0.00 179.25 179.22 1rk2 h GLY 52 N -0.59 -0.56 1.98 0.00 0.00 -0.50 -1.37 103.07 102.03 1rk2 h GLY 52 Ca -0.03 0.33 -0.04 0.00 0.00 0.00 0.00 47.33 47.60 1rk2 h GLY 52 CO 0.05 -0.24 -0.17 3.21 0.00 0.00 0.00 176.54 179.39 1rk2 h ARG 53 N -0.53 0.02 -0.00 4.80 3.08 -0.63 -1.94 114.38 119.18 1rk2 h ARG 53 Ca 0.02 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.07 1rk2 h ARG 53 Cb 0.53 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.58 1rk2 h ARG 53 CO -0.14 0.19 -0.00 -1.13 -1.07 0.00 0.00 179.97 177.82 1rk2 n SER 54 N -4.32 0.03 0.00 7.04 3.41 -0.62 -0.60 113.62 118.57 1rk2 n SER 54 Ca -0.02 -0.50 0.00 0.00 -0.26 0.00 0.00 58.87 58.09 1rk2 n SER 54 Cb 0.24 -0.17 0.00 0.00 -0.26 0.00 0.00 64.21 64.03 1rk2 n SER 54 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1rk2 n GLY 55 N 1.18 1.27 3.88 5.00 0.00 -0.73 -4.58 105.19 111.20 1rk2 n GLY 55 Ca 0.18 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.90 1rk2 n GLY 55 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rk2 s ALA 56 N -2.00 3.19 -0.75 4.61 0.00 -0.55 -5.00 121.76 121.25 1rk2 s ALA 56 Ca 0.00 -0.18 -0.16 0.00 0.00 0.00 0.00 51.96 51.62 1rk2 s ALA 56 Cb 0.00 -2.93 0.16 0.00 0.00 0.00 0.00 23.12 20.35 1rk2 s ALA 56 CO 0.00 -0.52 0.78 -0.80 0.00 0.00 0.00 175.76 175.22 1rk2 s ASN 57 N -4.00 6.52 0.02 0.00 0.01 -1.26 -4.65 114.94 111.58 1rk2 s ASN 57 Ca 0.53 -2.14 0.07 0.00 -0.71 0.00 0.00 52.86 50.60 1rk2 s ASN 57 Cb -0.11 -2.27 -0.02 0.00 0.41 0.00 0.00 41.25 39.26 1rk2 s ASN 57 CO 0.48 -0.84 -0.20 -0.51 -1.51 0.00 0.00 177.10 174.52 1rk2 s ILE 58 N 1.44 1.62 0.06 0.60 -1.16 -1.26 0.03 121.20 122.54 1rk2 s ILE 58 Ca 0.17 -1.06 0.09 0.00 -0.51 0.00 0.00 60.65 59.34 1rk2 s ILE 58 Cb -0.15 -1.39 -0.03 0.00 0.61 0.00 0.00 42.46 41.50 1rk2 s ILE 58 CO -0.04 0.30 -0.24 0.00 -2.81 0.00 0.00 174.94 172.15 1rk2 s ALA 59 N -0.67 2.38 -0.17 1.50 0.00 -0.13 -1.29 121.76 123.37 1rk2 s ALA 59 Ca 0.07 -1.27 0.01 0.00 0.00 0.00 0.00 51.96 50.77 1rk2 s ALA 59 Cb -0.08 -0.55 0.02 0.00 0.00 0.00 0.00 23.12 22.51 1rk2 s ALA 59 CO 0.01 0.55 -0.19 0.12 0.00 0.00 0.00 175.76 176.24 1rk2 s PHE 60 N -0.88 2.68 -0.33 0.00 5.36 -0.64 -1.10 117.98 123.06 1rk2 s PHE 60 Ca 0.13 -1.55 -0.15 0.00 -0.96 0.00 0.00 56.93 54.39 1rk2 s PHE 60 Cb -0.10 -1.86 -0.01 0.00 -0.34 0.00 0.00 43.02 40.70 1rk2 s PHE 60 CO 0.04 -0.77 0.37 0.42 -1.46 0.00 0.00 175.22 173.82 1rk2 s ILE 61 N 1.26 5.16 0.32 3.12 1.01 0.46 -3.04 121.20 129.49 1rk2 s ILE 61 Ca 0.04 0.12 -0.18 0.00 0.00 0.00 0.00 60.65 60.63 1rk2 s ILE 61 Cb -0.13 -3.82 0.06 0.00 0.01 0.00 0.00 42.46 38.58 1rk2 s ILE 61 CO -0.11 -0.07 0.86 0.00 0.00 0.00 0.00 174.94 175.61 1rk2 s ALA 62 N 2.05 -1.04 -0.02 9.38 0.00 -1.17 -2.26 121.76 128.71 1rk2 s ALA 62 Ca 0.13 -0.58 0.01 0.00 0.00 0.00 0.00 51.96 51.52 1rk2 s ALA 62 Cb -0.16 0.71 0.01 0.00 0.00 0.00 0.00 23.12 23.67 1rk2 s ALA 62 CO 0.12 -1.01 -0.04 0.00 0.00 0.00 0.00 175.76 174.82 1rk2 s THR 64 N 0.38 1.97 0.78 0.00 -4.23 -0.17 -4.29 115.64 110.07 1rk2 s THR 64 Ca -0.04 -2.00 -0.05 0.00 -1.18 0.00 0.00 61.69 58.41 1rk2 s THR 64 Cb -0.08 -2.98 0.14 0.00 1.34 0.00 0.00 72.50 70.92 1rk2 s THR 64 CO -0.00 0.00 1.08 -0.83 -0.54 0.00 0.00 174.62 174.33 1rk2 s GLY 65 N -3.71 1.76 -0.25 3.99 0.00 -1.26 -0.78 107.32 107.07 1rk2 s GLY 65 Ca 0.35 -1.51 0.01 0.00 0.00 0.00 0.00 44.72 43.57 1rk2 s GLY 65 CO 0.18 -0.90 1.59 2.09 0.00 0.00 0.00 173.10 176.06 1rk2 n ASP 66 N -3.09 4.11 -4.94 1.64 5.68 -0.58 -4.50 116.55 114.86 1rk2 n ASP 66 Ca 0.14 -2.88 -0.20 0.00 -0.50 0.00 0.00 54.79 51.36 1rk2 n ASP 66 Cb 0.60 -0.76 0.06 0.00 -1.14 0.00 0.00 41.12 39.88 1rk2 n ASP 66 CO 0.00 0.00 0.00 1.51 -1.33 0.00 0.00 177.20 177.38 1rk2 s ASP 67 N -0.10 5.10 0.22 -1.12 1.47 -1.26 -4.98 116.67 116.00 1rk2 s ASP 67 Ca 0.30 -0.50 -0.04 0.00 1.18 0.00 0.00 52.55 53.48 1rk2 s ASP 67 Cb 0.24 -0.19 0.20 0.00 -0.34 0.00 0.00 42.92 42.83 1rk2 s ASP 67 CO 0.04 -1.28 1.64 -1.28 0.68 0.00 0.00 175.17 174.97 1rk2 h SER 68 N 0.12 0.78 -0.56 2.11 0.87 -2.00 -2.66 113.55 112.20 1rk2 h SER 68 Ca -0.36 -0.27 -0.04 0.00 -1.23 0.00 0.00 61.79 59.90 1rk2 h SER 68 Cb 1.28 -0.21 -0.03 0.00 -0.44 0.00 0.00 62.40 63.00 1rk2 h SER 68 CO 0.43 0.97 0.23 -0.29 -0.53 0.00 0.00 176.83 177.64 1rk2 h ILE 69 N 0.67 1.22 -0.68 2.23 6.09 -1.95 -1.11 117.51 123.98 1rk2 h ILE 69 Ca 0.10 -0.69 -0.02 0.00 -1.37 0.00 0.00 64.86 62.87 1rk2 h ILE 69 Cb 0.71 0.52 -0.03 0.00 0.47 0.00 0.00 36.82 38.49 1rk2 h ILE 69 CO 0.05 0.27 0.33 1.23 -3.07 0.00 0.00 178.15 176.96 1rk2 h GLY 70 N 0.98 1.04 1.45 8.18 0.00 -1.73 0.11 103.07 113.10 1rk2 h GLY 70 Ca 0.20 -0.52 -0.13 0.00 0.00 0.00 0.00 47.33 46.89 1rk2 h GLY 70 CO -0.02 0.49 -0.35 -2.09 0.00 0.00 0.00 176.54 174.58 1rk2 h GLU 71 N 0.94 0.61 -0.41 4.80 4.81 -1.18 -2.33 114.58 121.83 1rk2 h GLU 71 Ca 0.23 -0.29 -0.03 0.00 -0.13 0.00 0.00 59.36 59.15 1rk2 h GLU 71 Cb 0.12 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.47 1rk2 h GLU 71 CO -0.03 0.87 0.15 1.03 -0.73 0.00 0.00 179.01 180.30 1rk2 h SER 72 N 0.52 0.58 -0.29 1.04 0.87 -0.65 -2.22 113.55 113.40 1rk2 h SER 72 Ca 0.05 -0.19 -0.13 0.00 -1.23 0.00 0.00 61.79 60.30 1rk2 h SER 72 Cb 0.84 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 62.64 1rk2 h SER 72 CO 0.07 0.61 -0.29 1.62 -0.53 0.00 0.00 176.83 178.31 1rk2 h VAL 73 N 0.52 1.28 -0.62 2.23 3.04 -0.70 -2.36 116.25 119.64 1rk2 h VAL 73 Ca 0.13 -1.43 -0.04 0.00 -1.01 0.00 0.00 66.70 64.35 1rk2 h VAL 73 Cb 0.22 1.29 -0.03 0.00 -2.01 0.00 0.00 31.29 30.77 1rk2 h VAL 73 CO -0.01 0.48 0.21 0.03 -1.01 0.00 0.00 177.57 177.27 1rk2 h ARG 74 N 0.68 0.93 -0.34 4.17 3.08 -1.33 0.22 114.38 121.80 1rk2 h ARG 74 Ca 0.08 -0.17 -0.09 0.00 0.07 0.00 0.00 59.98 59.87 1rk2 h ARG 74 Cb 0.82 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.71 1rk2 h ARG 74 CO 0.07 0.79 -0.13 1.96 -1.07 0.00 0.00 179.97 181.60 1rk2 h GLN 75 N 0.91 0.68 0.31 0.04 4.20 -1.24 -2.83 115.11 117.19 1rk2 h GLN 75 Ca 0.21 -0.28 -0.01 0.00 0.06 0.00 0.00 58.65 58.62 1rk2 h GLN 75 Cb 0.23 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 27.99 1rk2 h GLN 75 CO -0.01 0.87 -0.15 0.37 -0.67 0.00 0.00 178.83 179.24 1rk2 h GLN 76 N 0.46 -0.41 -0.93 1.46 5.75 -1.06 -2.83 115.11 117.55 1rk2 h GLN 76 Ca 0.08 0.03 0.21 0.00 -0.15 0.00 0.00 58.65 58.82 1rk2 h GLN 76 Cb 0.65 0.09 -0.07 0.00 1.07 0.00 0.00 27.48 29.22 1rk2 h GLN 76 CO 0.04 -0.27 0.61 -0.07 -2.65 0.00 0.00 178.83 176.49 1rk2 h LEU 77 N -0.43 0.46 -1.80 -2.39 3.38 -0.95 0.32 115.31 113.90 1rk2 h LEU 77 Ca -0.04 0.05 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 1rk2 h LEU 77 Cb 0.33 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.05 1rk2 h LEU 77 CO 0.07 0.17 -0.15 0.00 0.09 0.00 0.00 178.44 178.62 1rk2 h ALA 78 N 1.61 1.43 -0.03 1.53 0.00 -1.24 -1.06 119.26 121.50 1rk2 h ALA 78 Ca 0.50 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.27 1rk2 h ALA 78 Cb 1.18 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1rk2 h ALA 78 CO -0.21 0.19 0.00 0.25 0.00 0.00 0.00 179.25 179.48 1rk2 n THR 79 N -3.90 0.03 -1.10 0.00 -2.24 0.11 -3.75 114.28 103.44 1rk2 n THR 79 Ca -0.02 -0.21 -0.08 0.00 -2.27 0.00 0.00 64.05 61.47 1rk2 n THR 79 Cb 0.25 0.29 0.28 0.00 -2.10 0.00 0.00 70.33 69.05 1rk2 n THR 79 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1rk2 n ASP 80 N -0.03 4.53 -3.56 3.42 8.00 -0.40 -4.91 116.55 123.61 1rk2 n ASP 80 Ca 0.19 -3.30 -0.22 0.00 0.71 0.00 0.00 54.79 52.17 1rk2 n ASP 80 Cb 0.30 -0.75 0.08 0.00 -0.02 0.00 0.00 41.12 40.74 1rk2 n ASP 80 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1rk2 n ASN 81 N -0.36 -4.77 -4.15 -2.24 3.02 -1.25 -3.44 115.26 102.08 1rk2 n ASN 81 Ca 0.43 -0.58 -0.29 0.00 -0.03 0.00 0.00 54.58 54.10 1rk2 n ASN 81 Cb 1.39 -5.01 -0.17 0.00 -0.61 0.00 0.00 39.78 35.39 1rk2 n ASN 81 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1rk2 s ILE 82 N -3.34 1.74 -0.39 2.41 1.01 -1.24 -4.52 121.20 116.87 1rk2 s ILE 82 Ca 0.38 -0.82 -0.29 0.00 0.00 0.00 0.00 60.65 59.92 1rk2 s ILE 82 Cb -0.17 -1.52 0.02 0.00 0.01 0.00 0.00 42.46 40.79 1rk2 s ILE 82 CO 0.74 0.49 1.17 -0.62 0.00 0.00 0.00 174.94 176.71 1rk2 s ASP 83 N 0.51 6.72 -0.02 3.58 -1.08 -0.41 -4.45 116.67 121.52 1rk2 s ASP 83 Ca -0.16 0.82 0.20 0.00 -0.52 0.00 0.00 52.55 52.89 1rk2 s ASP 83 Cb -0.17 -2.55 0.61 0.00 -1.46 0.00 0.00 42.92 39.35 1rk2 s ASP 83 CO 0.06 -1.11 1.51 2.30 0.52 0.00 0.00 175.17 178.45 1rk2 n ILE 84 N 6.42 1.03 -0.33 4.11 -5.35 -1.26 -1.62 119.36 122.36 1rk2 n ILE 84 Ca 0.13 -0.93 0.11 0.00 -0.27 0.00 0.00 62.75 61.79 1rk2 n ILE 84 Cb 0.48 0.39 0.29 0.00 -1.74 0.00 0.00 39.64 39.06 1rk2 n ILE 84 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 1rk2 h THR 85 N 3.91 0.67 0.00 7.28 2.02 -1.89 0.40 112.91 125.31 1rk2 h THR 85 Ca 0.00 -0.23 0.00 0.00 0.77 0.00 0.00 66.41 66.95 1rk2 h THR 85 Cb 0.98 -0.05 0.00 0.00 -1.74 0.00 0.00 68.15 