#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qni s HIS 11 N 0.00 1.92 -0.24 0.00 0.09 -1.26 -4.62 115.29 111.18 1qni s HIS 11 Ca 0.00 -0.45 0.02 0.00 -0.00 0.00 0.00 55.06 54.63 1qni s HIS 11 Cb 0.00 -1.25 0.05 0.00 -0.00 0.00 0.00 32.58 31.38 1qni s HIS 11 CO 0.00 -0.10 -0.10 0.08 -0.00 0.00 0.00 174.74 174.62 1qni s VAL 12 N -0.30 1.90 0.51 -0.90 1.01 -1.26 -5.00 120.40 116.36 1qni s VAL 12 Ca 0.03 -1.36 -0.10 0.00 0.00 0.00 0.00 61.98 60.55 1qni s VAL 12 Cb -0.10 -2.02 -0.05 0.00 0.00 0.00 0.00 36.38 34.21 1qni s VAL 12 CO 0.01 0.04 0.89 0.00 0.00 0.00 0.00 175.10 176.03 1qni s ALA 13 N 1.24 3.24 0.09 5.51 0.00 -1.26 -4.94 121.76 125.65 1qni s ALA 13 Ca -0.06 -0.20 -0.36 0.00 0.00 0.00 0.00 51.96 51.35 1qni s ALA 13 Cb -0.18 -2.85 -0.15 0.00 0.00 0.00 0.00 23.12 19.93 1qni s ALA 13 CO -0.07 -0.36 1.47 -2.30 0.00 0.00 0.00 175.76 174.50 1qni n PRO 14 N -2.09 1.57 0.00 0.00 -0.02 -1.26 -0.78 135.00 132.41 1qni n PRO 14 Ca 0.04 0.57 0.00 0.00 -2.02 0.00 0.00 63.50 62.08 1qni n PRO 14 Cb 0.54 -2.27 0.00 0.00 -0.02 0.00 0.00 33.50 31.76 1qni n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1qni n GLY 15 N 3.01 3.16 3.93 -1.23 0.00 -1.26 -5.05 105.19 107.74 1qni n GLY 15 Ca 0.18 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.95 1qni n GLY 15 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1qni s GLU 16 N -0.44 2.96 0.17 1.61 2.02 0.04 -5.10 118.70 119.96 1qni s GLU 16 Ca 0.00 -0.19 0.11 0.00 0.02 0.00 0.00 54.97 54.91 1qni s GLU 16 Cb 0.00 -2.38 -0.04 0.00 0.10 0.00 0.00 34.13 31.81 1qni s GLU 16 CO 0.00 -0.55 -0.25 -0.51 0.02 0.00 0.00 175.26 173.97 1qni s LEU 17 N -4.84 2.41 1.06 1.80 1.43 -1.26 -4.80 118.68 114.48 1qni s LEU 17 Ca 0.52 -0.83 -0.12 0.00 -1.03 0.00 0.00 54.13 52.67 1qni s LEU 17 Cb -0.10 -1.19 0.23 0.00 0.03 0.00 0.00 46.19 45.15 1qni s LEU 17 CO 0.42 0.14 1.07 -1.81 0.23 0.00 0.00 176.35 176.40 1qni s ASP 18 N -2.49 1.96 -0.19 2.29 1.11 -1.26 -4.99 116.67 113.10 1qni s ASP 18 Ca 0.19 1.37 0.14 0.00 0.18 0.00 0.00 52.55 54.43 1qni s ASP 18 Cb -0.09 -2.08 -0.22 0.00 1.07 0.00 0.00 42.92 41.61 1qni s ASP 18 CO 0.09 -3.57 0.03 -0.62 1.18 0.00 0.00 175.17 172.27 1qni n GLU 19 N -4.49 0.94 -4.29 8.23 1.02 -0.47 -4.93 120.64 116.66 1qni n GLU 19 Ca 0.04 0.01 -0.23 0.00 -0.02 0.00 0.00 57.16 56.96 1qni n GLU 19 Cb 0.56 -1.47 -0.12 0.00 -0.02 0.00 0.00 31.44 30.38 1qni n GLU 19 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 1qni s TYR 20 N -2.45 1.77 0.06 -0.32 1.51 -0.91 -0.80 117.35 116.21 1qni s TYR 20 Ca -0.12 -0.43 -0.12 0.00 -1.01 0.00 0.00 57.07 55.39 1qni s TYR 20 Cb 0.06 -0.96 -0.06 0.00 -0.11 0.00 0.00 41.96 40.89 1qni s TYR 20 CO 0.73 0.22 0.43 0.71 -1.11 0.00 0.00 175.55 176.52 1qni s TYR 21 N -1.30 3.64 -0.19 2.71 1.51 0.08 -0.75 117.35 123.05 1qni s TYR 21 Ca 0.07 0.91 0.01 0.00 -1.01 0.00 0.00 57.07 57.06 1qni s TYR 21 Cb -0.09 -2.24 0.02 0.00 -0.11 0.00 0.00 41.96 39.53 1qni s TYR 21 CO 0.04 0.55 -0.19 0.20 -1.11 0.00 0.00 175.55 175.05 1qni s GLY 22 N -1.49 1.41 -0.53 0.71 0.00 0.39 -2.00 107.32 105.81 1qni s GLY 22 Ca 0.30 -1.25 -0.13 0.00 0.00 0.00 0.00 44.72 43.64 1qni s GLY 22 CO 0.16 0.30 0.45 -1.36 0.00 0.00 0.00 173.10 172.66 1qni s PHE 23 N 1.29 3.34 0.05 1.90 0.08 -0.39 0.61 117.98 124.86 1qni s PHE 23 Ca 0.04 -1.57 -0.20 0.00 0.12 0.00 0.00 56.93 55.32 1qni s PHE 23 Cb -0.13 -3.68 -0.06 0.00 -0.57 0.00 0.00 43.02 38.58 1qni s PHE 23 CO -0.12 -1.01 0.59 -1.58 -0.10 0.00 0.00 175.22 173.00 1qni s TRP 24 N 1.43 3.76 0.50 0.36 0.51 0.26 -2.06 118.94 123.70 1qni s TRP 24 Ca 0.05 1.27 -0.19 0.00 -2.12 0.00 0.00 56.10 55.11 1qni s TRP 24 Cb -0.28 -2.56 -0.08 0.00 -0.81 0.00 0.00 33.47 29.74 1qni s TRP 24 CO 0.01 0.48 1.01 -1.54 -0.51 0.00 0.00 176.95 176.40 1qni s SER 25 N -0.71 6.42 0.00 2.95 1.04 -0.97 -0.34 113.70 122.09 1qni s SER 25 Ca 0.30 1.78 0.24 0.00 0.48 0.00 0.00 55.95 58.75 1qni s SER 25 Cb -0.19 -2.54 0.23 0.00 0.10 0.00 0.00 66.02 63.62 1qni s SER 25 CO 0.19 -0.72 1.28 0.61 0.98 0.00 0.00 173.24 175.58 1qni n GLY 26 N -0.77 1.08 7.00 7.32 0.00 -0.45 -4.27 105.19 115.11 1qni n GLY 26 Ca 0.08 -0.69 0.00 0.00 0.00 0.00 0.00 46.02 45.41 1qni n GLY 26 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1qni n GLY 27 N 1.37 1.97 0.00 -0.02 0.00 0.65 -1.95 105.19 107.20 1qni n GLY 27 Ca 0.15 -0.53 0.04 0.00 0.00 0.00 0.00 46.02 45.67 1qni n GLY 27 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1qni n HIS 28 N 8.64 0.00 0.11 1.61 1.44 -1.26 -1.38 115.22 124.38 1qni n HIS 28 Ca 0.00 0.00 -0.02 0.00 -2.01 0.00 0.00 57.72 55.69 1qni n HIS 28 Cb 0.00 0.00 -0.04 0.00 0.12 0.00 0.00 29.99 30.07 1qni n HIS 28 CO 0.00 0.00 0.00 0.37 -2.81 0.00 0.00 176.34 173.90 1qni