67.34 1rk2 h THR 85 CO 0.04 0.12 0.00 -2.65 0.37 0.00 0.00 175.52 173.40 1rk2 n PRO 86 N -4.84 0.80 -2.94 6.66 -0.02 -1.25 -4.74 135.00 128.66 1rk2 n PRO 86 Ca 0.21 0.00 -0.42 0.00 -2.02 0.00 0.00 63.50 61.27 1rk2 n PRO 86 Cb 0.55 -1.38 -0.05 0.00 -0.02 0.00 0.00 33.50 32.60 1rk2 n PRO 86 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1rk2 s VAL 87 N -2.00 4.70 0.26 -1.45 1.01 0.13 -3.02 120.40 120.03 1rk2 s VAL 87 Ca 0.29 0.80 -0.11 0.00 0.00 0.00 0.00 61.98 62.96 1rk2 s VAL 87 Cb 0.13 -4.25 -0.08 0.00 0.00 0.00 0.00 36.38 32.19 1rk2 s VAL 87 CO 0.22 -0.51 0.61 -0.44 0.00 0.00 0.00 175.10 174.98 1rk2 s SER 88 N 1.92 6.67 -0.29 3.32 0.01 0.11 -4.94 113.70 120.51 1rk2 s SER 88 Ca 0.32 1.04 -0.07 0.00 1.31 0.00 0.00 55.95 58.55 1rk2 s SER 88 Cb -0.13 -2.28 0.00 0.00 0.21 0.00 0.00 66.02 63.83 1rk2 s SER 88 CO 0.19 -0.12 0.08 -0.69 0.41 0.00 0.00 173.24 173.10 1rk2 s VAL 89 N -1.88 4.04 -0.46 3.43 1.01 -1.26 -1.00 120.40 124.28 1rk2 s VAL 89 Ca 0.50 -0.58 -0.21 0.00 0.00 0.00 0.00 61.98 61.68 1rk2 s VAL 89 Cb -0.11 -3.04 0.03 0.00 0.00 0.00 0.00 36.38 33.26 1rk2 s VAL 89 CO 0.20 0.14 0.70 -0.63 0.00 0.00 0.00 175.10 175.50 1rk2 s ILE 90 N 1.53 4.76 0.32 2.22 -1.09 0.04 -4.89 121.20 124.08 1rk2 s ILE 90 Ca 0.04 0.14 -0.29 0.00 -2.23 0.00 0.00 60.65 58.30 1rk2 s ILE 90 Cb -0.17 -4.27 -0.11 0.00 -1.58 0.00 0.00 42.46 36.34 1rk2 s ILE 90 CO 0.03 -0.68 1.50 -0.54 -1.23 0.00 0.00 174.94 174.01 1rk2 s LYS 91 N 2.99 4.16 0.00 2.79 1.02 -1.26 -2.56 119.74 126.88 1rk2 s LYS 91 Ca 0.24 2.50 0.00 0.00 0.02 0.00 0.00 55.97 58.73 1rk2 s LYS 91 Cb -0.14 -3.02 0.00 0.00 -0.52 0.00 0.00 37.83 34.15 1rk2 s LYS 91 CO 0.19 -0.51 0.00 0.41 -0.92 0.00 0.00 175.35 174.52 1rk2 n GLY 92 N 1.32 0.72 3.24 -3.33 0.00 -1.26 -4.95 105.19 100.94 1rk2 n GLY 92 Ca 0.04 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.87 1rk2 n GLY 92 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1rk2 s GLU 93 N -0.09 1.03 0.12 1.61 2.02 -1.06 -5.03 118.70 117.30 1rk2 s GLU 93 Ca 0.00 -1.22 0.03 0.00 0.02 0.00 0.00 54.97 53.80 1rk2 s GLU 93 Cb 0.00 -0.96 -0.04 0.00 0.10 0.00 0.00 34.13 33.23 1rk2 s GLU 93 CO 0.00 0.19 0.18 -1.54 0.02 0.00 0.00 175.26 174.11 1rk2 s SER 94 N -2.36 5.92 0.49 -0.19 1.04 -1.26 -1.53 113.70 115.81 1rk2 s SER 94 Ca 0.08 0.06 -0.23 0.00 0.48 0.00 0.00 55.95 56.34 1rk2 s SER 94 Cb -0.06 -1.69 -0.07 0.00 0.10 0.00 0.00 66.02 64.31 1rk2 s SER 94 CO 0.03 0.11 1.37 -0.89 0.98 0.00 0.00 173.24 174.84 1rk2 s THR 95 N -1.61 2.17 0.67 2.02 2.01 -1.26 -1.11 115.64 118.52 1rk2 s THR 95 Ca 0.32 0.14 -0.17 0.00 0.31 0.00 0.00 61.69 62.29 1rk2 s THR 95 Cb -0.11 -3.07 -0.03 0.00 0.01 0.00 0.00 72.50 69.29 1rk2 s THR 95 CO 0.25 0.01 0.79 0.61 -0.69 0.00 0.00 174.62 175.59 1rk2 n GLY 96 N 0.65 -0.84 3.15 4.40 0.00 -1.22 -4.72 105.19 106.62 1rk2 n GLY 96 Ca 0.08 -0.27 -0.18 0.00 0.00 0.00 0.00 46.02 45.64 1rk2 n GLY 96 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1rk2 s VAL 97 N -1.74 1.07 -0.02 1.61 1.01 -0.81 -1.80 120.40 119.72 1rk2 s VAL 97 Ca 0.72 -1.19 0.02 0.00 0.00 0.00 0.00 61.98 61.52 1rk2 s VAL 97 Cb -0.38 -1.02 0.01 0.00 0.00 0.00 0.00 36.38 34.99 1rk2 s VAL 97 CO 0.52 -0.16 -0.07 0.00 0.00 0.00 0.00 175.10 175.39 1rk2 s ALA 98 N -1.14 0.68 -0.25 5.51 0.00 -1.04 -0.64 121.76 124.89 1rk2 s ALA 98 Ca -0.01 -0.21 -0.06 0.00 0.00 0.00 0.00 51.96 51.67 1rk2 s ALA 98 Cb -0.09 -0.29 -0.02 0.00 0.00 0.00 0.00 23.12 22.72 1rk2 s ALA 98 CO 0.02 0.09 0.03 -0.51 0.00 0.00 0.00 175.76 175.39 1rk2 s LEU 99 N 0.31 3.31 -0.05 0.00 1.43 0.03 -0.97 118.68 122.74 1rk2 s LEU 99 Ca -0.04 -0.33 0.04 0.00 -1.03 0.00 0.00 54.13 52.76 1rk2 s LEU 99 Cb -0.08 -1.86 0.00 0.00 0.03 0.00 0.00 46.19 44.28 1rk2 s LEU 99 CO 0.00 -0.05 -0.16 -0.63 0.23 0.00 0.00 176.35 175.74 1rk2 s ILE 100 N 1.56 1.37 -0.10 -0.59 1.01 0.51 -1.95 121.20 123.01 1rk2 s ILE 100 Ca 0.06 -0.66 -0.02 0.00 0.00 0.00 0.00 60.65 60.03 1rk2 s ILE 100 Cb -0.15 -1.20 -0.03 0.00 0.01 0.00 0.00 42.46 41.09 1rk2 s ILE 100 CO 0.01 0.40 -0.01 -0.36 0.00 0.00 0.00 174.94 174.98 1rk2 s PHE 101 N 0.23 3.10 -0.17 3.97 0.08 -0.96 -0.83 117.98 123.39 1rk2 s PHE 101 Ca -0.08 0.09 -0.01 0.00 0.12 0.00 0.00 56.93 57.05 1rk2 s PHE 101 Cb -0.13 -1.81 0.05 0.00 -0.57 0.00 0.00 43.02 40.56 1rk2 s PHE 101 CO 0.03 0.36 -0.04 0.08 -0.10 0.00 0.00 175.22 175.55 1rk2 s VAL 102 N -0.64 1.02 0.80 -0.44 1.01 -0.65 -1.73 120.40 119.78 1rk2 s VAL 102 Ca 0.10 -0.64 -0.12 0.00 0.00 0.00 0.00 61.98 61.33 1rk2 s VAL 102 Cb -0.12 -1.26 0.08 0.00 0.00 0.00 0.00 36.38 35.09 1rk2 s VAL 102 CO 0.02 0.06 1.17 0.54 0.00 0.00 0.00 175.10 176.89 1rk2 s ASN 103 N 1.66 4.50 0.23 3.32 2.20 -0.53 0.13 114.94 126.45 1rk2 s ASN 103 Ca 0.00 0.74 -0.11 0.00 -0.94 0.00 0.00 52.86 52.55 1rk2 s ASN 103 Cb -0.16 -1.24 0.32 0.00 -2.00 0.00 0.00 41.25 38.18 1rk2 s ASN 103 CO -0.07 -1.90 1.62 1.23 -2.94 0.00 0.00 177.10 175.04 1rk2 h GLY 104 N -1.03 0.61 1.62 0.45 0.00 -0.44 0.18 103.07 104.46 1rk2 h GLY 104 Ca -0.46 0.19 0.00 0.00 0.00 0.00 0.00 47.33 47.06 1rk2 h GLY 104 CO 0.65 -0.27 0.00 1.18 0.00 0.00 0.00 176.54 178.10 1rk2 n GLU 105 N -5.42 0.11 -0.17 4.80 1.02 -1.26 -4.83 120.64 114.89 1rk2 n GLU 105 Ca 0.10 0.22 0.00 0.00 -0.02 0.00 0.00 57.16 57.46 1rk2 n GLU 105 Cb 0.39 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.31 1rk2 n GLU 105 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1rk2 n GLY 106 N -0.53 0.60 3.80 0.62 0.00 0.64 -4.70 105.19 105.61 1rk2 n GLY 106 Ca 0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.75 1rk2 n GLY 106 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1rk2 s GLU 107 N -0.80 2.61 -0.00 1.61 2.02 -1.26 -2.19 118.70 120.68 1rk2 s GLU 107 Ca 0.00 1.01 -0.13 0.00 0.02 0.00 0.00 54.97 55.87 1rk2 s GLU 107 Cb 0.00 -1.95 0.02 0.00 0.10 0.00 0.00 34.13 32.30 1rk2 s GLU 107 CO 0.00 -1.35 0.27 0.54 0.02 0.00 0.00 175.26 174.74 1rk2 s ASN 108 N -3.65 -0.13 -0.03 -0.19 4.22 -1.26 -1.45 114.94 112.45 1rk2 s ASN 108 Ca 0.59 -0.02 0.06 0.00 -2.14 0.00 0.00 52.86 51.35 1rk2 s ASN 108 Cb -0.15 0.29 -0.02 0.00 1.28 0.00 0.00 41.25 42.65 1rk2 s ASN 108 CO 0.55 -0.45 -0.19 0.68 -2.04 0.00 0.00 177.10 175.65 1rk2 s VAL 109 N -1.51 2.63 -0.03 3.54 -7.23 -0.71 -4.99 120.40 112.11 1rk2 s VAL 109 Ca -0.13 -0.94 0.01 0.00 -1.81 0.00 0.00 61.98 59.12 1rk2 s VAL 109 Cb -0.05 -2.00 0.01 0.00 0.56 0.00 0.00 36.38 34.90 1rk2 s VAL 109 CO 0.03 0.55 -0.05 -0.63 -0.31 0.00 0.00 175.10 174.69 1rk2 s ILE 110 N -0.71 0.50 -0.10 -0.62 1.01 -1.26 -2.28 121.20 117.75 1rk2 s ILE 110 Ca 0.11 -0.16 0.01 0.00 0.00 0.00 0.00 60.65 60.62 1rk2 s ILE 110 Cb -0.10 -0.50 0.02 0.00 0.01 0.00 0.00 42.46 41.88 1rk2 s ILE 110 CO 0.01 0.19 -0.13 -0.83 0.00 0.00 0.00 174.94 174.18 1rk2 s GLY 111 N 0.57 0.93 0.24 6.18 0.00 -0.82 -4.98 107.32 109.43 1rk2 s GLY 111 Ca -0.07 -0.61 0.11 0.00 0.00 0.00 0.00 44.72 44.15 1rk2 s GLY 111 CO -0.00 0.30 -0.17 -0.26 0.00 0.00 0.00 173.10 172.97 1rk2 s ILE 112 N 1.02 2.68 -0.19 0.90 -4.36 -1.26 -0.79 121.20 119.19 1rk2 s ILE 112 Ca -0.07 -2.12 -0.01 0.00 -0.26 0.00 0.00 60.65 58.19 1rk2 s ILE 112 Cb -0.15 -2.36 0.01 0.00 1.25 0.00 0.00 42.46 41.21 1rk2 s ILE 112 CO -0.01 -0.27 -0.13 -2.28 0.24 0.00 0.00 174.94 172.48 1rk2 s HIS 113 N -2.12 2.85 0.10 1.37 5.65 0.19 -5.01 115.29 118.32 1rk2 s HIS 113 Ca 0.27 -1.31 -0.21 0.00 0.25 0.00 0.00 55.06 54.07 1rk2 s HIS 113 Cb -0.07 -1.99 -0.09 0.00 -1.18 0.00 0.00 32.58 29.25 1rk2 s HIS 113 CO 0.14 -0.67 1.71 0.00 -0.65 0.00 0.00 174.74 175.28 1rk2 h ALA 114 N 7.93 0.20 -0.79 1.58 0.00 -1.97 -2.15 119.26 124.07 1rk2 h ALA 114 Ca -0.43 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1rk2 h ALA 114 Cb 1.15 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1rk2 h ALA 114 CO 0.62 -0.28 0.00 0.41 0.00 0.00 0.00 179.25 180.00 1rk2 n GLY 115 N -0.97 2.73 0.34 0.00 0.00 -1.26 -1.85 105.19 104.18 1rk2 n GLY 115 Ca -0.04 -0.31 0.21 0.00 0.00 0.00 0.00 46.02 45.88 1rk2 n GLY 115 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rk2 h ALA 116 N -0.79 1.09 0.00 4.61 0.00 -1.40 -1.93 119.26 120.84 1rk2 h ALA 116 Ca 0.00 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 1rk2 h ALA 116 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 1rk2 h ALA 116 CO 0.00 -0.07 -0.08 -0.91 0.00 0.00 0.00 179.25 178.19 1rk2 h ASN 117 N 0.00 0.00 0.82 0.00 2.35 -1.55 0.11 115.58 117.31 1rk2 h ASN 117 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1rk2 h ASN 117 Cb 0.13 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.50 1rk2 h ASN 117 CO -0.00 0.08 0.00 0.00 -1.65 0.00 0.00 177.43 175.86 1rk2 h ALA 118 N 1.92 1.00 -0.01 -0.83 0.00 -1.49 -2.90 119.26 116.95 1rk2 h ALA 118 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1rk2 h ALA 118 Cb 0.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1rk2 h ALA 118 CO 0.01 0.00 -0.17 0.00 0.00 0.00 0.00 179.25 179.09 1rk2 n ALA 119 N -1.81 2.90 -2.37 0.00 0.00 0.02 -4.66 120.51 114.58 1rk2 n ALA 119 Ca 0.02 -0.36 -0.36 0.00 0.00 0.00 0.00 53.44 52.74 1rk2 n ALA 119 Cb 0.25 -1.21 -0.04 0.00 0.00 0.00 0.00 19.45 18.45 1rk2 n ALA 119 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1rk2 s LEU 120 N -2.41 3.36 0.51 0.00 0.20 -1.09 -4.91 118.68 114.34 1rk2 s LEU 120 Ca 0.28 -1.08 0.04 0.00 0.69 0.00 0.00 54.13 54.06 1rk2 s LEU 120 Cb 0.20 -2.56 0.03 0.00 -0.43 0.00 0.00 46.19 43.42 1rk2 s LEU 120 CO 0.48 -1.97 0.71 -0.94 -0.29 0.00 0.00 176.35 174.34 1rk2 s SER 121 N 6.05 5.37 0.43 3.68 1.04 -1.26 -4.43 113.70 124.57 1rk2 s SER 121 Ca 0.54 -0.19 0.11 0.00 0.48 0.00 0.00 55.95 56.89 1rk2 s SER 121 Cb -0.03 -0.73 0.96 0.00 0.10 0.00 0.00 66.02 66.33 1rk2 s SER 121 CO -0.05 -1.05 2.02 -0.65 0.98 0.00 0.00 173.24 174.49 1rk2 h PRO 122 N 0.25 0.45 -0.31 4.02 0.11 -1.90 -0.73 132.00 133.88 1rk2 h PRO 122 Ca -0.41 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 65.66 1rk2 h PRO 122 Cb 1.29 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 1rk2 h PRO 122 CO 0.49 0.30 0.13 0.00 -0.21 0.00 0.00 178.00 178.71 1rk2 h ALA 123 N 1.72 0.40 -0.13 -0.75 0.00 -1.96 0.31 119.26 118.85 1rk2 h ALA 123 Ca 0.22 -0.12 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 1rk2 h ALA 123 Cb 0.29 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1rk2 h ALA 123 CO -0.06 -0.00 -0.17 -0.07 0.00 0.00 0.00 179.25 178.94 1rk2 h LEU 124 N 0.36 0.20 -0.18 0.00 3.38 -1.59 -1.76 115.31 115.71 1rk2 h LEU 124 Ca 0.10 -0.05 -0.05 0.00 0.09 0.00 0.00 57.88 57.98 1rk2 h LEU 124 Cb 0.17 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 40.86 1rk2 h LEU 124 CO -0.01 0.39 -0.07 0.58 0.09 0.00 0.00 178.44 179.42 1rk2 h VAL 125 N 0.20 1.30 -0.58 1.22 2.07 -0.43 -2.95 116.25 117.08 1rk2 h VAL 125 Ca 0.04 -1.10 0.06 0.00 0.82 0.00 0.00 66.70 66.51 1rk2 h VAL 125 Cb 0.43 1.66 -0.03 0.00 -1.52 0.00 0.00 31.29 31.82 1rk2 h VAL 125 CO 0.03 0.33 0.39 -0.33 0.02 0.00 0.00 177.57 178.00 1rk2 h GLU 126 N 0.06 0.54 0.00 1.57 4.39 0.02 0.22 114.58 121.37 1rk2 h GLU 126 Ca 0.04 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.71 1rk2 h GLU 126 Cb 0.54 -0.12 0.00 0.00 -0.10 0.00 0.00 28.75 29.07 1rk2 h GLU 126 CO 0.02 0.36 0.00 0.00 -1.16 0.00 0.00 179.01 178.23 1rk2 h ALA 127 N 1.68 1.00 -0.53 3.43 0.00 -1.16 -1.79 119.26 121.90 1rk2 h ALA 127 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1rk2 h ALA 127 Cb 0.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1rk2 h ALA 127 CO -0.07 0.00 0.00 1.04 0.00 0.00 0.00 179.25 180.22 1rk2 n GLN 128 N -2.86 3.39 -0.21 0.00 1.13 0.75 -4.72 117.38 114.87 1rk2 n GLN 128 Ca -0.00 -2.71 -0.03 0.00 -1.94 0.00 0.00 57.00 52.32 1rk2 n GLN 128 Cb 0.19 -1.74 0.04 0.00 0.11 0.00 0.00 30.24 28.84 1rk2 n GLN 128 CO 0.00 0.00 0.00 -0.09 -1.44 0.00 0.00 177.06 175.53 1rk2 h ARG 129 N 3.31 -0.08 -0.38 -1.09 2.43 -1.14 -0.87 114.38 116.55 1rk2 h ARG 129 Ca 0.00 0.01 -0.09 0.00 -0.81 0.00 0.00 59.98 59.09 1rk2 h ARG 129 Cb 1.29 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.84 1rk2 h ARG 129 CO 0.17 -0.06 -0.13 1.49 -1.51 0.00 0.00 179.97 179.94 1rk2 h GLU 130 N -0.09 0.69 -0.46 0.20 4.81 -1.85 0.35 114.58 118.24 1rk2 h GLU 130 Ca 0.27 -0.22 -0.04 0.00 -0.13 0.00 0.00 59.36 59.24 1rk2 h GLU 130 Cb 0.52 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.82 1rk2 h GLU 130 CO -0.67 0.79 0.14 -0.09 -0.73 0.00 0.00 179.01 178.45 1rk2 h ARG 131 N 0.62 0.72 -0.33 1.92 2.43 -1.64 -1.16 114.38 116.95 1rk2 h ARG 131 Ca 0.11 -0.16 -0.11 0.00 -0.81 0.00 0.00 59.98 59.01 1rk2 h ARG 131 Cb 0.58 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 30.02 1rk2 h ARG 131 CO 0.04 0.69 -0.22 0.82 -1.51 0.00 0.00 179.97 179.78 1rk2 h ILE 132 N 0.61 1.29 -0.32 1.20 2.04 -1.00 -2.52 117.51 118.82 1rk2 h ILE 132 Ca 0.15 -1.37 -0.04 0.00 1.00 0.00 0.00 64.86 64.60 1rk2 h ILE 132 Cb 0.27 1.45 -0.02 0.00 -0.74 0.00 0.00 36.82 37.79 1rk2 h ILE 132 CO -0.00 0.44 0.01 0.00 0.00 0.00 0.00 178.15 178.60 1rk2 h ALA 133 N 0.75 1.43 0.00 1.87 0.00 -0.77 -2.62 119.26 119.92 1rk2 h ALA 133 Ca 0.07 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1rk2 h ALA 133 Cb 0.78 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1rk2 h ALA 133 CO 0.06 0.40 -0.31 0.09 0.00 0.00 0.00 179.25 179.49 1rk2 n ASN 134 N -4.30 0.46 -4.80 0.00 3.02 -0.45 -4.80 115.26 104.39 1rk2 n ASN 134 Ca 0.01 0.19 -0.33 0.00 -0.03 0.00 0.00 54.58 54.42 1rk2 n ASN 134 Cb 0.23 -0.15 -0.01 0.00 -0.61 0.00 0.00 39.78 39.23 1rk2 n ASN 134 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1rk2 s ALA 135 N -3.06 2.81 0.08 5.41 0.00 -0.96 -4.83 121.76 121.22 1rk2 s ALA 135 Ca 0.11 0.48 0.08 0.00 0.00 0.00 0.00 51.96 52.63 1rk2 s ALA 135 Cb 0.16 -3.24 -0.19 0.00 0.00 0.00 0.00 23.12 19.86 1rk2 s ALA 135 CO 0.64 -0.58 1.26 0.77 0.00 0.00 0.00 175.76 177.85 1rk2 h SER 136 N 0.94 0.00 -5.02 0.00 0.02 -1.03 -3.42 113.55 105.03 1rk2 h SER 136 Ca -0.48 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 60.39 1rk2 h SER 136 Cb 1.22 0.00 -0.17 0.00 0.14 0.00 0.00 62.40 63.59 1rk2 h SER 136 CO 0.58 0.95 -0.11 0.00 -1.14 0.00 0.00 176.83 177.11 1rk2 s ALA 137 N -2.73 -1.03 -0.13 3.77 0.00 -1.08 -1.68 121.76 118.88 1rk2 s ALA 137 Ca 0.01 0.40 0.01 0.00 0.00 0.00 0.00 51.96 52.37 1rk2 s ALA 137 Cb 0.10 0.26 0.02 0.00 0.00 0.00 0.00 23.12 23.50 1rk2 s ALA 137 CO 0.81 -0.41 -0.13 -1.17 0.00 0.00 0.00 175.76 174.86 1rk2 s LEU 138 N -1.80 1.62 -0.18 0.00 2.96 0.13 -1.36 118.68 120.06 1rk2 s LEU 138 Ca -0.07 -0.44 -0.02 0.00 -0.22 0.00 0.00 54.13 53.38 1rk2 s LEU 138 Cb -0.02 -1.10 -0.01 0.00 0.50 0.00 0.00 46.19 45.57 1rk2 s LEU 138 CO 0.00 -0.04 -0.09 -0.22 -1.32 0.00 0.00 176.35 174.68 1rk2 s LEU 139 N 1.36 2.80 0.16 -0.68 2.96 -0.17 -0.28 118.68 124.83 1rk2 s LEU 139 Ca 0.01 -0.36 0.01 0.00 -0.22 0.00 0.00 54.13 53.57 1rk2 s LEU 139 Cb -0.13 -1.68 -0.04 0.00 0.50 0.00 0.00 46.19 44.84 1rk2 s LEU 139 CO -0.07 0.07 -0.00 -0.04 -1.32 0.00 0.00 176.35 174.98 1rk2 s MET 140 N 0.95 1.04 0.00 1.98 -1.94 -0.53 -1.42 119.30 119.38 1rk2 s MET 140 Ca -0.01 -1.49 0.00 0.00 -1.71 0.00 0.00 55.69 52.48 1rk2 s MET 140 Cb -0.15 -0.20 0.00 0.00 2.01 0.00 0.00 34.83 36.50 1rk2 s MET 140 CO -0.00 -0.13 0.00 1.04 -0.01 0.00 0.00 175.02 175.92 1rk2 n GLN 141 N -0.19 1.14 -0.96 2.03 3.00 -1.25 -0.79 117.38 120.36 1rk2 n GLN 141 Ca -0.07 0.00 -0.08 0.00 -0.01 0.00 0.00 57.00 56.84 1rk2 n GLN 141 Cb 0.63 0.00 0.18 0.00 0.00 0.00 0.00 30.24 31.04 1rk2 n GLN 141 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 1rk2 n LEU 142 N 0.00 4.34 -1.38 1.08 4.77 0.10 -4.48 117.00 121.44 1rk2 n LEU 142 Ca 0.00 -3.93 0.09 0.00 -0.03 0.00 0.00 56.01 52.15 1rk2 n LEU 142 Cb 0.00 -0.62 0.32 0.00 -2.33 0.00 0.00 43.42 40.79 1rk2 n LEU 142 CO 0.00 1.38 0.78 -0.62 -1.33 0.00 0.00 177.39 177.60 1rk2 n GLU 143 N -1.08 3.36 -4.45 3.23 1.02 -1.25 -4.37 120.64 117.10 1rk2 n GLU 143 Ca 0.35 -2.74 -0.23 0.00 -0.02 0.00 0.00 57.16 54.52 1rk2 n GLU 143 Cb 1.00 -1.74 -0.10 0.00 -0.02 0.00 0.00 31.44 30.58 1rk2 n GLU 143 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 1rk2 s SER 144 N -1.01 3.39 0.20 1.62 0.01 -1.26 -4.58 113.70 112.07 1rk2 s SER 144 Ca 0.47 -1.03 -0.32 0.00 1.31 0.00 0.00 55.95 56.38 1rk2 s SER 144 Cb 0.29 -0.27 -0.14 0.00 0.21 0.00 0.00 66.02 66.11 1rk2 s SER 144 CO 0.25 0.00 1.47 -2.65 0.41 0.00 0.00 173.24 172.72 1rk2 n PRO 145 N -0.56 2.03 -0.36 12.44 -0.02 -1.26 -4.84 135.00 142.43 1rk2 n PRO 145 Ca -0.06 0.73 0.03 0.00 -2.02 0.00 0.00 63.50 62.18 1rk2 n PRO 145 Cb 0.60 -2.43 0.17 0.00 -0.02 0.00 0.00 33.50 31.83 1rk2 n PRO 145 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1rk2 h LEU 146 N 4.89 1.00 -1.60 2.45 5.85 -1.95 -0.83 115.31 125.13 1rk2 h LEU 146 Ca -0.45 0.01 0.06 0.00 0.84 0.00 0.00 57.88 58.34 1rk2 h LEU 146 Cb 1.27 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 42.07 1rk2 h LEU 146 CO 0.81 0.63 0.36 -0.33 -0.34 0.00 0.00 178.44 179.57 1rk2 h GLU 147 N 1.14 0.48 -0.02 1.25 3.07 -1.97 0.27 114.58 118.80 1rk2 h GLU 147 Ca 0.43 -0.03 -0.23 0.00 -0.50 0.00 0.00 59.36 59.03 1rk2 h GLU 147 Cb 0.19 -0.11 0.02 0.00 -0.84 0.00 0.00 28.75 28.01 1rk2 h GLU 147 CO -0.18 0.32 -0.90 0.77 -1.40 0.00 0.00 179.01 177.62 1rk2 h SER 148 N 0.50 0.82 -0.76 1.42 0.02 -1.47 -1.72 113.55 112.36 1rk2 h SER 148 Ca 0.23 -0.73 -0.04 0.00 -0.84 0.00 0.00 61.79 60.41 1rk2 h SER 148 Cb 0.27 -0.25 -0.03 0.00 0.14 0.00 0.00 62.40 62.53 1rk2 h SER 148 CO -0.06 1.44 0.33 0.58 -1.14 0.00 0.00 176.83 177.97 1rk2 h VAL 149 N 0.28 1.25 -0.13 2.27 2.07 -0.45 -0.86 116.25 120.68 1rk2 h VAL 149 Ca -0.11 -0.76 -0.01 0.00 0.82 0.00 0.00 66.70 66.64 1rk2 h VAL 149 Cb 1.56 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 31.64 1rk2 h VAL 149 CO 0.18 0.32 0.04 -0.03 0.02 0.00 0.00 177.57 178.09 1rk2 h MET 150 N 1.11 0.21 -0.71 1.57 -1.53 -0.51 -0.99 114.93 