h GLN 29 N 0.00 0.00 0.00 -1.40 -0.00 -1.56 -3.41 115.11 108.74 1qni h GLN 29 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 1qni h GLN 29 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27.48 27.48 1qni h GLN 29 CO 0.00 0.71 0.00 0.41 0.00 0.00 0.00 178.83 179.95 1qni n GLY 30 N 1.28 3.02 4.02 2.39 0.00 -0.80 -4.56 105.19 110.55 1qni n GLY 30 Ca 0.01 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.83 1qni n GLY 30 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1qni s GLU 31 N -0.74 2.15 -0.06 1.61 -1.05 -1.26 -2.26 118.70 117.08 1qni s GLU 31 Ca 0.00 -1.49 0.04 0.00 -0.15 0.00 0.00 54.97 53.37 1qni s GLU 31 Cb 0.00 -2.57 -0.02 0.00 -0.44 0.00 0.00 34.13 31.10 1qni s GLU 31 CO 0.00 -1.00 -0.18 0.08 0.95 0.00 0.00 175.26 175.11 1qni s VAL 32 N -2.78 2.75 -0.13 1.83 1.01 -0.42 -1.34 120.40 121.32 1qni s VAL 32 Ca 0.63 -0.82 -0.01 0.00 0.00 0.00 0.00 61.98 61.78 1qni s VAL 32 Cb -0.06 -2.07 -0.02 0.00 0.00 0.00 0.00 36.38 34.24 1qni s VAL 32 CO 0.40 0.57 -0.10 -0.13 0.00 0.00 0.00 175.10 175.84 1qni s ARG 33 N -0.41 3.36 -0.33 2.72 0.52 0.53 -0.35 118.95 125.00 1qni s ARG 33 Ca 0.04 -0.63 -0.12 0.00 -0.52 0.00 0.00 55.73 54.50 1qni s ARG 33 Cb -0.12 -2.69 -0.02 0.00 0.52 0.00 0.00 34.95 32.64 1qni s ARG 33 CO 0.02 0.28 0.22 0.08 0.02 0.00 0.00 175.30 175.92 1qni s VAL 34 N 0.20 5.14 0.26 3.52 1.01 0.53 0.90 120.40 131.97 1qni s VAL 34 Ca -0.06 -0.22 0.11 0.00 0.00 0.00 0.00 61.98 61.80 1qni s VAL 34 Cb -0.15 -3.62 -0.05 0.00 0.00 0.00 0.00 36.38 32.57 1qni s VAL 34 CO 0.04 0.03 -0.12 -0.76 0.00 0.00 0.00 175.10 174.29 1qni s LEU 35 N 1.70 2.83 -0.08 3.92 1.43 0.20 0.00 118.68 128.68 1qni s LEU 35 Ca 0.06 -0.83 -0.07 0.00 -1.03 0.00 0.00 54.13 52.26 1qni s LEU 35 Cb -0.17 -1.38 -0.04 0.00 0.03 0.00 0.00 46.19 44.62 1qni s LEU 35 CO 0.10 0.04 0.17 -0.83 0.23 0.00 0.00 176.35 176.06 1qni s GLY 36 N -3.41 2.19 0.02 -3.19 0.00 0.03 0.15 107.32 103.11 1qni s GLY 36 Ca 0.29 -0.63 0.09 0.00 0.00 0.00 0.00 44.72 44.46 1qni s GLY 36 CO 0.16 -0.40 -0.26 0.14 0.00 0.00 0.00 173.10 172.75 1qni s VAL 37 N -1.10 2.15 -2.17 1.40 1.01 0.07 0.19 120.40 121.94 1qni s VAL 37 Ca 0.19 -1.27 0.21 0.00 0.00 0.00 0.00 61.98 61.11 1qni s VAL 37 Cb -0.12 -1.81 0.52 0.00 0.00 0.00 0.00 36.38 34.97 1qni s VAL 37 CO 0.08 0.45 1.67 -0.81 0.00 0.00 0.00 175.10 176.49 1qni n PRO 38 N 2.02 1.40 0.22 2.72 -0.04 -1.26 -1.37 135.00 138.69 1qni n PRO 38 Ca -0.17 -0.60 0.06 0.00 -0.04 0.00 0.00 63.50 62.76 1qni n PRO 38 Cb 0.52 -1.37 0.54 0.00 -0.04 0.00 0.00 33.50 33.15 1qni n PRO 38 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1qni h SER 39 N 1.24 0.03 -1.05 3.54 4.64 -1.81 -3.46 113.55 116.67 1qni h SER 39 Ca 0.00 -0.00 -0.26 0.00 -0.47 0.00 0.00 61.79 61.06 1qni h SER 39 Cb 0.27 -0.01 -0.07 0.00 -0.31 0.00 0.00 62.40 62.28 1qni h SER 39 CO 0.00 0.13 -0.27 0.23 -0.87 0.00 0.00 176.83 176.05 1qni n MET 40 N -4.41 -0.94 -3.04 4.77 2.81 0.13 -5.01 117.12 111.44 1qni n MET 40 Ca -0.02 0.83 -0.30 0.00 -1.81 0.00 0.00 57.70 56.40 1qni n MET 40 Cb 0.18 -4.93 -0.03 0.00 -0.71 0.00 0.00 33.22 27.73 1qni n MET 40 CO 0.00 0.00 0.00 1.03 1.51 0.00 0.00 175.97 178.51 1qni s ARG 41 N -3.65 3.74 -0.41 0.03 0.52 -1.17 -4.82 118.95 113.20 1qni s ARG 41 Ca 0.00 0.32 -0.20 0.00 -0.52 0.00 0.00 55.73 55.33 1qni s ARG 41 Cb 0.00 -2.48 0.02 0.00 0.52 0.00 0.00 34.95 33.00 1qni s ARG 41 CO 0.00 0.07 0.63 -2.00 0.02 0.00 0.00 175.30 174.01 1qni s GLU 42 N -3.67 3.42 -0.01 3.54 2.12 -1.26 -0.79 118.70 122.05 1qni s GLU 42 Ca 0.49 -0.24 0.01 0.00 0.36 0.00 0.00 54.97 55.59 1qni s GLU 42 Cb -0.10 -3.90 -0.26 0.00 0.26 0.00 0.00 34.13 30.13 1qni s GLU 42 CO 0.30 -0.90 0.80 -0.07 -0.54 0.00 0.00 175.26 174.85 1qni h LEU 43 N 9.54 0.26 -7.00 2.70 3.38 -0.75 -3.49 115.31 119.95 1qni h LEU 43 Ca -0.26 -0.40 0.01 0.00 0.09 0.00 0.00 57.88 57.32 1qni h LEU 43 Cb 1.10 -0.08 -0.18 0.00 0.09 0.00 0.00 40.66 41.59 1qni h LEU 43 CO 0.86 1.34 0.32 -0.32 0.09 0.00 0.00 178.44 180.73 1qni s MET 44 N -2.62 0.98 -0.15 1.13 0.00 -0.83 -5.01 119.30 112.81 1qni s MET 44 Ca -0.08 -0.03 0.01 0.00 0.00 0.00 0.00 55.69 55.59 1qni s MET 44 Cb 0.07 0.46 -0.00 0.00 0.00 0.00 0.00 34.83 35.36 1qni s MET 44 CO 0.83 -0.36 -0.16 1.03 0.00 0.00 0.00 175.02 176.36 1qni s ARG 45 N -2.09 3.22 -0.44 4.11 0.52 -1.26 -0.34 118.95 122.66 1qni s ARG 45 Ca -0.04 -0.76 -0.11 0.00 -0.52 0.00 0.00 55.73 54.30 1qni s ARG 45 Cb -0.00 -2.59 0.08 0.00 0.52 0.00 0.00 34.95 32.96 1qni s ARG 45 CO -0.00 0.05 0.31 0.42 0.02 0.00 0.00 175.30 176.10 1qni s ILE 46 N 0.71 4.54 0.28 1.52 1.01 0.52 -4.97 121.20 124.82 1qni s ILE 46 Ca -0.07 -1.33 -0.29 0.00 0.00 0.00 0.00 60.65 58.96 1qni s ILE 46 Cb -0.16 -3.77 -0.10 0.00 