114.07 1rk2 h MET 150 Ca 0.26 -0.05 0.02 0.00 -3.44 0.00 0.00 59.70 56.49 1rk2 h MET 150 Cb 0.18 -0.03 -0.04 0.00 -0.55 0.00 0.00 31.60 31.16 1rk2 h MET 150 CO -0.03 0.35 0.46 0.00 0.14 0.00 0.00 176.91 177.83 1rk2 h ALA 151 N 0.85 0.92 -0.52 0.39 0.00 -0.99 -1.19 119.26 118.72 1rk2 h ALA 151 Ca 0.04 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.82 1rk2 h ALA 151 Cb 0.23 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1rk2 h ALA 151 CO -0.00 0.27 -0.07 0.00 0.00 0.00 0.00 179.25 179.45 1rk2 h ALA 152 N 1.28 0.71 -0.64 0.00 0.00 -1.08 -2.44 119.26 117.10 1rk2 h ALA 152 Ca 0.27 -0.33 0.01 0.00 0.00 0.00 0.00 54.91 54.86 1rk2 h ALA 152 Cb -0.04 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 1rk2 h ALA 152 CO -0.08 0.59 0.42 0.00 0.00 0.00 0.00 179.25 180.17 1rk2 h ALA 153 N 0.92 0.81 -0.51 0.00 0.00 -0.78 -1.09 119.26 118.60 1rk2 h ALA 153 Ca 0.14 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 1rk2 h ALA 153 Cb 0.62 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 1rk2 h ALA 153 CO 0.04 0.24 0.23 0.87 0.00 0.00 0.00 179.25 180.63 1rk2 h LYS 154 N 0.86 0.75 -0.02 0.00 1.57 -1.07 0.72 116.57 119.39 1rk2 h LYS 154 Ca 0.23 -0.12 -0.00 0.00 -1.87 0.00 0.00 60.65 58.89 1rk2 h LYS 154 Cb -0.09 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 32.09 1rk2 h LYS 154 CO -0.05 0.64 0.01 0.82 -0.57 0.00 0.00 179.45 180.30 1rk2 h ILE 155 N 0.68 1.04 -0.41 1.86 2.04 -1.14 -0.95 117.51 120.63 1rk2 h ILE 155 Ca 0.17 -0.12 0.06 0.00 1.00 0.00 0.00 64.86 65.97 1rk2 h ILE 155 Cb 0.15 1.09 -0.05 0.00 -0.74 0.00 0.00 36.82 37.27 1rk2 h ILE 155 CO -0.02 0.03 0.12 0.00 0.00 0.00 0.00 178.15 178.28 1rk2 h ALA 156 N 0.96 0.47 -0.07 1.87 0.00 -0.99 -2.35 119.26 119.14 1rk2 h ALA 156 Ca 0.01 0.06 0.03 0.00 0.00 0.00 0.00 54.91 55.01 1rk2 h ALA 156 Cb 0.04 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.86 1rk2 h ALA 156 CO -0.00 -0.28 -0.13 1.25 0.00 0.00 0.00 179.25 180.09 1rk2 h HIS 157 N 0.26 -0.32 -0.16 0.00 -0.00 -0.54 0.75 115.15 115.14 1rk2 h HIS 157 Ca 0.19 0.02 0.05 0.00 -0.00 0.00 0.00 60.37 60.62 1rk2 h HIS 157 Cb 0.21 0.16 -0.01 0.00 -0.00 0.00 0.00 27.41 27.76 1rk2 h HIS 157 CO -0.17 -0.19 0.21 1.96 -0.00 0.00 0.00 177.93 179.74 1rk2 h GLN 158 N -0.18 0.00 -0.15 5.26 4.20 -0.80 -2.56 115.11 120.88 1rk2 h GLN 158 Ca 0.07 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.75 1rk2 h GLN 158 Cb 0.28 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.04 1rk2 h GLN 158 CO -0.18 0.00 -0.06 0.09 -0.67 0.00 0.00 178.83 178.01 1rk2 n ASN 159 N -3.62 2.87 -3.09 1.46 3.02 -0.60 -4.97 115.26 110.33 1rk2 n ASN 159 Ca 0.01 -3.26 -0.22 0.00 -0.03 0.00 0.00 54.58 51.08 1rk2 n ASN 159 Cb 0.32 -0.52 0.02 0.00 -0.61 0.00 0.00 39.78 38.99 1rk2 n ASN 159 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1rk2 n LYS 160 N -1.02 -4.02 -3.51 3.52 5.02 -0.85 -4.93 118.16 112.37 1rk2 n LYS 160 Ca 0.21 0.72 -0.37 0.00 -2.02 0.00 0.00 58.31 56.85 1rk2 n LYS 160 Cb 0.80 -5.50 -0.08 0.00 -0.02 0.00 0.00 35.03 30.23 1rk2 n LYS 160 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1rk2 s THR 161 N -3.04 5.28 0.24 -0.18 2.01 0.16 -4.96 115.64 115.15 1rk2 s THR 161 Ca 0.31 0.50 -0.31 0.00 0.31 0.00 0.00 61.69 62.49 1rk2 s THR 161 Cb -0.15 -3.63 -0.12 0.00 0.01 0.00 0.00 72.50 68.61 1rk2 s THR 161 CO 0.38 0.32 1.66 -0.38 -0.69 0.00 0.00 174.62 175.90 1rk2 n ILE 162 N 4.13 0.46 -3.68 1.82 5.41 -0.68 -4.25 119.36 122.56 1rk2 n ILE 162 Ca -0.11 -0.11 -0.39 0.00 1.00 0.00 0.00 62.75 63.13 1rk2 n ILE 162 Cb 0.52 -1.94 -0.12 0.00 -0.71 0.00 0.00 39.64 37.38 1rk2 n ILE 162 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 1rk2 s VAL 163 N 0.63 4.22 -0.23 1.39 1.01 -1.26 0.20 120.40 126.36 1rk2 s VAL 163 Ca 0.70 -0.87 -0.06 0.00 0.00 0.00 0.00 61.98 61.76 1rk2 s VAL 163 Cb -0.51 -3.31 -0.02 0.00 0.00 0.00 0.00 36.38 32.53 1rk2 s VAL 163 CO 0.40 -0.13 0.02 0.00 0.00 0.00 0.00 175.10 175.39 1rk2 s ALA 164 N 1.50 3.03 -0.18 5.51 0.00 0.62 -1.10 121.76 131.14 1rk2 s ALA 164 Ca 0.01 -1.10 0.01 0.00 0.00 0.00 0.00 51.96 50.89 1rk2 s ALA 164 Cb -0.19 -1.89 0.02 0.00 0.00 0.00 0.00 23.12 21.07 1rk2 s ALA 164 CO 0.05 -0.37 -0.19 -1.17 0.00 0.00 0.00 175.76 174.08 1rk2 s LEU 165 N 1.39 2.20 -0.57 0.00 2.96 0.86 -1.46 118.68 124.06 1rk2 s LEU 165 Ca 0.05 -0.70 -0.18 0.00 -0.22 0.00 0.00 54.13 53.08 1rk2 s LEU 165 Cb -0.15 -1.46 0.11 0.00 0.50 0.00 0.00 46.19 45.19 1rk2 s LEU 165 CO 0.01 -0.02 0.64 0.21 -1.32 0.00 0.00 176.35 175.87 1rk2 s ASN 166 N 1.29 6.19 -0.52 3.68 3.04 0.03 -1.66 114.94 126.98 1rk2 s ASN 166 Ca 0.04 -1.49 -0.04 0.00 0.04 0.00 0.00 52.86 51.41 1rk2 s ASN 166 Cb -0.14 -2.27 -0.06 0.00 -1.54 0.00 0.00 41.25 37.24 1rk2 s ASN 166 CO -0.12 -1.02 1.86 -0.81 -3.04 0.00 0.00 177.10 173.96 1rk2 n PRO 167 N 6.01 1.42 -4.34 0.43 -0.04 -1.26 -3.73 135.00 133.49 1rk2 n PRO 167 Ca -0.11 -1.03 -0.19 0.00 -0.04 0.00 0.00 63.50 62.14 1rk2 n PRO 167 Cb 0.42 -2.18 -0.14 0.00 -0.04 0.00 0.00 33.50 31.56 1rk2 n PRO 167 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1rk2 s ALA 168 N 3.34 0.92 0.79 0.55 0.00 -1.26 -3.99 121.76 122.12 1rk2 s ALA 168 Ca 0.30 -0.63 -0.13 0.00 0.00 0.00 0.00 51.96 51.51 1rk2 s ALA 168 Cb 0.09 -0.16 0.07 0.00 0.00 0.00 0.00 23.12 23.12 1rk2 s ALA 168 CO -0.02 0.18 1.15 -2.14 0.00 0.00 0.00 175.76 174.93 1rk2 s PRO 169 N -0.77 1.88 0.31 0.00 0.02 -1.26 0.01 135.00 135.18 1rk2 s PRO 169 Ca 0.01 1.54 -0.29 0.00 0.02 0.00 0.00 61.00 62.28 1rk2 s PRO 169 Cb -0.06 -1.83 -0.13 0.00 0.02 0.00 0.00 34.50 32.51 1rk2 s PRO 169 CO 0.00 -1.99 1.34 0.00 -0.33 0.00 0.00 177.00 176.02 1rk2 n ALA 170 N -3.32 1.26 -3.61 -1.55 0.00 -1.26 -4.85 120.51 107.19 1rk2 n ALA 170 Ca 0.12 0.38 -0.01 0.00 0.00 0.00 0.00 53.44 53.93 1rk2 n ALA 170 Cb 0.52 -2.27 -0.01 0.00 0.00 0.00 0.00 19.45 17.69 1rk2 n ALA 170 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 1rk2 s ARG 171 N -1.34 0.14 0.42 0.00 1.70 -1.26 -5.10 118.95 113.51 1rk2 s ARG 171 Ca 0.60 -0.06 -0.19 0.00 -0.47 0.00 0.00 55.73 55.60 1rk2 s ARG 171 Cb -0.59 0.06 -0.10 0.00 -0.57 0.00 0.00 34.95 33.74 1rk2 s ARG 171 CO 0.58 -0.06 0.91 -1.21 -1.08 0.00 0.00 175.30 174.44 1rk2 s GLU 172 N -2.17 4.16 0.01 3.89 2.02 -1.26 -4.61 118.70 120.74 1rk2 s GLU 172 Ca 0.12 1.02 0.04 0.00 0.02 0.00 0.00 54.97 56.18 1rk2 s GLU 172 Cb 0.02 -2.22 -0.01 0.00 0.10 0.00 0.00 34.13 32.01 1rk2 s GLU 172 CO -0.04 -0.02 -0.14 -0.51 0.02 0.00 0.00 175.26 174.58 1rk2 s LEU 173 N -3.23 2.08 0.56 1.80 1.43 -1.26 -5.11 118.68 114.96 1rk2 s LEU 173 Ca 0.60 -0.33 -0.20 0.00 -1.03 0.00 0.00 54.13 53.17 1rk2 s LEU 173 Cb -0.09 -0.66 -0.04 0.00 0.03 0.00 0.00 46.19 45.43 1rk2 s LEU 173 CO 0.15 0.11 1.26 -2.16 0.23 0.00 0.00 176.35 175.95 1rk2 s PRO 174 N -0.64 3.09 0.50 1.29 0.04 -1.26 -4.88 135.00 133.13 1rk2 s PRO 174 Ca 0.04 1.99 0.15 0.00 0.04 0.00 0.00 61.00 63.22 1rk2 s PRO 174 Cb -0.06 -2.10 1.18 0.00 0.04 0.00 0.00 34.50 33.56 1rk2 s PRO 174 CO 0.00 -1.16 2.11 -0.44 0.04 0.00 0.00 177.00 177.56 1rk2 h ASP 175 N 1.21 0.05 -0.83 6.66 3.32 -1.99 -2.01 116.42 122.83 1rk2 h ASP 175 Ca -0.51 -0.00 0.10 0.00 0.02 0.00 0.00 57.03 56.64 1rk2 h ASP 175 Cb 1.30 -0.01 -0.06 0.00 0.22 0.00 0.00 39.33 40.78 1rk2 h ASP 175 CO 0.56 0.07 0.54 -0.08 -1.72 0.00 0.00 179.24 178.61 1rk2 h GLU 176 N 0.05 0.74 0.01 3.56 4.81 -1.96 -0.50 114.58 121.29 1rk2 h GLU 176 Ca 0.01 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 59.20 1rk2 h GLU 176 Cb 0.06 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.27 1rk2 h GLU 176 CO 0.00 0.49 -0.00 1.25 -0.73 0.00 0.00 179.01 180.01 1rk2 h LEU 177 N 0.76 -0.01 -1.51 1.64 5.85 -1.73 -3.32 115.31 116.98 1rk2 h LEU 177 Ca 0.39 -0.81 0.18 0.00 0.84 0.00 0.00 57.88 58.48 1rk2 h LEU 177 Cb 0.47 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 41.45 1rk2 h LEU 177 CO -0.16 0.83 0.56 -0.07 -0.34 0.00 0.00 178.44 179.27 1rk2 h LEU 178 N -0.89 0.43 -1.97 2.25 3.38 -1.30 0.61 115.31 117.82 1rk2 h LEU 178 Ca -0.00 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 1rk2 h LEU 178 Cb 0.82 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.52 1rk2 h LEU 178 CO 0.00 0.20 -0.11 0.00 0.09 0.00 0.00 178.44 178.62 1rk2 h ALA 179 N 1.62 1.45 -0.00 1.53 0.00 -1.14 -2.32 119.26 120.39 1rk2 h ALA 179 Ca 0.43 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.24 1rk2 h ALA 179 Cb 1.00 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.77 1rk2 h ALA 179 CO -0.16 0.13 -0.27 1.28 0.00 0.00 0.00 179.25 180.23 1rk2 n LEU 180 N -3.86 0.66 -4.77 0.00 4.77 0.20 -4.82 117.00 109.17 1rk2 n LEU 180 Ca -0.02 -0.06 -0.39 0.00 -0.03 0.00 0.00 56.01 55.51 1rk2 n LEU 180 Cb 0.20 -0.20 -0.06 0.00 -2.33 0.00 0.00 43.42 41.03 1rk2 n LEU 180 CO 0.31 0.13 0.39 -0.69 -1.33 0.00 0.00 177.39 176.20 1rk2 s VAL 181 N -2.68 4.65 -0.22 4.08 1.01 -0.87 -4.68 120.40 121.69 1rk2 s VAL 181 Ca 0.21 1.48 -0.02 