0.01 0.00 0.00 42.46 38.44 1qni s ILE 46 CO 0.01 -0.55 1.40 -2.16 0.00 0.00 0.00 174.94 173.65 1qni s PRO 47 N 1.49 4.28 0.02 2.79 0.04 -1.26 -1.31 135.00 141.05 1qni s PRO 47 Ca 0.03 2.30 0.00 0.00 0.04 0.00 0.00 61.00 63.37 1qni s PRO 47 Cb -0.24 -3.09 0.00 0.00 0.04 0.00 0.00 34.50 31.22 1qni s PRO 47 CO 0.03 -0.36 0.00 0.28 0.04 0.00 0.00 177.00 176.99 1qni n VAL 48 N 1.71 0.07 0.60 -0.36 0.31 -1.25 -4.32 118.33 115.09 1qni n VAL 48 Ca 0.04 0.02 0.07 0.00 -0.01 0.00 0.00 64.34 64.46 1qni n VAL 48 Cb 0.41 -0.66 -0.01 0.00 -0.91 0.00 0.00 33.84 32.67 1qni n VAL 48 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 1qni n PHE 49 N -2.60 0.00 -2.62 3.52 3.72 -0.96 -4.98 117.46 113.54 1qni n PHE 49 Ca 0.00 0.00 -0.23 0.00 -0.05 0.00 0.00 57.45 57.17 1qni n PHE 49 Cb 0.00 0.00 0.10 0.00 -0.94 0.00 0.00 39.48 38.64 1qni n PHE 49 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 1qni s ASN 50 N -1.73 4.44 -0.29 4.37 6.03 -1.25 -3.80 114.94 122.71 1qni s ASN 50 Ca 0.10 -0.39 0.03 0.00 -1.03 0.00 0.00 52.86 51.58 1qni s ASN 50 Cb 0.11 -0.02 0.07 0.00 -3.03 0.00 0.00 41.25 38.38 1qni s ASN 50 CO 0.36 -1.80 -0.05 -0.69 -2.03 0.00 0.00 177.10 172.90 1qni s VAL 51 N -3.09 2.24 -0.42 3.54 1.01 -1.26 -4.70 120.40 117.71 1qni s VAL 51 Ca 0.66 -1.88 -0.27 0.00 0.00 0.00 0.00 61.98 60.49 1qni s VAL 51 Cb -0.06 -2.44 0.02 0.00 0.00 0.00 0.00 36.38 33.91 1qni s VAL 51 CO 0.44 -0.24 0.98 -0.62 0.00 0.00 0.00 175.10 175.66 1qni s ASP 52 N 1.04 6.62 0.47 3.32 2.15 -0.71 -4.93 116.67 124.62 1qni s ASP 52 Ca -0.02 0.41 0.32 0.00 0.43 0.00 0.00 52.55 53.69 1qni s ASP 52 Cb -0.20 -2.48 1.59 0.00 -0.30 0.00 0.00 42.92 41.53 1qni s ASP 52 CO -0.06 -1.02 1.96 -1.28 -0.17 0.00 0.00 175.17 174.61 1qni h SER 53 N 8.84 0.00 0.00 -0.34 0.87 -1.95 -0.75 113.55 120.22 1qni h SER 53 Ca -0.23 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.33 1qni h SER 53 Cb 1.07 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.03 1qni h SER 53 CO 1.03 0.00 -0.05 0.00 -0.53 0.00 0.00 176.83 177.28 1qni h ALA 54 N 2.05 0.00 0.00 6.23 0.00 -1.92 -3.40 119.26 122.22 1qni h ALA 54 Ca 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1qni h ALA 54 Cb 0.16 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1qni h ALA 54 CO 0.00 0.05 0.00 1.79 0.00 0.00 0.00 179.25 181.09 1qni h THR 55 N -0.12 0.00 0.00 0.00 1.35 -1.90 -3.34 112.91 108.89 1qni h THR 55 Ca 0.00 -0.42 0.00 0.00 -0.55 0.00 0.00 66.41 65.44 1qni h THR 55 Cb 0.05 1.30 0.00 0.00 -1.73 0.00 0.00 68.15 67.77 1qni h THR 55 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 1qni n GLY 56 N 0.25 0.62 3.67 5.82 0.00 -0.30 -1.91 105.19 113.34 1qni n GLY 56 Ca 0.02 -0.25 -0.42 0.00 0.00 0.00 0.00 46.02 45.37 1qni n GLY 56 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1qni s TRP 57 N -2.00 1.79 0.00 1.61 -0.11 -1.18 0.11 118.94 119.16 1qni s TRP 57 Ca 0.00 -0.05 0.00 0.00 1.22 0.00 0.00 56.10 57.27 1qni s TRP 57 Cb 0.00 -4.07 0.00 0.00 -1.50 0.00 0.00 33.47 27.90 1qni s TRP 57 CO 0.00 -4.58 0.00 0.41 -4.62 0.00 0.00 176.95 168.16 1qni n GLY 58 N 4.27 2.23 0.08 5.86 0.00 -1.26 -1.74 105.19 114.63 1qni n GLY 58 Ca 0.18 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.09 1qni n GLY 58 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1qni n ILE 59 N -1.60 0.94 -1.32 -0.61 5.41 0.12 -4.78 119.36 117.51 1qni n ILE 59 Ca 0.00 -0.38 -0.31 0.00 1.00 0.00 0.00 62.75 63.06 1qni n ILE 59 Cb 0.00 -1.05 0.08 0.00 -0.71 0.00 0.00 39.64 37.97 1qni n ILE 59 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 176.55 176.97 1qni s THR 60 N -2.33 3.45 0.21 1.39 -4.23 0.37 -4.66 115.64 109.85 1qni s THR 60 Ca -0.21 0.47 0.02 0.00 -1.18 0.00 0.00 61.69 60.80 1qni s THR 60 Cb 0.06 -3.01 -0.07 0.00 1.34 0.00 0.00 72.50 70.81 1qni s THR 60 CO 0.39 -0.62 1.50 0.78 -0.54 0.00 0.00 174.62 176.14 1qni h ASN 61 N -1.06 0.34 -0.29 3.99 -0.26 -1.82 -1.98 115.58 114.51 1qni h ASN 61 Ca -0.44 -0.21 -0.02 0.00 -0.56 0.00 0.00 56.30 55.07 1qni h ASN 61 Cb 1.23 -0.10 -0.01 0.00 -1.06 0.00 0.00 38.32 38.38 1qni h ASN 61 CO 0.53 0.91 0.09 -0.33 -1.06 0.00 0.00 177.43 177.57 1qni h GLU 62 N 0.21 0.45 -0.10 0.81 3.07 -1.90 -1.75 114.58 115.37 1qni h GLU 62 Ca -0.02 -0.10 -0.02 0.00 -0.50 0.00 0.00 59.36 58.73 1qni h GLU 62 Cb 1.20 -0.07 -0.00 0.00 -0.84 0.00 0.00 28.75 29.04 1qni h GLU 62 CO 0.11 0.51 -0.01 0.66 -1.40 0.00 0.00 179.01 178.87 1qni h SER 63 N 0.31 0.19 -0.53 1.42 4.64 -1.91 -2.73 113.55 114.95 1qni h SER 63 Ca 0.09 -0.34 0.12 0.00 -0.47 0.00 0.00 61.79 61.19 1qni h SER 63 Cb 0.24 -0.05 -0.03 0.00 -0.31 0.00 0.00 62.40 62.25 1qni h SER 63 CO -0.00 0.48 0.36 0.11 -0.87 0.00 0.00 176.83 176.91 1qni h LYS 64 N -0.11 0.19 -0.13 