0.00 0.00 0.00 0.00 61.98 63.65 1rk2 s VAL 181 Cb 0.19 -4.03 -0.19 0.00 0.00 0.00 0.00 36.38 32.34 1rk2 s VAL 181 CO 0.56 0.47 -0.06 0.47 0.00 0.00 0.00 175.10 176.54 1rk2 n ASP 182 N 2.14 2.02 -3.84 3.32 8.00 -0.26 -4.28 116.55 123.65 1rk2 n ASP 182 Ca -0.06 0.00 -0.24 0.00 0.71 0.00 0.00 54.79 55.20 1rk2 n ASP 182 Cb 0.50 -0.58 -0.17 0.00 -0.02 0.00 0.00 41.12 40.85 1rk2 n ASP 182 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1rk2 s ILE 183 N -2.53 0.64 -0.05 0.53 1.01 -0.68 -1.69 121.20 118.44 1rk2 s ILE 183 Ca -0.32 -0.06 0.06 0.00 0.00 0.00 0.00 60.65 60.33 1rk2 s ILE 183 Cb 0.09 -0.73 -0.01 0.00 0.01 0.00 0.00 42.46 41.81 1rk2 s ILE 183 CO 0.64 0.30 -0.24 -0.51 0.00 0.00 0.00 174.94 175.13 1rk2 s ILE 184 N 1.73 2.17 -0.57 2.92 2.07 -0.83 -0.10 121.20 128.58 1rk2 s ILE 184 Ca 0.03 -1.04 0.06 0.00 -1.41 0.00 0.00 60.65 58.29 1rk2 s ILE 184 Cb -0.13 -1.78 0.30 0.00 0.13 0.00 0.00 42.46 40.98 1rk2 s ILE 184 CO -0.05 0.57 0.83 0.35 -1.91 0.00 0.00 174.94 174.72 1rk2 n THR 185 N 2.80 2.27 -2.23 4.00 -2.24 -0.67 -1.48 114.28 116.73 1rk2 n THR 185 Ca -0.17 -5.26 -0.32 0.00 -2.27 0.00 0.00 64.05 56.03 1rk2 n THR 185 Cb 0.52 -1.60 -0.02 0.00 -2.10 0.00 0.00 70.33 67.13 1rk2 n THR 185 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 1rk2 s PRO 186 N -2.86 3.71 0.04 -0.78 0.04 -1.20 -4.47 135.00 129.48 1rk2 s PRO 186 Ca 0.44 1.02 -0.00 0.00 0.04 0.00 0.00 61.00 62.49 1rk2 s PRO 186 Cb 0.23 -2.10 0.01 0.00 0.04 0.00 0.00 34.50 32.68 1rk2 s PRO 186 CO -0.08 -0.48 0.05 0.27 0.04 0.00 0.00 177.00 176.80 1rk2 n ASN 187 N -1.84 0.06 -0.10 6.66 0.23 -1.26 -1.70 115.26 117.31 1rk2 n ASN 187 Ca 0.07 -1.06 -0.09 0.00 -0.53 0.00 0.00 54.58 52.97 1rk2 n ASN 187 Cb 0.54 -0.04 -0.02 0.00 -2.08 0.00 0.00 39.78 38.18 1rk2 n ASN 187 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 1rk2 h GLU 188 N 0.00 0.45 -0.83 -3.83 5.08 -1.91 -0.11 114.58 113.43 1rk2 h GLU 188 Ca -0.02 -0.06 -0.04 0.00 -1.00 0.00 0.00 59.36 58.24 1rk2 h GLU 188 Cb 0.06 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.19 1rk2 h GLU 188 CO 0.02 0.41 0.38 1.15 -1.00 0.00 0.00 179.01 179.97 1rk2 h THR 189 N 0.37 1.26 -0.17 1.13 2.02 -1.93 -1.50 112.91 114.10 1rk2 h THR 189 Ca 0.11 -0.77 -0.14 0.00 0.77 0.00 0.00 66.41 66.38 1rk2 h THR 189 Cb 0.11 0.22 -0.01 0.00 -1.74 0.00 0.00 68.15 66.73 1rk2 h THR 189 CO -0.01 0.32 -0.51 -0.33 0.37 0.00 0.00 175.52 175.36 1rk2 h GLU 190 N 1.19 0.46 -0.18 6.66 5.08 -1.87 -0.94 114.58 124.99 1rk2 h GLU 190 Ca 0.28 -0.27 -0.02 0.00 -1.00 0.00 0.00 59.36 58.35 1rk2 h GLU 190 Cb 0.15 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 1rk2 h GLU 190 CO -0.03 0.86 0.03 0.00 -1.00 0.00 0.00 179.01 178.87 1rk2 h ALA 191 N 1.09 0.24 -0.83 3.43 0.00 -0.68 -1.56 119.26 120.95 1rk2 h ALA 191 Ca 0.01 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 1rk2 h ALA 191 Cb 1.02 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.70 1rk2 h ALA 191 CO 0.09 -0.10 0.45 1.49 0.00 0.00 0.00 179.25 181.18 1rk2 h GLU 192 N 0.09 1.16 0.00 0.00 4.81 -1.20 -0.14 114.58 119.30 1rk2 h GLU 192 Ca 0.05 -0.13 -0.07 0.00 -0.13 0.00 0.00 59.36 59.08 1rk2 h GLU 192 Cb 0.30 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 29.44 1rk2 h GLU 192 CO 0.00 0.85 -0.36 -0.22 -0.73 0.00 0.00 179.01 178.56 1rk2 h LYS 193 N 1.16 0.00 0.00 1.92 1.63 -0.89 0.46 116.57 120.85 1rk2 h LYS 193 Ca 0.29 0.00 -0.23 0.00 -0.85 0.00 0.00 60.65 59.86 1rk2 h LYS 193 Cb 0.03 0.00 -0.04 0.00 -0.60 0.00 0.00 32.23 31.63 1rk2 h LYS 193 CO -0.05 0.36 -1.42 -0.07 -3.45 0.00 0.00 179.45 174.82 1rk2 h LEU 194 N 0.00 0.00 0.00 5.20 3.38 -0.74 -3.40 115.31 119.75 1rk2 h LEU 194 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1rk2 h LEU 194 Cb 0.74 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.49 1rk2 h LEU 194 CO 0.05 0.83 -0.28 0.35 0.09 0.00 0.00 178.44 179.48 1rk2 n THR 195 N -3.06 0.00 -0.98 0.22 -2.24 -0.11 -4.94 114.28 103.16 1rk2 n THR 195 Ca -0.11 -0.37 0.00 0.00 -2.27 0.00 0.00 64.05 61.31 1rk2 n THR 195 Cb 0.95 0.99 0.00 0.00 -2.10 0.00 0.00 70.33 70.17 1rk2 n THR 195 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1rk2 n GLY 196 N 1.14 0.48 3.30 3.38 0.00 0.16 -5.00 105.19 108.65 1rk2 n GLY 196 Ca 0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.69 1rk2 n GLY 196 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1rk2 s ILE 197 N -2.12 3.18 0.07 -0.61 1.01 -1.22 -5.02 121.20 116.49 1rk2 s ILE 197 Ca 0.00 -0.57 -0.31 0.00 0.00 0.00 0.00 60.65 59.78 1rk2 s ILE 197 Cb 0.00 -2.42 -0.06 0.00 0.01 0.00 0.00 42.46 39.98 1rk2 s ILE 197 CO 0.00 0.45 1.31 -0.13 0.00 0.00 0.00 174.94 176.57 1rk2 s ARG 198 N 1.29 4.36 -0.42 2.79 0.52 -1.26 -3.50 118.95 122.73 1rk2 s ARG 198 Ca 0.03 1.92 -0.16 0.00 -0.52 0.00 0.00 55.73 57.00 1rk2 s ARG 198 Cb -0.14 -3.35 0.03 0.00 0.52 0.00 0.00 34.95 32.00 1rk2 s ARG 198 CO -0.03 -0.39 0.38 0.08 0.02 0.00 0.00 175.30 175.36 1rk2 s VAL 199 N 1.33 5.17 -0.09 3.52 1.01 -1.26 -4.81 120.40 125.28 1rk2 s VAL 199 Ca 0.62 -0.55 0.03 0.00 0.00 0.00 0.00 61.98 62.07 1rk2 s VAL 199 Cb -0.33 -4.01 -0.07 0.00 0.00 0.00 0.00 36.38 31.97 1rk2 s VAL 199 CO 0.29 -0.40 -0.04 -0.62 0.00 0.00 0.00 175.10 174.32 1rk2 n GLU 200 N 5.40 1.16 -4.28 2.72 1.02 -1.26 -4.95 120.64 120.45 1rk2 n GLU 200 Ca -0.09 0.03 -0.17 0.00 -0.02 0.00 0.00 57.16 56.91 1rk2 n GLU 200 Cb 0.47 -1.19 -0.09 0.00 -0.02 0.00 0.00 31.44 30.61 1rk2 n GLU 200 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1rk2 s ASN 201 N -4.55 1.24 0.51 1.62 2.20 -1.26 -5.02 114.94 109.69 1rk2 s ASN 201 Ca -0.09 -1.61 0.32 0.00 -0.94 0.00 0.00 52.86 50.53 1rk2 s ASN 201 Cb 0.03 0.47 1.73 0.00 -2.00 0.00 0.00 41.25 41.48 1rk2 s ASN 201 CO 0.25 -0.96 1.96 0.44 -2.94 0.00 0.00 177.10 175.85 1rk2 h ASP 202 N 2.28 0.00 -0.01 3.54 3.32 -1.99 0.13 116.42 123.69 1rk2 h ASP 202 Ca -0.30 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 56.72 1rk2 h ASP 202 Cb 1.24 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.79 1rk2 h ASP 202 CO 0.45 0.00 -0.10 -0.33 -1.72 0.00 0.00 179.24 177.54 1rk2 h GLU 203 N 0.00 0.08 0.40 3.56 5.08 -2.00 -3.06 114.58 118.64 1rk2 h GLU 203 Ca 0.00 -0.08 -0.01 0.00 -1.00 0.00 0.00 59.36 58.27 1rk2 h GLU 203 Cb 0.14 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.40 1rk2 h GLU 203 CO 0.00 0.80 -0.25 -0.44 -1.00 0.00 0.00 179.01 178.12 1rk2 h ASP 204 N -0.61 -0.62 -0.84 1.42 3.32 -1.32 -2.87 116.42 114.90 1rk2 h ASP 204 Ca -0.01 0.04 0.15 0.00 0.02 0.00 0.00 57.03 57.23 1rk2 h ASP 204 Cb 0.83 0.18 -0.15 0.00 0.22 0.00 0.00 39.33 40.41 1rk2 h ASP 204 CO 0.02 -0.39 -0.30 0.00 -1.72 0.00 0.00 179.24 176.85 1rk2 h ALA 205 N -0.06 0.31 -0.79 3.45 0.00 -1.39 0.34 119.26 121.12 1rk2 h ALA 205 Ca -0.04 0.28 0.04 0.00 0.00 0.00 0.00 54.91 55.18 1rk2 h ALA 205 Cb 0.51 0.79 -0.05 0.00 0.00 0.00 0.00 17.79 19.04 1rk2 h ALA 205 CO 0.05 -0.53 0.49 0.00 0.00 0.00 0.00 179.25 179.26 1rk2 h ALA 206 N 1.52 1.04 -0.65 0.00 0.00 -1.45 0.19 119.26 119.91 1rk2 h ALA 206 Ca 0.35 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 55.16 1rk2 h ALA 206 Cb 0.60 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.12 1rk2 h ALA 206 CO -0.87 0.28 0.11 -0.22 0.00 0.00 0.00 179.25 178.55 1rk2 h LYS 207 N 0.95 1.07 -0.55 0.00 3.64 -0.25 -0.27 116.57 121.17 1rk2 h LYS 207 Ca 0.32 -0.28 -0.10 0.00 -1.27 0.00 0.00 60.65 59.32 1rk2 h LYS 207 Cb 0.05 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 31.72 1rk2 h LYS 207 CO -0.13 0.99 -0.05 0.00 -2.27 0.00 0.00 179.45 177.99 1rk2 h ALA 208 N 1.04 0.75 -0.56 5.00 0.00 -0.18 -2.87 119.26 122.44 1rk2 h ALA 208 Ca 0.20 -0.32 -0.06 0.00 0.00 0.00 0.00 54.91 54.73 1rk2 h ALA 208 Cb 0.43 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 1rk2 h ALA 208 CO 0.01 0.62 0.11 0.00 0.00 0.00 0.00 179.25 179.99 1rk2 h ALA 209 N 0.94 1.15 -0.83 0.00 0.00 -0.31 -2.75 119.26 117.46 1rk2 h ALA 209 Ca 0.15 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 1rk2 h ALA 209 Cb 0.60 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 18.13 1rk2 h ALA 209 CO 0.04 0.57 0.37 0.37 0.00 0.00 0.00 179.25 180.60 1rk2 h GLN 210 N 0.84 1.21 -0.52 0.00 4.15 -0.85 0.90 115.11 120.84 1rk2 h GLN 210 Ca 0.18 -0.19 0.02 0.00 0.77 0.00 0.00 58.65 59.42 1rk2 h GLN 210 Cb 0.34 -0.21 -0.03 0.00 0.21 0.00 0.00 27.48 27.78 1rk2 h GLN 210 CO 0.00 0.95 0.32 0.28 -1.93 0.00 0.00 178.83 178.45 1rk2 h VAL 211 N 1.19 1.07 -0.23 2.39 2.07 -1.29 -0.40 116.25 121.06 1rk2 h VAL 211 Ca 0.28 -0.22 -0.12 0.00 0.82 0.00 0.00 66.70 67.47 1rk2 h VAL 211 Cb 0.16 0.38 -0.01 0.00 -1.52 0.00 0.00 31.29 30.30 1rk2 h VAL 211 CO -0.03 0.12 -0.36 -0.07 0.02 0.00 0.00 177.57 177.25 1rk2 h LEU 212 N 0.63 0.52 -0.75 2.57 3.38 -1.20 -1.84 115.31 118.64 1rk2 h LEU 212 Ca 0.20 -0.21 -0.04 0.00 0.09 0.00 0.00 57.88 57.92 1rk2 h LEU 212 Cb -0.00 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 1rk2 h LEU 212 CO -0.08 0.84 0.29 0.45 0.09 0.00 0.00 178.44 180.03 1rk2 h HIS 213 N 0.42 1.14 0.00 1.13 3.86 -0.33 -1.77 115.15 119.61 1rk2 h HIS 213 Ca 0.05 -0.09 -0.01 0.00 -1.16 0.00 0.00 60.37 59.16 1rk2 h HIS 213 Cb 0.82 -0.34 -0.00 0.00 1.06 0.00 0.00 27.41 28.95 1rk2 h HIS 213 CO 0.03 0.87 -0.03 0.93 0.86 0.00 0.00 177.93 180.60 1rk2 h GLU 214 N 1.08 0.00 -0.00 2.45 4.39 -0.71 -0.53 114.58 121.25 1rk2 h GLU 214 Ca 0.25 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.95 1rk2 h GLU 214 Cb 0.22 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.87 1rk2 h GLU 214 CO -0.02 0.03 -0.04 1.63 -1.16 0.00 0.00 179.01 179.44 1rk2 n LYS 215 N -3.14 0.62 0.00 2.33 4.76 -0.72 -4.89 118.16 117.12 1rk2 n LYS 215 Ca -0.00 -0.10 0.00 0.00 -2.87 0.00 0.00 58.31 55.34 1rk2 n LYS 215 Cb 0.28 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 31.97 1rk2 n LYS 215 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1rk2 n GLY 216 N 1.24 0.96 3.52 0.72 0.00 -0.21 -3.56 105.19 107.86 1rk2 n GLY 216 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 1rk2 n GLY 216 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1rk2 s ILE 217 N -2.00 5.13 0.09 -0.61 1.01 -0.75 -4.77 121.20 119.31 1rk2 s ILE 217 Ca 0.00 -0.08 -0.17 0.00 0.00 0.00 0.00 60.65 60.39 1rk2 s ILE 217 Cb 0.00 -3.91 -0.07 0.00 0.01 0.00 0.00 42.46 38.49 1rk2 s ILE 217 CO 0.00 -0.22 1.50 -0.09 0.00 0.00 0.00 174.94 176.13 1rk2 h ARG 218 N 8.56 0.53 -4.86 2.79 2.43 -1.74 -3.31 114.38 118.77 1rk2 h ARG 218 Ca -0.28 -0.19 -0.67 0.00 -0.81 0.00 0.00 59.98 58.02 1rk2 h ARG 218 Cb 1.13 -0.04 -0.29 0.00 -0.42 0.00 0.00 29.97 30.35 1rk2 h ARG 218 CO 0.74 0.72 -0.69 0.99 -1.51 0.00 0.00 179.97 180.22 1rk2 s THR 219 N -4.83 3.41 -0.16 0.20 2.01 -0.68 -0.23 115.64 115.35 1rk2 s THR 219 Ca -0.13 -0.86 0.00 0.00 0.31 0.00 0.00 61.69 61.01 1rk2 s THR 219 Cb 0.08 -2.74 0.00 0.00 0.01 0.00 0.00 72.50 69.85 1rk2 s THR 219 CO 0.77 0.14 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.99 1rk2 s VAL 220 N 1.41 2.54 -0.27 3.82 1.01 0.64 -1.97 120.40 127.58 1rk2 s VAL 220 Ca 0.01 -0.80 0.02 0.00 0.00 0.00 0.00 61.98 61.22 1rk2 s VAL 220 Cb -0.17 -2.08 0.07 0.00 0.00 0.00 0.00 36.38 34.21 1rk2 s VAL 220 CO -0.01 0.51 -0.05 -0.76 0.00 0.00 0.00 175.10 174.80 1rk2 s LEU 221 N 0.98 3.41 -0.43 3.92 1.43 -0.55 -0.67 118.68 126.77 1rk2 s LEU 221 Ca -0.02 -1.51 -0.17 0.00 -1.03 0.00 0.00 54.13 51.40 1rk2 s LEU 221 Cb -0.15 -1.42 0.03 0.00 0.03 0.00 0.00 46.19 44.68 1rk2 s LEU 221 CO -0.03 -0.26 0.41 -0.63 0.23 0.00 0.00 176.35 176.07 1rk2 s ILE 222 N 1.17 5.13 0.29 -0.59 1.01 -0.64 -3.25 121.20 124.32 1rk2 s ILE 222 Ca -0.03 -0.53 -0.29 0.00 0.00 0.00 0.00 60.65 59.80 1rk2 s ILE 222 Cb -0.19 -4.04 -0.10 0.00 0.01 0.00 0.00 42.46 38.14 1rk2 s ILE 222 CO -0.07 -0.44 1.20 0.42 0.00 0.00 0.00 174.94 176.05 1rk2 s THR 223 N 2.00 3.18 -0.26 2.92 -4.23 -0.69 -0.34 115.64 118.21 1rk2 s THR 223 Ca 0.09 1.15 0.09 0.00 -1.18 0.00 0.00 61.69 61.85 1rk2 s THR 223 Cb -0.19 -3.74 0.45 0.00 1.34 0.00 0.00 72.50 70.37 1rk2 s THR 223 CO 0.12 0.26 1.29 0.18 -0.54 0.00 0.00 174.62 175.93 1rk2 n LEU 224 N 1.24 3.74 0.00 4.79 4.77 0.16 -3.14 117.00 128.56 1rk2 n LEU 224 Ca 0.00 -4.11 0.00 0.00 -0.03 0.00 0.00 56.01 51.87 1rk2 n LEU 224 Cb 0.43 -0.52 0.00 0.00 -2.33 0.00 0.00 43.42 41.00 1rk2 n LEU 224 CO 0.56 1.56 0.00 0.61 -1.33 0.00 0.00 177.39 178.79 1rk2 n GLY 225 N -1.01 3.35 0.00 -0.72 0.00 -1.25 -1.54 105.19 104.01 1rk2 n GLY 225 Ca 0.30 -0.12 0.12 0.00 0.00 0.00 0.00 46.02 46.32 1rk2 n GLY 225 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1rk2 n SER 226 N 7.32 0.00 -0.37 1.61 3.41 -1.26 -2.91 113.62 121.42 1rk2 n SER 226 Ca 0.00 0.28 0.07 0.00 -0.26 0.00 0.00 58.87 58.97 1rk2 n SER 226 Cb 0.00 -0.42 0.29 0.00 -0.26 0.00 0.00 64.21 63.82 1rk2 n SER 226 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1rk2 n ARG 227 N -1.42 1.48 0.00 4.33 1.74 -0.59 -4.50 116.66 117.69 1rk2 n ARG 227 Ca 0.08 -0.73 0.00 0.00 -0.77 0.00 0.00 57.85 56.44 1rk2 n ARG 227 Cb 0.26 -1.28 0.00 0.00 -1.02 0.00 0.00 32.46 30.42 1rk2 n ARG 227 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1rk2 n GLY 228 N 0.94 0.60 3.30 -0.13 0.00 -1.14 -4.39 105.19 104.36 1rk2 n GLY 228 Ca 0.12 -1.03 -0.14 0.00 0.00 0.00 0.00 46.02 44.97 1rk2 n GLY 228 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rk2 s VAL 229 N 0.00 0.04 -0.51 1.61 0.11 -0.42 0.36 120.40 121.59 1rk2 s VAL 229 Ca 0.00 -0.32 -0.17 0.00 -2.93 0.00 0.00 61.98 58.56 1rk2 s VAL 229 Cb 0.00 -0.68 0.08 0.00 -1.53 0.00 0.00 36.38 34.24 1rk2 s VAL 229 CO 0.00 -0.18 0.53 0.86 -3.33 0.00 0.00 175.10 172.99 1rk2 s TRP 230 N -1.09 3.14 -0.19 1.54 -0.11 0.54 -0.63 118.94 122.13 1rk2 s TRP 230 Ca -0.11 -0.81 -0.18 0.00 1.22 0.00 0.00 56.10 56.22 1rk2 s TRP 230 Cb -0.04 -3.47 -0.03 0.00 -1.50 0.00 0.00 33.47 28.43 1rk2 s TRP 230 CO 0.05 -0.97 0.51 0.00 -4.62 0.00 0.00 176.95 171.92 1rk2 s ALA 231 N 2.15 3.54 -0.03 5.86 0.00 -0.32 -1.63 121.76 131.33 1rk2 s ALA 231 Ca 0.09 -0.39 -0.00 0.00 0.00 0.00 0.00 51.96 51.65 1rk2 s ALA 231 Cb -0.23 -2.79 0.03 0.00 0.00 0.00 0.00 23.12 20.13 1rk2 s ALA 231 CO 0.08 -0.40 0.02 0.45 0.00 0.00 0.00 175.76 175.91 1rk2 s SER 232 N 1.11 0.58 -0.32 0.00 0.15 0.15 -0.48 113.70 114.88 1rk2 s SER 232 Ca 0.24 0.01 -0.02 0.00 0.70 0.00 0.00 55.95 56.88 1rk2 s SER 232 Cb -0.15 -0.18 0.06 0.00 -1.71 0.00 0.00 66.02 64.04 1rk2 s SER 232 CO 0.10 -0.15 0.04 -0.69 1.20 0.00 0.00 173.24 173.74 1rk2 s VAL 233 N 1.37 3.02 -1.29 4.45 1.01 -0.92 -0.26 120.40 127.78 1rk2 s VAL 233 Ca -0.05 -1.54 -0.19 0.00 0.00 0.00 0.00 61.98 60.20 1rk2 s VAL 233 Cb -0.13 -2.82 0.02 0.00 0.00 0.00 0.00 36.38 33.45 1rk2 s VAL 233 CO -0.03 -0.23 0.53 0.59 0.00 0.00 0.00 175.10 175.96 1rk2 n ASN 234 N 4.60 -2.77 0.00 3.32 3.02 0.68 -2.05 115.26 122.07 1rk2 n ASN 234 Ca -0.10 -1.17 0.00 0.00 -0.03 0.00 0.00 54.58 53.27 1rk2 n ASN 234 Cb 0.43 -2.33 0.00 0.00 -0.61 0.00 0.00 39.78 37.27 1rk2 n ASN 234 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1rk2 n GLY 235 N -2.07 2.99 3.41 7.41 0.00 -1.26 -4.98 105.19 110.69 1rk2 n GLY 235 Ca -0.18 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.40 1rk2 n GLY 235 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1rk2 s GLU 236 N -0.24 3.09 0.33 1.61 2.02 -0.87 -5.03 118.70 119.62 1rk2 s GLU 236 Ca 0.00 -1.10 0.09 0.00 0.02 0.00 0.00 54.97 53.98 1rk2 s GLU 236 Cb 0.00 -4.26 -0.05 0.00 0.10 0.00 0.00 34.13 29.92 1rk2 s GLU 236 CO 0.00 -1.68 0.03 0.20 0.02 0.00 0.00 175.26 173.83 1rk2 s GLY 237 N 3.65 2.01 -0.01 -1.39 0.00 -1.26 -2.16 107.32 108.17 1rk2 s GLY 237 Ca 0.17 -1.91 -0.22 0.00 0.00 0.00 0.00 44.72 42.75 1rk2 s GLY 237 CO 0.08 -1.86 0.49 -0.86 0.00 0.00 0.00 173.10 170.95 1rk2 s GLN 238 N -3.73 0.90 0.02 2.90 -2.07 0.37 -4.98 119.66 113.07 1rk2 s GLN 238 Ca 0.35 -0.05 -0.17 0.00 -1.82 0.00 0.00 55.36 53.68 1rk2 s GLN 238 Cb -0.01 0.41 -0.06 0.00 -1.09 0.00 0.00 33.01 32.26 1rk2 s GLN 238 CO 0.20 -0.28 0.47 0.50 -1.32 0.00 0.00 175.29 174.86 1rk2 s ARG 239 N -1.56 4.04 -0.29 9.60 3.52 -1.26 -1.18 118.95 131.82 1rk2 s ARG 239 Ca -0.11 0.54 0.03 0.00 -0.13 0.00 0.00 55.73 56.06 1rk2 s ARG 239 Cb -0.02 -3.24 0.08 0.00 -1.56 0.00 0.00 34.95 30.21 1rk2 s ARG 239 CO 0.05 0.65 -0.04 0.08 -0.81 0.00 0.00 175.30 175.23 1rk2 s VAL 240 N -1.02 2.16 0.55 7.11 1.01 0.20 -4.95 120.40 125.46 1rk2 s VAL 240 Ca 0.26 -1.89 -0.21 0.00 0.00 0.00 0.00 61.98 60.14 1rk2 s VAL 240 Cb -0.18 -2.41 -0.05 0.00 0.00 0.00 0.00 36.38 33.75 1rk2 s VAL 240 CO 0.15 -0.26 1.27 -2.84 0.00 0.00 0.00 175.10 173.43 1rk2 s PRO 241 N 1.04 3.18 0.00 2.72 0.02 -1.26 -1.30 135.00 139.40 1rk2 s PRO 241 Ca -0.01 2.01 0.00 0.00 0.02 0.00 0.00 61.00 63.03 1rk2 s PRO 241 Cb -0.20 -2.17 0.00 0.00 0.02 0.00 0.00 34.50 32.15 1rk2 s PRO 241 CO -0.06 -1.09 0.00 0.41 -0.33 0.00 0.00 177.00 175.93 1rk2 n GLY 242 N 0.63 0.89 3.74 0.52 0.00 -1.26 -4.85 105.19 104.85 1rk2 n GLY 242 Ca 0.11 -1.90 -0.33 0.00 0.00 0.00 0.00 46.02 43.91 1rk2 n GLY 242 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1rk2 s PHE 243 N 1.08 3.18 -0.17 1.61 0.08 -1.26 -4.92 117.98 117.58 1rk2 s PHE 243 Ca 0.00 0.14 -0.26 0.00 0.12 0.00 0.00 56.93 56.92 1rk2 s PHE 243 Cb 0.00 -1.70 -0.01 0.00 -0.57 0.00 0.00 43.02 40.74 1rk2 s PHE 243 CO 0.00 0.51 0.89 1.03 -0.10 0.00 0.00 175.22 177.55 1rk2 s ARG 244 N -1.71 4.31 -0.01 0.44 1.81 -1.26 -4.94 118.95 117.59 1rk2 s ARG 244 Ca 0.22 1.13 -0.11 0.00 -1.72 0.00 0.00 55.73 55.24 1rk2 s ARG 244 Cb -0.12 -3.58 0.01 0.00 -0.45 0.00 0.00 34.95 30.82 1rk2 s ARG 244 CO 0.13 -0.37 0.23 0.14 -0.68 0.00 0.00 175.30 174.75 1rk2 s VAL 245 N 2.26 0.07 -0.45 3.52 -7.23 -1.26 -5.10 120.40 112.20 1rk2 s VAL 245 Ca 0.41 -0.56 -0.29 0.00 -1.81 0.00 0.00 61.98 59.73 1rk2 s VAL 245 Cb -0.17 -0.52 0.02 0.00 0.56 0.00 0.00 36.38 36.28 1rk2 s VAL 245 CO 0.13 -0.31 1.20 -1.58 -0.31 