4.77 1.57 -1.33 0.43 116.57 121.96 1qni h LYS 64 Ca 0.03 -0.01 -0.14 0.00 -1.87 0.00 0.00 60.65 58.66 1qni h LYS 64 Cb 0.39 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.65 1qni h LYS 64 CO 0.01 0.13 -0.52 1.49 -0.57 0.00 0.00 179.45 179.98 1qni h GLU 65 N 0.19 0.38 0.04 3.15 4.81 -1.14 0.03 114.58 122.03 1qni h GLU 65 Ca 0.25 -0.23 -0.20 0.00 -0.13 0.00 0.00 59.36 59.06 1qni h GLU 65 Cb 0.72 0.02 0.02 0.00 0.63 0.00 0.00 28.75 30.14 1qni h GLU 65 CO -0.04 0.81 -0.79 0.82 -0.73 0.00 0.00 179.01 179.08 1qni h ILE 66 N 0.29 1.40 -0.91 2.32 2.04 -0.54 -3.20 117.51 118.90 1qni h ILE 66 Ca 0.01 -2.22 0.07 0.00 1.00 0.00 0.00 64.86 63.72 1qni h ILE 66 Cb 1.02 2.67 -0.06 0.00 -0.74 0.00 0.00 36.82 39.71 1qni h ILE 66 CO 0.09 0.66 0.59 -0.07 0.00 0.00 0.00 178.15 179.42 1qni h LEU 67 N -0.01 0.90 0.00 1.44 3.38 -0.16 -3.33 115.31 117.52 1qni h LEU 67 Ca -0.11 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.87 1qni h LEU 67 Cb 1.50 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 42.07 1qni h LEU 67 CO 0.15 0.57 0.00 0.61 0.09 0.00 0.00 178.44 179.86 1qni n GLY 68 N -1.39 1.69 0.08 0.83 0.00 -0.01 -4.91 105.19 101.47 1qni n GLY 68 Ca 0.14 -0.48 0.01 0.00 0.00 0.00 0.00 46.02 45.70 1qni n GLY 68 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1qni n GLY 69 N 0.00 -2.58 1.47 -0.02 0.00 -1.26 -4.69 105.19 98.10 1qni n GLY 69 Ca 0.00 -1.43 0.04 0.00 0.00 0.00 0.00 46.02 44.63 1qni n GLY 69 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1qni n ASP 70 N -2.19 4.59 -3.60 1.61 5.68 -1.26 -4.92 116.55 116.46 1qni n ASP 70 Ca -0.01 -3.09 -0.16 0.00 -0.50 0.00 0.00 54.79 51.03 1qni n ASP 70 Cb 0.04 -0.64 -0.07 0.00 -1.14 0.00 0.00 41.12 39.31 1qni n ASP 70 CO 0.00 0.00 0.00 -1.58 -1.33 0.00 0.00 177.20 174.29 1qni s GLN 71 N -2.88 0.91 -0.08 0.11 0.74 -1.26 -5.15 119.66 112.04 1qni s GLN 71 Ca 0.49 0.45 -0.20 0.00 0.05 0.00 0.00 55.36 56.15 1qni s GLN 71 Cb 0.39 0.43 -0.04 0.00 1.10 0.00 0.00 33.01 34.89 1qni s GLN 71 CO 0.11 -0.23 0.56 -1.14 -0.55 0.00 0.00 175.29 174.05 1qni s GLN 72 N -0.64 4.36 -0.19 1.67 0.74 -1.26 -5.04 119.66 119.29 1qni s GLN 72 Ca -0.07 0.62 -0.00 0.00 0.05 0.00 0.00 55.36 55.96 1qni s GLN 72 Cb -0.02 -3.42 0.01 0.00 1.10 0.00 0.00 33.01 30.68 1qni s GLN 72 CO 0.06 0.17 -0.16 0.71 -0.55 0.00 0.00 175.29 175.53 1qni s TYR 73 N 0.52 2.83 -2.33 1.67 2.02 -1.26 -4.98 117.35 115.82 1qni s TYR 73 Ca 0.30 -1.43 0.25 0.00 -0.37 0.00 0.00 57.07 55.83 1qni s TYR 73 Cb -0.16 -1.97 1.05 0.00 -0.40 0.00 0.00 41.96 40.48 1qni s TYR 73 CO 0.14 -0.72 1.73 1.28 -1.57 0.00 0.00 175.55 176.41 1qni n LEU 74 N 4.64 1.27 -4.27 -1.29 4.77 -1.26 -4.90 117.00 115.96 1qni n LEU 74 Ca -0.20 -0.47 -0.15 0.00 -0.03 0.00 0.00 56.01 55.16 1qni n LEU 74 Cb 0.50 -0.04 -0.10 0.00 -2.33 0.00 0.00 43.42 41.46 1qni n LEU 74 CO 0.27 0.23 -0.25 0.54 -1.33 0.00 0.00 177.39 176.85 1qni s ASN 75 N -1.82 0.79 0.21 -1.43 6.03 -1.25 -4.33 114.94 113.14 1qni s ASN 75 Ca 0.36 -1.37 -0.23 0.00 -1.03 0.00 0.00 52.86 50.59 1qni s ASN 75 Cb 0.19 0.24 0.04 0.00 -3.03 0.00 0.00 41.25 38.70 1qni s ASN 75 CO 0.31 -0.76 0.85 -0.83 -2.03 0.00 0.00 177.10 174.64 1qni s GLY 76 N -3.24 -0.17 -0.37 0.45 0.00 -1.25 -4.76 107.32 97.98 1qni s GLY 76 Ca 0.37 -0.08 0.02 0.00 0.00 0.00 0.00 44.72 45.04 1qni s GLY 76 CO 0.12 -0.04 0.32 -0.35 0.00 0.00 0.00 173.10 173.16 1qni s ASP 77 N -2.94 1.74 -0.18 1.64 2.15 -1.26 -3.96 116.67 113.87 1qni s ASP 77 Ca 0.12 -1.84 -0.10 0.00 0.43 0.00 0.00 52.55 51.15 1qni s ASP 77 Cb -0.03 0.23 -0.05 0.00 -0.30 0.00 0.00 42.92 42.76 1qni s ASP 77 CO 0.04 -0.27 0.16 0.00 -0.17 0.00 0.00 175.17 174.94 1qni n HIS 79 N 3.32 0.00 -3.97 0.00 8.25 -1.25 -0.26 115.22 121.31 1qni n HIS 79 Ca -0.16 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 57.00 1qni n HIS 79 Cb 0.52 -0.23 -0.15 0.00 1.12 0.00 0.00 29.99 31.26 1qni n HIS 79 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 1qni s HIS 80 N -2.12 3.39 0.03 4.41 3.76 -1.26 -1.97 115.29 121.53 1qni s HIS 80 Ca -0.06 -2.89 -0.24 0.00 -0.15 0.00 0.00 55.06 51.71 1qni s HIS 80 Cb 0.02 -2.75 -0.05 0.00 1.11 0.00 0.00 32.58 30.91 1qni s HIS 80 CO 0.15 -0.90 0.75 -1.25 -0.85 0.00 0.00 174.74 172.64 1qni s PRO 81 N 0.74 4.47 0.00 8.40 0.04 -1.26 -4.15 135.00 143.25 1qni s PRO 81 Ca 0.12 1.02 0.00 0.00 0.04 0.00 0.00 61.00 62.19 1qni s PRO 81 Cb -0.20 -3.37 -0.00 0.00 0.04 0.00 0.00 34.50 30.97 1qni s PRO 81 CO -0.08 0.28 -0.01 -1.01 0.04 0.00 0.00 177.00 176.22 1qni s HIS 82 N -0.01 0.07 -0.16 0.56 3.76 -0.10 -4.54 115.29 114.87 1qni s HIS 82 Ca 0.38 -0.04 -0.08 0.00 -0.15 0.00 0.00 55.06 55.17 1qni s HIS 82 Cb -0.20 -0.05 -0.04 0.00 1.11 0.00 0.00 32.58 33.40 1qni s HIS 82 CO 0.22 -0.01 0.10 -1.50 -0.85 0.00 0.00 174.74 172.70 1qni s ILE 83 N -0.11 5.18 0.61 0.60 2.07 -1.26 -0.21 121.20 128.08 1qni s ILE 83 Ca -0.01 0.10 -0.18 0.00 -1.41 0.00 0.00 60.65 59.15 1qni s ILE 83 Cb -0.01 -3.31 -0.05 0.00 0.13 0.00 0.00 42.46 39.22 1qni s ILE 83 CO -0.00 0.52 0.85 -1.54 -1.91 0.00 0.00 174.94 172.86 1qni n SER 84 N 2.89 0.29 -4.27 4.50 3.41 0.12 -4.83 113.62 115.72 1qni n SER 84 Ca -0.18 0.77 -0.15 0.00 -0.26 0.00 0.00 58.87 59.06 1qni n SER 84 Cb 0.53 -1.34 -0.10 0.00 -0.26 0.00 0.00 64.21 63.04 1qni n SER 84 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 1qni s MET 85 N -2.64 1.15 -0.17 4.33 1.00 -1.26 -1.37 119.30 120.33 1qni s MET 85 Ca 0.75 -1.53 -0.02 0.00 0.00 0.00 0.00 55.69 54.88 1qni s MET 85 Cb -0.42 -0.56 0.05 0.00 0.00 0.00 0.00 34.83 33.90 1qni s MET 85 CO 0.48 -0.01 0.02 0.99 0.00 0.00 0.00 175.02 176.50 1qni s THR 86 N -3.41 0.59 -1.41 2.05 2.01 0.03 -1.25 115.64 114.26 1qni s THR 86 Ca 0.21 -0.48 -0.09 0.00 0.31 0.00 0.00 61.69 61.64 1qni s THR 86 Cb 0.04 -1.00 0.04 0.00 0.01 0.00 0.00 72.50 71.58 1qni s THR 86 CO 0.03 -0.10 1.04 -0.67 -0.69 0.00 0.00 174.62 174.23 1qni n ASP 87 N 5.04 -4.77 -0.09 3.53 2.03 0.24 -2.40 116.55 120.12 1qni n ASP 87 Ca -0.09 -0.67 -0.01 0.00 0.52 0.00 0.00 54.79 54.54 1qni n ASP 87 Cb 0.48 -4.49 -0.01 0.00 -0.72 0.00 0.00 41.12 36.38 1qni n ASP 87 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1qni n GLY 88 N -1.76 0.50 3.09 0.27 0.00 -0.78 -4.91 105.19 101.61 1qni n GLY 88 Ca -0.04 -0.66 -0.18 0.00 0.00 0.00 0.00 46.02 45.13 1qni n GLY 88 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1qni s ARG 89 N -1.48 0.78 0.18 1.61 0.52 -1.01 -0.94 118.95 118.62 1qni s ARG 89 Ca 0.00 -0.63 -0.32 0.00 -0.52 0.00 0.00 55.73 54.26 1qni s ARG 89 Cb 0.00 -0.73 -0.11 0.00 0.52 0.00 0.00 34.95 34.63 1qni s ARG 89 CO 0.00 0.18 1.61 0.71 0.02 0.00 0.00 175.30 177.82 1qni s TYR 90 N -0.78 3.01 -1.79 -0.53 2.02 -1.26 -0.79 117.35 117.23 1qni s TYR 90 Ca -0.00 0.57 0.15 0.00 -0.37 0.00 0.00 57.07 57.41 1qni s TYR 90 Cb -0.07 -3.99 0.14 0.00 -0.40 0.00 0.00 41.96 37.64 1qni s TYR 90 CO 0.01 -3.65 1.00 -0.40 -1.57 0.00 0.00 175.55 170.94 1qni n ASP 91 N 3.86 2.31 -1.84 2.29 5.68 -0.47 -4.83 116.55 123.55 1qni n ASP 91 Ca 0.14 -1.65 -0.19 0.00 -0.50 0.00 0.00 54.79 52.59 1qni n ASP 91 Cb 0.38 -0.03 -0.06 0.00 -1.14 0.00 0.00 41.12 40.27 1qni n ASP 91 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1qni n GLY 92 N 0.83 1.01 0.11 6.12 0.00 -1.24 -4.89 105.19 107.13 1qni n GLY 92 Ca 0.09 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.90 1qni n GLY 92 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1qni h LYS 93 N 0.00 0.03 -5.26 1.61 3.64 -1.87 -3.43 116.57 111.29 1qni h LYS 93 Ca -0.41 -0.05 -0.37 0.00 -1.27 0.00 0.00 60.65 58.54 1qni h LYS 93 Cb 1.27 0.02 -0.15 0.00 -0.41 0.00 0.00 32.23 32.95 1qni h LYS 93 CO 0.55 1.03 -0.73 0.71 -2.27 0.00 0.00 179.45 178.74 1qni s TYR 94 N -2.38 1.40 -0.06 1.91 2.02 -1.26 -2.84 117.35 116.13 1qni s TYR 94 Ca -0.28 -0.67 0.01 0.00 -0.37 0.00 0.00 57.07 55.77 1qni s TYR 94 Cb 0.06 -0.70 0.02 0.00 -0.40 0.00 0.00 41.96 40.94 1qni s TYR 94 CO 0.61 0.16 -0.09 -1.17 -1.57 0.00 0.00 175.55 173.50 1qni s LEU 95 N -3.06 1.45 0.04 -1.29 0.20 -0.63 -0.71 118.68 114.68 1qni s LEU 95 Ca 0.17 -0.23 0.08 0.00 0.69 0.00 0.00 54.13 54.83 1qni s LEU 95 Cb 0.00 -0.68 -0.03 0.00 -0.43 0.00 0.00 46.19 45.05 1qni s LEU 95 CO 0.03 -0.02 -0.21 -0.36 -0.29 0.00 0.00 176.35 175.50 1qni s PHE 96 N 0.90 2.48 0.04 5.38 0.40 0.71 0.92 117.98 128.81 1qni s PHE 96 Ca -0.11 -0.31 -0.13 0.00 -0.60 0.00 0.00 56.93 55.79 1qni s PHE 96 Cb -0.15 -1.45 0.02 0.00 0.51 0.00 0.00 43.02 41.95 1qni s PHE 96 CO 0.01 0.20 0.28 -1.50 0.70 0.00 0.00 175.22 174.91 1qni s ILE 97 N -0.87 0.09 0.46 0.64 2.07 -0.90 -0.92 121.20 121.76 1qni s ILE 97 Ca 0.13 -0.71 0.01 0.00 -1.41 0.00 0.00 60.65 58.67 1qni s ILE 97 Cb -0.10 -0.90 0.00 0.00 0.13 0.00 0.00 42.46 41.59 1qni s ILE 97 CO 0.04 -0.39 0.68 0.54 -1.91 0.00 0.00 174.94 173.89 1qni s ASN 98 N -2.00 5.76 -0.19 4.50 2.20 -1.26 -0.52 114.94 123.43 1qni s ASN 98 Ca -0.06 0.22 -0.02 0.00 -0.94 0.00 0.00 52.86 52.06 1qni s ASN 98 Cb -0.01 -1.42 0.06 0.00 -2.00 0.00 0.00 41.25 37.87 1qni s ASN 98 CO -0.03 -0.75 0.01 -0.62 -2.94 0.00 0.00 177.10 172.77 1qni s ASP 99 N -4.25 2.95 0.25 3.54 2.15 -0.50 -3.56 116.67 117.25 1qni s ASP 99 Ca 0.50 -0.81 0.23 0.00 0.43 0.00 0.00 52.55 52.90 1qni s ASP 99 Cb -0.10 -0.71 0.19 0.00 -0.30 0.00 0.00 42.92 41.99 1qni s ASP 99 CO 0.38 -0.27 1.27 0.50 -0.17 0.00 0.00 175.17 176.87 1qni h LYS 100 N 8.19 0.00 0.01 4.34 3.64 -0.41 -3.07 116.57 129.26 1qni h LYS 100 Ca -0.18 