0.00 0.00 175.10 174.22 1rk2 s GLN 246 N -1.30 3.71 0.52 4.82 2.00 -1.26 -4.99 119.66 123.17 1rk2 s GLN 246 Ca -0.14 0.68 -0.19 0.00 -2.00 0.00 0.00 55.36 53.71 1rk2 s GLN 246 Cb -0.06 -3.92 -0.07 0.00 0.80 0.00 0.00 33.01 29.75 1rk2 s GLN 246 CO 0.03 -1.39 1.05 0.00 -0.50 0.00 0.00 175.29 174.48 1rk2 s ALA 247 N 4.62 2.82 0.00 1.58 0.00 -1.26 -4.66 121.76 124.86 1rk2 s ALA 247 Ca 0.51 0.58 0.00 0.00 0.00 0.00 0.00 51.96 53.05 1rk2 s ALA 247 Cb -0.09 -3.26 0.00 0.00 0.00 0.00 0.00 23.12 19.77 1rk2 s ALA 247 CO 0.31 -0.47 0.00 1.33 0.00 0.00 0.00 175.76 176.93 1rk2 n VAL 248 N -1.23 0.00 -3.50 0.00 0.24 -0.24 -4.73 118.33 108.86 1rk2 n VAL 248 Ca 0.09 0.00 -0.02 0.00 -2.04 0.00 0.00 64.34 62.37 1rk2 n VAL 248 Cb 0.52 -0.57 -0.05 0.00 -1.47 0.00 0.00 33.84 32.27 1rk2 n VAL 248 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1rk2 s ASP 249 N -3.10 -0.90 -0.16 -1.34 -1.08 -0.98 -3.92 116.67 105.18 1rk2 s ASP 249 Ca 0.00 1.17 0.17 0.00 -0.52 0.00 0.00 52.55 53.36 1rk2 s ASP 249 Cb 0.00 1.97 0.75 0.00 -1.46 0.00 0.00 42.92 44.18 1rk2 s ASP 249 CO 0.00 -0.24 1.67 0.35 0.52 0.00 0.00 175.17 177.47 1rk2 n THR 250 N 5.43 2.21 -2.08 1.71 -2.24 -0.93 -4.14 114.28 114.24 1rk2 n THR 250 Ca -0.08 -1.31 -0.42 0.00 -2.27 0.00 0.00 64.05 59.97 1rk2 n THR 250 Cb 0.50 -0.04 -0.03 0.00 -2.10 0.00 0.00 70.33 68.66 1rk2 n THR 250 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1rk2 s ILE 251 N -2.24 2.89 -0.02 2.28 1.01 -1.26 -2.06 121.20 121.80 1rk2 s ILE 251 Ca 0.52 0.72 0.00 0.00 0.00 0.00 0.00 60.65 61.89 1rk2 s ILE 251 Cb 0.36 -3.46 0.00 0.00 0.01 0.00 0.00 42.46 39.37 1rk2 s ILE 251 CO 0.21 0.10 0.00 0.00 0.00 0.00 0.00 174.94 175.24 1rk2 n ALA 252 N 2.82 -0.00 -0.01 9.38 0.00 -1.26 -4.63 120.51 126.81 1rk2 n ALA 252 Ca 0.08 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.40 1rk2 n ALA 252 Cb 0.41 -0.40 -0.07 0.00 0.00 0.00 0.00 19.45 19.38 1rk2 n ALA 252 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1rk2 h ALA 253 N 0.00 0.08 -0.52 0.00 0.00 -1.76 -0.91 119.26 116.15 1rk2 h ALA 253 Ca -0.00 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.71 1rk2 h ALA 253 Cb 0.26 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1rk2 h ALA 253 CO 0.01 -0.28 0.10 0.78 0.00 0.00 0.00 179.25 179.86 1rk2 h GLY 254 N -0.14 0.91 0.88 0.00 0.00 -1.90 -1.80 103.07 101.01 1rk2 h GLY 254 Ca 0.02 -0.59 0.03 0.00 0.00 0.00 0.00 47.33 46.79 1rk2 h GLY 254 CO 0.00 0.55 0.57 -0.55 0.00 0.00 0.00 176.54 177.11 1rk2 h ASP 255 N 0.73 0.95 -0.59 0.19 3.32 -1.92 -0.77 116.42 118.32 1rk2 h ASP 255 Ca 0.16 -0.01 -0.10 0.00 0.02 0.00 0.00 57.03 57.10 1rk2 h ASP 255 Cb 0.37 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.68 1rk2 h ASP 255 CO 0.01 0.65 -0.02 0.74 -1.72 0.00 0.00 179.24 178.90 1rk2 h THR 256 N 1.11 1.27 -0.19 0.35 2.02 -0.93 -2.03 112.91 114.50 1rk2 h THR 256 Ca 0.35 -1.17 0.03 0.00 0.77 0.00 0.00 66.41 66.39 1rk2 h THR 256 Cb 0.00 0.82 -0.03 0.00 -1.74 0.00 0.00 68.15 67.20 1rk2 h THR 256 CO -0.12 0.42 0.01 0.15 0.37 0.00 0.00 175.52 176.35 1rk2 h PHE 257 N 0.96 0.00 -0.12 3.16 3.57 -0.46 -1.28 116.94 122.77 1rk2 h PHE 257 Ca 0.17 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.68 1rk2 h PHE 257 Cb 0.57 0.03 -0.01 0.00 2.79 0.00 0.00 35.95 39.34 1rk2 h PHE 257 CO 0.04 -0.02 0.06 -0.91 -2.23 0.00 0.00 178.31 175.25 1rk2 h ASN 258 N 0.07 0.16 -0.32 0.41 4.21 -1.00 0.57 115.58 119.69 1rk2 h ASN 258 Ca 0.09 -0.11 -0.00 0.00 1.21 0.00 0.00 56.30 57.49 1rk2 h ASN 258 Cb 0.11 -0.04 -0.02 0.00 -1.12 0.00 0.00 38.32 37.25 1rk2 h ASN 258 CO -0.15 0.22 0.19 1.23 -1.29 0.00 0.00 177.43 177.63 1rk2 h GLY 259 N 0.09 0.46 1.36 2.83 0.00 -1.24 -2.30 103.07 104.26 1rk2 h GLY 259 Ca 0.04 -0.19 -0.10 0.00 0.00 0.00 0.00 47.33 47.08 1rk2 h GLY 259 CO -0.01 0.18 -0.17 0.00 0.00 0.00 0.00 176.54 176.54 1rk2 h ALA 260 N 1.08 0.95 0.35 3.60 0.00 -1.20 -2.75 119.26 121.30 1rk2 h ALA 260 Ca 0.11 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 1rk2 h ALA 260 Cb 0.01 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1rk2 h ALA 260 CO -0.02 0.61 -0.23 1.25 0.00 0.00 0.00 179.25 180.85 1rk2 h LEU 261 N 0.66 -0.59 -1.42 0.00 5.85 -0.63 -1.92 115.31 117.27 1rk2 h LEU 261 Ca 0.10 0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.84 1rk2 h LEU 261 Cb 0.66 0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.85 1rk2 h LEU 261 CO 0.05 -0.37 0.13 0.40 -0.34 0.00 0.00 178.44 178.32 1rk2 h ILE 262 N -0.57 1.15 -0.41 4.05 1.08 -1.41 -0.43 117.51 120.97 1rk2 h ILE 262 Ca -0.03 -0.49 -0.01 0.00 -0.39 0.00 0.00 64.86 63.94 1rk2 h ILE 262 Cb 0.48 0.73 -0.02 0.00 -3.07 0.00 0.00 36.82 34.94 1rk2 h ILE 262 CO 0.02 0.18 0.21 0.74 -0.69 0.00 0.00 178.15 178.62 1rk2 h THR 263 N 0.53 1.17 -0.56 -0.27 2.02 -1.26 -0.70 112.91 113.83 1rk2 h THR 263 Ca 0.13 -0.45 -0.09 0.00 0.77 0.00 0.00 66.41 66.77 1rk2 h THR 263 Cb 0.13 0.72 -0.02 0.00 -1.74 0.00 0.00 68.15 67.24 1rk2 h THR 263 CO -0.01 0.18 0.01 0.00 0.37 0.00 0.00 175.52 176.07 1rk2 h ALA 264 N 1.06 0.76 -0.52 6.16 0.00 -0.53 -2.47 119.26 123.71 1rk2 h ALA 264 Ca 0.14 -0.29 -0.09 0.00 0.00 0.00 0.00 54.91 54.67 1rk2 h ALA 264 Cb 0.09 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1rk2 h ALA 264 CO -0.02 0.57 -0.04 -0.07 0.00 0.00 0.00 179.25 179.69 1rk2 h LEU 265 N 0.87 0.90 -1.08 0.00 3.38 -0.94 -2.10 115.31 116.33 1rk2 h LEU 265 Ca 0.16 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 57.88 1rk2 h LEU 265 Cb 0.52 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.03 1rk2 h LEU 265 CO 0.03 0.98 0.00 -0.07 0.09 0.00 0.00 178.44 179.47 1rk2 h LEU 266 N 0.84 0.00 -1.73 1.67 3.38 -0.93 -0.19 115.31 118.34 1rk2 h LEU 266 Ca 0.15 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.12 1rk2 h LEU 266 Cb 0.55 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.30 1rk2 h LEU 266 CO 0.03 0.00 0.00 -0.62 0.09 0.00 0.00 178.44 177.94 1rk2 n GLU 267 N -2.63 2.21 -2.12 1.13 1.02 -0.90 -3.89 120.64 115.46 1rk2 n GLU 267 Ca 0.01 -1.59 -0.15 0.00 -0.02 0.00 0.00 57.16 55.42 1rk2 n GLU 267 Cb 0.26 -1.44 -0.02 0.00 -0.02 0.00 0.00 31.44 30.22 1rk2 n GLU 267 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1rk2 n GLU 268 N 0.68 -1.16 -2.85 3.49 1.02 -0.08 -5.00 120.64 116.73 1rk2 n GLU 268 Ca 0.15 0.78 -0.40 0.00 -0.02 0.00 0.00 57.16 57.66 1rk2 n GLU 268 Cb 0.44 -5.07 -0.05 0.00 -0.02 0.00 0.00 31.44 26.73 1rk2 n GLU 268 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1rk2 s LYS 269 N -4.46 4.62 0.69 3.49 1.02 -0.84 -5.00 119.74 119.25 1rk2 s LYS 269 Ca 0.00 1.27 -0.17 0.00 0.02 0.00 0.00 55.97 57.10 1rk2 s LYS 269 Cb 0.00 -3.35 -0.01 0.00 -0.52 0.00 0.00 37.83 33.95 1rk2 s LYS 269 CO 0.00 0.29 1.00 -0.35 -0.92 0.00 0.00 175.35 175.37 1rk2 n PRO 270 N 2.60 0.66 -0.29 -1.68 -0.04 -1.26 -4.52 135.00 130.47 1rk2 n PRO 270 Ca -0.01 0.28 -0.01 0.00 -0.04 0.00 0.00 63.50 63.72 1rk2 n PRO 270 Cb 0.49 -2.24 0.05 0.00 -0.04 0.00 0.00 33.50 31.76 1rk2 n PRO 270 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1rk2 h LEU 271 N -0.01 -1.12 -0.27 1.53 5.85 -1.97 0.28 115.31 119.60 1rk2 h LEU 271 Ca -0.48 0.26 0.05 0.00 0.84 0.00 0.00 57.88 58.55 1rk2 h LEU 271 Cb 1.34 0.61 -0.05 0.00 0.37 0.00 0.00 40.66 42.94 1rk2 h LEU 271 CO 0.48 -0.29 -0.03 -0.65 -0.34 0.00 0.00 178.44 177.62 1rk2 h PRO 272 N -0.06 0.05 -0.57 5.25 0.11 -1.99 0.61 132.00 135.40 1rk2 h PRO 272 Ca 0.33 -0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.40 1rk2 h PRO 272 Cb 0.59 -0.01 -0.03 0.00 0.11 0.00 0.00 31.00 31.66 1rk2 h PRO 272 CO -0.84 0.03 0.23 1.49 -0.21 0.00 0.00 178.00 178.69 1rk2 h GLU 273 N 0.05 0.86 -0.78 1.05 4.81 -1.71 -1.71 114.58 117.15 1rk2 h GLU 273 Ca 0.13 -0.16 0.04 0.00 -0.13 0.00 0.00 59.36 59.24 1rk2 h GLU 273 Cb 0.18 -0.14 -0.05 0.00 0.63 0.00 0.00 28.75 29.38 1rk2 h GLU 273 CO -0.24 0.74 0.49 0.00 -0.73 0.00 0.00 179.01 179.27 1rk2 h ALA 274 N 1.07 1.03 -0.27 2.92 0.00 -0.30 0.06 119.26 123.77 1rk2 h ALA 274 Ca 0.19 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 55.00 1rk2 h ALA 274 Cb 0.21 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1rk2 h ALA 274 CO -0.01 0.29 -0.14 0.82 0.00 0.00 0.00 179.25 180.20 1rk2 h ILE 275 N 0.95 1.23 -0.42 0.00 2.04 -0.57 -0.58 117.51 120.16 1rk2 h ILE 275 Ca 0.32 -1.03 -0.15 0.00 1.00 0.00 0.00 64.86 65.00 1rk2 h ILE 275 Cb 0.04 1.18 -0.01 0.00 -0.74 0.00 0.00 36.82 37.29 1rk2 h ILE 275 CO -0.12 0.34 -0.31 -0.09 0.00 0.00 0.00 178.15 177.96 1rk2 h ARG 276 N 0.43 0.94 -0.52 2.37 2.43 -0.31 0.19 114.38 119.90 1rk2 h ARG 276 Ca 0.08 -0.45 0.01 0.00 -0.81 0.00 0.00 59.98 58.81 1rk2 h ARG 276 Cb 0.51 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.02 1rk2 h ARG 276 CO 0.03 1.11 0.33 0.35 -1.51 0.00 0.00 179.97 180.28 1rk2 h PHE 277 N 0.79 0.62 -0.54 2.20 3.57 -0.59 -1.35 116.94 121.65 1rk2 h PHE 277 Ca 0.08 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.55 1rk2 h PHE 277 Cb 0.89 -0.21 -0.02 0.00 2.79 0.00 0.00 35.95 39.40 1rk2 h PHE 277 CO 0.06 0.38 0.14 0.00 -2.23 0.00 0.00 178.31 176.65 1rk2 h ALA 278 N 1.21 0.71 -0.90 2.41 0.00 -0.72 -2.49 119.26 119.49 1rk2 h ALA 278 Ca 0.20 -0.21 0.01 0.00 0.00 0.00 0.00 54.91 54.91 1rk2 h ALA 278 Cb -0.03 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.51 1rk2 h ALA 278 CO -0.07 0.40 0.59 0.45 0.00 0.00 0.00 179.25 180.62 1rk2 h HIS 279 N 0.76 1.14 -0.00 0.00 3.86 -0.17 -1.07 115.15 119.67 1rk2 h HIS 279 Ca 0.17 0.02 -0.00 0.00 -1.16 0.00 0.00 60.37 59.40 1rk2 h HIS 279 Cb 0.32 -0.38 -0.00 0.00 1.06 0.00 0.00 27.41 28.41 1rk2 h HIS 279 CO 0.02 0.73 0.00 0.00 0.86 0.00 0.00 177.93 179.54 1rk2 h ALA 280 N 1.42 0.00 -0.66 2.45 0.00 -1.02 0.16 119.26 121.62 1rk2 h ALA 280 Ca 0.33 -0.08 0.02 0.00 0.00 0.00 0.00 54.91 55.17 1rk2 h ALA 280 Cb -0.12 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.63 1rk2 h ALA 280 CO -0.07 -0.42 0.42 0.00 0.00 0.00 0.00 179.25 179.19 1rk2 h ALA 281 N 0.84 0.84 -0.55 0.00 0.00 -1.21 -1.89 119.26 117.30 1rk2 h ALA 281 Ca 0.00 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.76 1rk2 h ALA 281 Cb 0.16 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1rk2 h ALA 281 CO -0.00 0.22 -0.09 0.00 0.00 0.00 0.00 179.25 179.38 1rk2 h ALA 282 N 1.26 0.79 -0.18 0.00 0.00 -1.04 -1.45 119.26 118.63 1rk2 h ALA 282 Ca 0.25 -0.35 0.01 0.00 0.00 0.00 0.00 54.91 54.83 1rk2 h ALA 282 Cb -0.05 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 1rk2 h ALA 282 CO -0.07 0.67 0.09 0.00 0.00 0.00 0.00 179.25 179.94 1rk2 h ALA 283 N 0.96 0.22 -0.80 0.00 0.00 -0.33 -0.53 119.26 118.78 1rk2 h ALA 283 Ca 0.15 0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.07 1rk2 h ALA 283 Cb 0.66 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.37 1rk2 h ALA 283 CO 0.05 -0.33 0.53 0.82 0.00 0.00 0.00 179.25 180.31 1rk2 h ILE 284 N 0.20 1.21 -0.94 0.00 2.04 -1.23 -2.54 117.51 116.24 1rk2 h ILE 284 Ca 0.07 -0.39 0.02 0.00 1.00 0.00 0.00 64.86 65.57 1rk2 h ILE 284 Cb 0.01 0.03 -0.05 0.00 -0.74 0.00 0.00 36.82 36.08 1rk2 h ILE 284 CO -0.05 0.20 0.62 0.00 0.00 0.00 0.00 178.15 178.92 1rk2 h ALA 285 N 1.29 1.21 0.00 1.87 0.00 -0.55 -1.92 119.26 121.16 1rk2 h ALA 285 Ca 0.29 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1rk2 h ALA 285 Cb -0.12 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 17.31 1rk2 h ALA 285 CO -0.06 0.55 0.00 1.33 0.00 0.00 0.00 179.25 181.06 1rk2 n VAL 286 N -4.45 0.88 0.23 0.00 0.24 -0.27 -1.92 118.33 113.03 1rk2 n VAL 286 Ca 0.11 0.25 0.08 0.00 -2.04 0.00 0.00 64.34 62.74 1rk2 n VAL 286 Cb 0.04 -1.16 0.24 0.00 -1.47 0.00 0.00 33.84 31.49 1rk2 n VAL 286 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 1rk2 n THR 287 N -2.11 0.94 -4.37 3.34 -2.24 -0.72 -1.08 114.28 108.03 1rk2 n THR 287 Ca 0.02 -0.74 -0.19 0.00 -2.27 0.00 0.00 64.05 60.87 1rk2 n THR 287 Cb 0.21 0.20 -0.10 0.00 -2.10 0.00 0.00 70.33 68.54 1rk2 n THR 287 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1rk2 s ARG 288 N -1.50 1.42 0.04 -0.78 0.52 -0.81 -4.78 118.95 113.06 1rk2 s ARG 288 Ca 0.35 -1.72 -0.04 0.00 -0.52 0.00 0.00 55.73 53.79 1rk2 s ARG 288 Cb 0.20 -0.81 -0.05 0.00 0.52 0.00 0.00 34.95 34.82 1rk2 s ARG 288 CO 0.21 -0.06 0.26 0.15 0.02 0.00 0.00 175.30 175.89 1rk2 s LYS 289 N -3.82 3.54 0.00 3.54 1.02 -1.26 -3.88 119.74 118.87 1rk2 s LYS 289 Ca 0.29 -0.19 0.00 0.00 0.02 0.00 0.00 55.97 56.09 1rk2 s LYS 289 Cb 0.05 -3.03 0.00 0.00 -0.52 0.00 0.00 37.83 34.33 1rk2 s LYS 289 CO 0.10 0.61 0.00 0.41 -0.92 0.00 0.00 175.35 175.55 1rk2 n GLY 290 N 0.73 -1.67 0.00 -3.33 0.00 -1.26 -3.70 105.19 95.95 1rk2 n GLY 290 Ca -0.08 -1.55 0.00 0.00 0.00 0.00 0.00 46.02 44.39 1rk2 n GLY 290 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rk2 n ALA 291 N -1.87 0.00 -0.11 4.61 0.00 -1.26 -3.76 120.51 118.12 1rk2 n ALA 291 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.45 1rk2 n ALA 291 Cb 0.00 0.00 0.29 0.00 0.00 0.00 0.00 19.45 19.74 1rk2 n ALA 291 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1rk2 h GLN 292 N 0.00 0.77 0.00 0.00 4.20 -1.87 -2.23 115.11 115.98 1rk2 h GLN 292 Ca 0.00 -0.08 -0.01 0.00 0.06 0.00 0.00 58.65 58.61 1rk2 h GLN 292 Cb 0.00 -0.16 -0.00 0.00 0.30 0.00 0.00 27.48 27.62 1rk2 h GLN 292 CO 0.00 0.58 -0.07 -1.35 -0.67 0.00 0.00 178.83 177.32 1rk2 h PRO 293 N 0.78 0.00 -0.00 1.46 0.11 -1.80 -2.29 132.00 130.26 1rk2 h PRO 293 Ca 0.20 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.31 1rk2 h PRO 293 Cb 0.04 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.15 1rk2 h PRO 293 CO -0.03 0.07 -0.27 -1.13 -0.21 0.00 0.00 178.00 176.42 1rk2 n SER 294 N -3.69 0.48 -4.65 -2.05 3.41 -0.84 -4.85 113.62 101.42 1rk2 n SER 294 Ca -0.02 -0.28 -0.43 0.00 -0.26 0.00 0.00 58.87 57.88 1rk2 n SER 294 Cb 0.17 0.01 -0.02 0.00 -0.26 0.00 0.00 64.21 64.10 1rk2 n SER 294 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1rk2 s VAL 295 N -2.80 4.02 0.63 -3.33 1.01 -0.86 -4.00 120.40 115.07 1rk2 s VAL 295 Ca 0.18 1.21 -0.15 0.00 0.00 0.00 0.00 61.98 63.23 1rk2 s VAL 295 Cb 0.19 -3.85 -0.02 0.00 0.00 0.00 0.00 36.38 32.70 1rk2 s VAL 295 CO 0.59 -0.18 1.07 -2.16 0.00 0.00 0.00 175.10 174.41 1rk2 s PRO 296 N 3.87 3.09 0.42 2.72 0.04 -1.26 -5.02 135.00 138.86 1rk2 s PRO 296 Ca 0.62 1.21 0.01 0.00 0.04 0.00 0.00 61.00 62.87 1rk2 s PRO 296 Cb -0.24 -2.00 -0.01 0.00 0.04 0.00 0.00 34.50 32.29 1rk2 s PRO 296 CO 0.21 -0.99 0.63 -1.58 0.04 0.00 0.00 177.00 175.31 1rk2 s TRP 297 N -2.54 3.27 0.19 0.56 0.52 -1.26 -4.36 118.94 115.32 1rk2 s TRP 297 Ca 0.63 0.22 -0.13 0.00 0.02 0.00 0.00 56.10 56.84 1rk2 s TRP 297 Cb -0.17 -2.20 0.19 0.00 -1.15 0.00 0.00 33.47 30.14 1rk2 s TRP 297 CO 0.42 -0.23 1.71 -0.09 0.02 0.00 0.00 176.95 178.78 1rk2 h ARG 298 N 0.51 0.21 -0.84 4.98 9.65 -1.10 -0.31 114.38 127.48 1rk2 h ARG 298 Ca -0.47 -0.01 0.07 0.00 -1.10 0.00 0.00 59.98 58.47 1rk2 h ARG 298 Cb 1.25 -0.05 -0.06 0.00 -1.39 0.00 0.00 29.97 29.71 1rk2 h ARG 298 CO 0.58 0.14 0.51 0.93 2.80 0.00 0.00 179.97 184.93 1rk2 h GLU 299 N 0.21 0.89 -0.45 0.20 3.07 -1.94 0.07 114.58 116.62 1rk2 h GLU 299 Ca 0.25 -0.05 -0.06 0.00 -0.50 0.00 0.00 59.36 59.00 1rk2 h GLU 299 Cb 0.34 -0.20 -0.02 0.00 -0.84 0.00 0.00 28.75 28.04 1rk2 h GLU 299 CO -0.34 0.59 0.06 0.93 -1.40 0.00 0.00 179.01 178.84 1rk2 h GLU 300 N 0.91 0.76 -0.07 2.33 5.08 -1.66 -0.91 114.58 121.02 1rk2 h GLU 300 Ca 0.38 -0.21 -0.00 0.00 -1.00 0.00 0.00 59.36 58.53 1rk2 h GLU 300 Cb 0.23 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.39 1rk2 h GLU 300 CO -0.19 0.79 0.04 0.82 -1.00 0.00 0.00 179.01 179.47 1rk2 h ILE 301 N 0.62 1.07 -0.72 3.13 2.04 -0.19 -0.54 117.51 122.92 1rk2 h ILE 301 Ca 0.14 -0.20 -0.03 0.00 1.00 0.00 0.00 64.86 65.76 1rk2 h ILE 301 Cb 0.41 1.08 -0.03 0.00 -0.74 0.00 0.00 36.82 37.53 1rk2 h ILE 301 CO 0.01 0.06 0.32 0.44 0.00 0.00 0.00 178.15 178.99 1rk2 h ASP 302 N 0.04 0.96 0.05 1.72 3.32 -0.98 -0.42 116.42 121.11 1rk2 h ASP 302 Ca 0.03 -0.15 0.02 0.00 0.02 0.00 0.00 57.03 56.95 1rk2 h ASP 302 Cb 0.07 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.34 1rk2 h ASP 302 CO -0.00 0.84 -0.20 0.00 -1.72 0.00 0.00 179.24 178.16 1rk2 h ALA 303 N 1.16 -0.29 -0.89 3.45 0.00 -0.90 0.19 119.26 121.98 1rk2 h ALA 303 Ca 0.24 -0.01 0.09 0.00 0.00 0.00 0.00 54.91 55.23 1rk2 h ALA 303 Cb 0.15 0.33 -0.07 0.00 0.00 0.00 0.00 17.79 18.21 1rk2 h ALA 303 CO -0.03 -0.71 0.54 0.35 0.00 0.00 0.00 179.25 179.40 1rk2 h PHE 304 N -0.34 0.98 0.30 0.00 3.04 -0.82 -3.18 116.94 116.91 1rk2 h PHE 304 Ca 0.04 0.03 -0.01 0.00 3.98 0.00 0.00 57.97 62.01 1rk2 h PHE 304 Cb 0.40 -0.31 0.00 0.00 2.56 0.00 0.00 35.95 38.60 1rk2 h PHE 304 CO -0.22 0.44 -0.14 -0.07 -2.02 0.00 0.00 178.31 176.30 1rk2 h LEU 305 N 0.92 -0.34 0.00 0.59 3.38 0.13 -3.09 115.31 116.90 1rk2 h LEU 305 Ca 0.41 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 58.19 1rk2 h LEU 305 Cb 0.31 0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.15 1rk2 h LEU 305 CO -0.22 0.05 0.15 0.47 0.09 0.00 0.00 178.44 178.97 1rk2 n ASP 306 N -5.11 0.00 -0.03 -0.43 8.00 0.55 0.16 116.55 119.69 1rk2 n ASP 306 Ca -0.09 0.12 0.04 0.00 0.71 0.00 0.00 54.79 55.57 1rk2 n ASP 306 Cb 0.26 -0.12 -0.13 0.00 -0.02 0.00 0.00 41.12 41.11 1rk2 n ASP 306 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1rk2 n ARG 307 N -0.99 0.75 0.01 -1.24 1.74 -1.17 -4.53 116.66 111.23 1rk2 n ARG 307 Ca 0.00 -0.12 0.11 0.00 -0.77 0.00 0.00 57.85 57.07 1rk2 n ARG 307 Cb 0.15 -1.41 0.05 0.00 -1.02 0.00 0.00 32.46 30.22 1rk2 n ARG 307 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 1rk2 n GLN 308 N -2.24 0.15 0.00 5.56 1.13 0.41 -5.16 117.38 117.23 1rk2 n GLN 308 Ca -0.09 -0.01 0.00 0.00 -1.94 0.00 0.00 57.00 54.96 1rk2 n GLN 308 Cb 0.61 -1.54 0.00 0.00 0.11 0.00 0.00 30.24 29.41 1rk2 n GLN 308 CO 0.00 0.00 0.00 2.89 -1.44 0.00 0.00 177.06 178.51