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.19 1qni h LYS 100 Cb 1.11 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.93 1qni h LYS 100 CO 0.35 0.00 -0.07 0.00 -2.27 0.00 0.00 179.45 177.46 1qni h ALA 101 N 2.12 0.00 -0.12 5.00 0.00 -1.88 -3.36 119.26 121.02 1qni h ALA 101 Ca 0.00 -0.45 -0.05 0.00 0.00 0.00 0.00 54.91 54.40 1qni h ALA 101 Cb 0.94 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.70 1qni h ALA 101 CO 0.00 -0.02 -0.25 0.09 0.00 0.00 0.00 179.25 179.07 1qni n ASN 102 N -4.62 2.20 -3.40 0.00 3.02 -1.26 -4.86 115.26 106.34 1qni n ASN 102 Ca -0.10 -3.66 -0.18 0.00 -0.03 0.00 0.00 54.58 50.61 1qni n ASN 102 Cb 0.45 -0.54 0.01 0.00 -0.61 0.00 0.00 39.78 39.09 1qni n ASN 102 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 1qni n THR 103 N -1.13 -6.48 -4.09 3.41 -1.04 -1.19 -4.91 114.28 98.85 1qni n THR 103 Ca 0.23 0.06 -0.11 0.00 -2.04 0.00 0.00 64.05 62.20 1qni n THR 103 Cb 0.80 -4.80 -0.07 0.00 -1.82 0.00 0.00 70.33 64.44 1qni n THR 103 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 1qni s ARG 104 N -3.61 1.40 -0.02 -2.82 0.52 -1.17 -2.57 118.95 110.68 1qni s ARG 104 Ca 0.11 -1.44 -0.00 0.00 -0.52 0.00 0.00 55.73 53.87 1qni s ARG 104 Cb -0.02 0.38 0.02 0.00 0.52 0.00 0.00 34.95 35.86 1qni s ARG 104 CO 0.83 -0.53 0.03 0.08 0.02 0.00 0.00 175.30 175.73 1qni s VAL 105 N -4.05 -0.05 0.29 3.52 1.01 -0.66 -1.40 120.40 119.05 1qni s VAL 105 Ca 0.30 0.17 0.09 0.00 0.00 0.00 0.00 61.98 62.55 1qni s VAL 105 Cb 0.03 -0.08 -0.04 0.00 0.00 0.00 0.00 36.38 36.29 1qni s VAL 105 CO 0.11 0.07 0.03 0.00 0.00 0.00 0.00 175.10 175.31 1qni s ALA 106 N 0.87 3.25 -0.03 5.51 0.00 0.32 -1.62 121.76 130.06 1qni s ALA 106 Ca -0.07 -1.72 0.04 0.00 0.00 0.00 0.00 51.96 50.21 1qni s ALA 106 Cb -0.10 -0.73 -0.00 0.00 0.00 0.00 0.00 23.12 22.28 1qni s ALA 106 CO -0.03 0.20 -0.13 0.50 0.00 0.00 0.00 175.76 176.30 1qni s ARG 107 N -3.72 1.26 -0.07 0.00 3.52 0.95 -2.12 118.95 118.76 1qni s ARG 107 Ca 0.33 -0.45 0.05 0.00 -0.13 0.00 0.00 55.73 55.53 1qni s ARG 107 Cb -0.05 -1.15 -0.01 0.00 -1.56 0.00 0.00 34.95 32.18 1qni s ARG 107 CO 0.21 0.20 -0.24 0.42 -0.81 0.00 0.00 175.30 175.08 1qni s ILE 108 N 0.01 2.13 -0.45 4.11 1.01 0.26 -0.17 121.20 128.11 1qni s ILE 108 Ca -0.01 -1.03 -0.26 0.00 0.00 0.00 0.00 60.65 59.36 1qni s ILE 108 Cb -0.09 -1.79 0.03 0.00 0.01 0.00 0.00 42.46 40.62 1qni s ILE 108 CO 0.01 0.57 0.93 -0.13 0.00 0.00 0.00 174.94 176.31 1qni s ARG 109 N -0.02 3.58 0.32 2.79 0.52 -0.21 -1.61 118.95 124.32 1qni s ARG 109 Ca -0.08 0.23 0.26 0.00 -0.52 0.00 0.00 55.73 55.62 1qni s ARG 109 Cb -0.15 -3.91 1.04 0.00 0.52 0.00 0.00 34.95 32.45 1qni s ARG 109 CO 0.05 -1.19 1.77 -0.07 0.02 0.00 0.00 175.30 175.89 1qni h LEU 110 N 10.51 0.00 -0.74 2.53 3.38 -1.79 0.29 115.31 129.50 1qni h LEU 110 Ca -0.24 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.61 1qni h LEU 110 Cb 1.08 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.81 1qni h LEU 110 CO 1.02 0.00 -0.33 -2.24 0.09 0.00 0.00 178.44 176.98 1qni h ASP 111 N 0.00 0.61 -0.01 -0.43 2.03 -1.80 -3.29 116.42 113.54 1qni h ASP 111 Ca 0.00 -0.25 0.00 0.00 -0.73 0.00 0.00 57.03 56.05 1qni h ASP 111 Cb 0.43 -0.17 0.00 0.00 -0.83 0.00 0.00 39.33 38.77 1qni h ASP 111 CO 0.00 0.90 0.00 2.30 -1.03 0.00 0.00 179.24 181.41 1qni n ILE 112 N -4.07 0.13 -3.51 4.15 -5.35 -1.12 -1.42 119.36 108.18 1qni n ILE 112 Ca -0.01 -0.57 -0.24 0.00 -0.27 0.00 0.00 62.75 61.66 1qni n ILE 112 Cb 0.47 0.96 0.05 0.00 -1.74 0.00 0.00 39.64 39.38 1qni n ILE 112 CO 0.00 0.00 0.00 0.23 -1.76 0.00 0.00 176.55 175.02 1qni n MET 113 N 0.02 -1.94 -3.88 6.28 2.81 0.10 -5.02 117.12 115.50 1qni n MET 113 Ca 0.01 0.64 -0.11 0.00 -1.81 0.00 0.00 57.70 56.42 1qni n MET 113 Cb 0.07 -4.90 -0.12 0.00 -0.71 0.00 0.00 33.22 27.56 1qni n MET 113 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 1qni s LYS 114 N -5.34 0.24 0.13 0.03 -0.14 -1.06 -4.83 119.74 108.78 1qni s LYS 114 Ca 0.43 -0.15 -0.31 0.00 -1.36 0.00 0.00 55.97 54.58 1qni s LYS 114 Cb -0.11 0.10 -0.09 0.00 -1.68 0.00 0.00 37.83 36.05 1qni s LYS 114 CO 0.81 -0.05 1.49 0.99 -0.76 0.00 0.00 175.35 177.83 1qni s THR 115 N -0.60 2.97 -0.11 2.17 2.01 -1.26 -1.04 115.64 119.76 1qni s THR 115 Ca -0.07 0.68 0.10 0.00 0.31 0.00 0.00 61.69 62.71 1qni s THR 115 Cb -0.04 -3.43 -0.14 0.00 0.01 0.00 0.00 72.50 68.89 1qni s THR 115 CO 0.00 0.05 0.03 -0.67 -0.69 0.00 0.00 174.62 173.35 1qni n ASP 116 N 4.06 2.18 -3.81 3.53 2.03 0.76 -4.88 116.55 120.43 1qni n ASP 116 Ca 0.13 -0.00 -0.12 0.00 0.52 0.00 0.00 54.79 55.31 1qni n ASP 116 Cb 0.40 0.75 -0.11 0.00 -0.72 0.00 0.00 41.12 41.45 1qni n ASP 116 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 1qni s LYS 117 N -2.28 0.33 -0.05 -0.67 -0.14 -1.08 -4.96 119.74 110.90 1qni s LYS 117 Ca -0.06 0.13 -0.02 0.00 -1.36 0.00 0.00 55.97 54.66 1qni s LYS 117 Cb 0.03 0.15 0.03 0.00 -1.68 0.00 0.00 37.83 36.37 1qni s LYS 117 CO 0.47 -0.06 0.03 0.42 -0.76 0.00 0.00 175.35 175.45 1qni s ILE 118 N -0.29 0.09 -0.09 2.17 1.01 -1.25 -0.04 121.20 122.81 1qni s ILE 118 Ca -0.04 0.29 0.04 0.00 0.00 0.00 0.00 60.65 60.94 1qni s ILE 118 Cb -0.03 -0.30 -0.01 0.00 0.01 0.00 0.00 42.46 42.13 1qni s ILE 118 CO 0.01 0.21 -0.22 -0.89 0.00 0.00 0.00 174.94 174.05 1qni s THR 119 N 2.01 2.28 -0.05 2.92 2.01 -0.64 -4.85 115.64 119.32 1qni s THR 119 Ca 0.04 -0.96 -0.24 0.00 0.31 0.00 0.00 61.69 60.85 1qni s THR 119 Cb -0.12 -1.88 -0.04 0.00 0.01 0.00 0.00 72.50 70.47 1qni s THR 119 CO -0.04 0.56 0.71 -1.00 -0.69 0.00 0.00 174.62 174.16 1qni s HIS 120 N 0.16 3.60 -0.14 4.92 3.76 -1.26 -1.65 115.29 124.67 1qni s HIS 120 Ca -0.12 1.28 -0.21 0.00 -0.15 0.00 0.00 55.06 55.86 1qni s HIS 120 Cb -0.16 -2.81 -0.03 0.00 1.11 0.00 0.00 32.58 30.69 1qni s HIS 120 CO 0.07 0.11 0.61 0.42 -0.85 0.00 0.00 174.74 175.09 1qni s ILE 121 N 0.71 5.07 0.45 0.60 -1.09 -1.06 -5.00 121.20 120.88 1qni s ILE 121 Ca 0.38 1.20 -0.17 0.00 -2.23 0.00 0.00 60.65 59.83 1qni s ILE 121 Cb -0.18 -3.94 -0.09 0.00 -1.58 0.00 0.00 42.46 36.67 1qni s ILE 121 CO 0.19 0.20 0.92 -2.16 -1.23 0.00 0.00 174.94 172.86 1qni s PRO 122 N 1.28 4.03 -0.94 2.79 0.04 -1.26 -4.27 135.00 136.67 1qni s PRO 122 Ca 0.30 0.93 -0.01 0.00 0.04 0.00 0.00 61.00 62.26 1qni s PRO 122 Cb -0.16 -2.21 0.01 0.00 0.04 0.00 0.00 34.50 32.17 1qni s PRO 122 CO 0.12 -0.11 0.05 0.09 0.04 0.00 0.00 177.00 177.19 1qni n ASN 123 N -1.09 -3.51 -3.96 6.66 3.02 -1.26 -4.93 115.26 110.19 1qni n ASN 123 Ca 0.06 0.17 -0.09 0.00 -0.03 0.00 0.00 54.58 54.69 1qni n ASN 123 Cb 0.54 -3.00 -0.07 0.00 -0.61 0.00 0.00 39.78 36.64 1qni n ASN 123 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1qni s VAL 124 N -2.57 0.09 0.01 2.41 0.11 -1.26 -4.87 120.40 114.32 1qni s VAL 124 Ca 0.04 -1.41 0.02 0.00 -2.93 0.00 0.00 61.98 57.70 1qni s VAL 124 Cb -0.02 -1.73 -0.01 0.00 -1.53 0.00 0.00 36.38 33.09 1qni s VAL 124 CO 0.05 -0.42 -0.06 -1.10 -3.33 0.00 0.00 175.10 170.24 1qni s GLN 125 N -3.95 0.43 -0.34 1.54 -0.21 -1.26 -4.97 119.66 110.90 1qni s GLN 125 Ca 0.15 -0.37 -0.06 0.00 0.02 0.00 0.00 55.36 55.09 1qni s GLN 125 Cb 0.04 -0.33 0.01 0.00 1.00 0.00 0.00 33.01 33.73 1qni s GLN 125 CO -0.03 0.08 0.23 0.00 -2.12 0.00 0.00 175.29 173.45 1qni n ALA 126 N 2.43 -3.28 -2.55 6.09 0.00 -1.26 -2.97 120.51 118.96 1qni n ALA 126 Ca -0.16 0.73 -0.43 0.00 0.00 0.00 0.00 53.44 53.58 1qni n ALA 126 Cb 0.57 -2.02 -0.02 0.00 0.00 0.00 0.00 19.45 17.98 1qni n ALA 126 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1qni s ILE 127 N -1.93 4.37 0.00 0.00 -1.09 -1.22 -0.71 121.20 120.62 1qni s ILE 127 Ca 0.10 1.57 0.00 0.00 -2.23 0.00 0.00 60.65 60.09 1qni s ILE 127 Cb -0.03 -4.31 0.00 0.00 -1.58 0.00 0.00 42.46 36.55 1qni s ILE 127 CO 0.73 -0.46 0.00 1.57 -1.23 0.00 0.00 174.94 175.55 1qni n HIS 128 N 7.11 0.00 -1.86 3.97 -0.00 -0.29 -2.99 115.22 121.17 1qni n HIS 128 Ca 0.13 0.00 -0.41 0.00 0.46 0.00 0.00 57.72 57.90 1qni n HIS 128 Cb 0.47 0.00 -0.01 0.00 -0.12 0.00 0.00 29.99 30.33 1qni n HIS 128 CO 0.00 0.00 0.00 0.20 0.46 0.00 0.00 176.34 177.00 1qni s GLY 129 N -1.15 2.79 -0.22 1.57 0.00 -0.46 -4.71 107.32 105.14 1qni s GLY 129 Ca 0.00 1.52 -0.13 0.00 0.00 0.00 0.00 44.72 46.11 1qni s GLY 129 CO 0.00 2.26 0.54 -2.27 0.00 0.00 0.00 173.10 173.63 1qni s LEU 130 N -1.72 -0.49 0.16 0.66 0.20 -1.26 -0.30 118.68 115.94 1qni s LEU 130 Ca 0.54 1.19 -0.19 0.00 0.69 0.00 0.00 54.13 56.36 1qni s LEU 130 Cb -0.45 1.85 0.05 0.00 -0.43 0.00 0.00 46.19 47.20 1qni s LEU 130 CO 0.58 -0.21 0.52 -0.13 -0.29 0.00 0.00 176.35 176.82 1qni s ARG 131 N 1.46 1.26 0.32 1.98 0.52 -0.75 -4.88 118.95 118.87 1qni s ARG 131 Ca -0.09 -0.68 0.06 0.00 -0.52 0.00 0.00 55.73 54.50 1qni s ARG 131 Cb -0.07 0.53 -0.01 0.00 0.52 0.00 0.00 34.95 35.92 1qni s ARG 131 CO -0.15 -0.53 0.43 -0.51 0.02 0.00 0.00 175.30 174.55 1qni s LEU 132 N -2.81 3.97 0.23 2.53 1.43 -1.26 -0.96 118.68 121.81 1qni s LEU 132 Ca 0.04 -0.19 -0.30 0.00 -1.03 0.00 0.00 54.13 52.65 1qni s LEU 132 Cb -0.00 -2.69 -0.09 0.00 0.03 0.00 0.00 46.19 43.44 1qni s LEU 132 CO -0.09 -0.36 0.97 -1.58 0.23 0.00 0.00 176.35 175.52 1qni s GLN 133 N -4.12 4.80 -0.25 1.70 0.74 -0.95 -4.51 119.66 117.07 1qni s GLN 133 Ca 0.43 1.54 -0.07 0.00 0.05 0.00 0.00 55.36 57.31 1qni s GLN 133 Cb -0.09 -3.28 -0.16 0.00 1.10 0.00 0.00 33.01 30.58 1qni s GLN 133 CO 0.30 0.42 -0.18 1.63 -0.55 0.00 0.00 175.29 176.91 1qni n LYS 134 N 1.64 0.63 -5.22 1.67 5.02 -1.26 -3.38 118.16 117.26 1qni n LYS 134 Ca -0.01 0.24 -0.30 0.00 -2.02 0.00 0.00 58.31 56.22 1qni n LYS 134 Cb 0.47 -1.55 -0.16 0.00 -0.02 0.00 0.00 35.03 33.77 1qni n LYS 134 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1qni s VAL 135 N -2.51 1.92 0.17 -0.18 1.01 -1.26 -1.86 120.40 117.69 1qni s VAL 135 Ca -0.35 -1.04 0.22 0.00 0.00 0.00 0.00 61.98 60.81 1qni s VAL 135 Cb 0.11 -1.60 0.20 0.00 0.00 0.00 0.00 36.38 35.09 1qni s VAL 135 CO 0.57 0.54 1.81 -0.65 0.00 0.00 0.00 175.10 177.37 1qni h PRO 136 N 5.54 0.00 0.00 2.72 0.11 -1.94 -3.13 132.00 135.29 1qni h PRO 136 Ca -0.42 0.00 0.08 0.00 0.11 0.00 0.00 66.00 65.77 1qni h PRO 136 Cb 1.13 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 1qni h PRO 136 CO 0.47 0.28 0.45 0.36 -0.21 0.00 0.00 178.00 179.35 1qni n LYS 137 N -3.47 0.85 -2.66 1.05 2.85 -1.20 0.80 118.16 116.37 1qni n LYS 137 Ca -0.00 -1.78 -0.42 0.00 -1.05 0.00 0.00 58.31 55.06 1qni n LYS 137 Cb 0.45 2.31 -0.03 0.00 -0.65 0.00 0.00 35.03 37.11 1qni n LYS 137 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 177.40 178.34 1qni s THR 138 N -2.09 4.07 -0.22 0.58 2.01 -0.38 -4.36 115.64 115.26 1qni s THR 138 Ca 0.20 -0.53 0.08 0.00 0.31 0.00 0.00 61.69 61.74 1qni s THR 138 Cb -0.04 -4.92 -0.19 0.00 0.01 0.00 0.00 72.50 67.36 1qni s THR 138 CO 0.08 -1.77 -0.09 0.59 -0.69 0.00 0.00 174.62 172.74 1qni n ASN 139 N 8.44 1.36 -4.61 3.53 5.03 -1.26 -4.67 115.26 123.08 1qni n ASN 139 Ca 0.18 -0.07 -0.34 0.00 0.87 0.00 0.00 54.58 55.22 1qni n ASN 139 Cb 0.49 0.20 -0.11 0.00 -1.02 0.00 0.00 39.78 39.35 1qni n ASN 139 CO 0.00 0.00 0.00 -0.31 -1.83 0.00 0.00 177.26 175.12 1qni s TYR 140 N -2.47 2.97 -0.25 3.10 2.02 -1.26 -0.51 117.35 120.95 1qni s TYR 140 Ca -0.22 0.04 -0.05 0.00 -0.37 0.00 0.00 57.07 56.47 1qni s TYR 140 Cb 0.07 -1.71 0.00 0.00 -0.40 0.00 0.00 41.96 39.93 1qni s TYR 140 CO 0.65 0.37 -0.00 0.08 -1.57 0.00 0.00 175.55 175.07 1qni s VAL 141 N -0.87 3.52 -0.19 0.71 1.01 0.82 -2.23 120.40 123.17 1qni s VAL 141 Ca 0.14 -0.62 -0.16 0.00 0.00 0.00 0.00 61.98 61.34 1qni s VAL 141 Cb -0.11 -2.70 -0.04 0.00 0.00 0.00 0.00 36.38 33.53 1qni s VAL 141 CO 0.03 0.28 0.39 -0.36 0.00 0.00 0.00 175.10 175.44 1qni s PHE 142 N 1.47 3.40 0.01 5.22 0.08 -0.13 -0.38 117.98 127.64 1qni s PHE 142 Ca 0.04 0.64 0.07 0.00 0.12 0.00 0.00 56.93 57.80 1qni s PHE 142 Cb -0.16 -2.50 -0.02 0.00 -0.57 0.00 0.00 43.02 39.77 1qni s PHE 142 CO -0.01 0.04 -0.21 0.00 -0.10 0.00 0.00 175.22 174.95 1qni s ASN 144 N -0.75 5.24 -0.21 0.00 0.02 0.59 -1.18 114.94 118.66 1qni s ASN 144 Ca 0.08 0.02 -0.01 0.00 -1.02 0.00 0.00 52.86 51.93 1qni s ASN 144 Cb -0.08 -1.40 0.01 0.00 0.02 0.00 0.00 41.25 39.81 1qni s ASN 144 CO 0.00 0.28 -0.13 0.00 0.02 0.00 0.00 177.10 177.27 1qni s ALA 145 N -1.11 2.54 0.15 0.60 0.00 -1.23 -1.13 121.76 121.57 1qni s ALA 145 Ca 0.20 -1.27 0.04 0.00 0.00 0.00 0.00 51.96 50.94 1qni s ALA 145 Cb -0.12 -1.44 -0.07 0.00 0.00 0.00 0.00 23.12 21.50 1qni s ALA 145 CO 0.11 -0.48 1.34 1.49 0.00 0.00 0.00 175.76 178.22 1qni h GLU 146 N 8.00 0.12 -5.16 0.00 4.81 -0.81 -3.30 114.58 118.24 1qni h GLU 146 Ca -0.41 -0.16 -0.63 0.00 -0.13 0.00 0.00 59.36 58.02 1qni h GLU 146 Cb 1.14 0.05 -0.20 0.00 0.63 0.00 0.00 28.75 30.37 1qni h GLU 146 CO 0.61 0.97 -0.62 -0.06 -0.73 0.00 0.00 179.01 179.18 1qni s PHE 147 N -3.02 3.12 0.25 0.92 0.08 -1.17 -4.35 117.98 113.80 1qni s PHE 147 Ca -0.02 -0.23 -0.30 0.00 0.12 0.00 0.00 56.93 56.50 1qni s PHE 147 Cb 0.10 -2.10 -0.09 0.00 -0.57 0.00 0.00 43.02 40.36 1qni s PHE 147 CO 0.83 -0.10 1.24 0.14 -0.10 0.00 0.00 175.22 177.23 1qni s VAL 148 N 0.83 3.19 0.07 -0.44 -7.23 -1.26 -4.28 120.40 111.28 1qni s VAL 148 Ca 0.02 1.08 0.01 0.00 -1.81 0.00 0.00 61.98 61.28 1qni s VAL 148 Cb -0.14 -3.69 -0.04 0.00 0.56 0.00 0.00 36.38 33.07 1qni s VAL 148 CO 0.02 0.21 -0.05 0.27 -0.31 0.00 0.00 175.10 175.24 1qni s ILE 149 N -0.54 0.48 0.72 -0.62 -4.36 -0.11 -4.64 121.20 112.12 1qni s ILE 149 Ca 0.51 -1.80 -0.15 0.00 -0.26 0.00 0.00 60.65 58.96 1qni s ILE 149 Cb -0.36 -1.51 0.03 0.00 1.25 0.00 0.00 42.46 41.88 1qni s ILE 149 CO 0.43 -0.88 1.17 -2.16 0.24 0.00 0.00 174.94 173.73 1qni s PRO 150 N -3.65 2.30 -0.27 0.37 0.04 -1.26 -0.05 135.00 132.48 1qni s PRO 150 Ca 0.08 1.61 0.03 0.00 0.04 0.00 0.00 61.00 62.76 1qni s PRO 150 Cb 0.05 -1.87 0.07 0.00 0.04 0.00 0.00 34.50 32.79 1qni s PRO 150 CO -0.06 -1.68 -0.06 -0.65 0.04 0.00 0.00 177.00 174.59 1qni s GLN 151 N -4.03 1.92 0.65 4.56 -0.21 -1.25 -2.05 119.66 119.25 1qni s GLN 151 Ca 0.71 -1.36 -0.09 0.00 0.02 0.00 0.00 55.36 54.64 1qni s GLN 151 Cb -0.26 -2.86 0.01 0.00 1.00 0.00 0.00 33.01 30.90 1qni s GLN 151 CO 0.45 -0.66 1.00 -1.25 -2.12 0.00 0.00 175.29 172.71 1qni s PRO 152 N 1.14 2.92 -1.25 2.91 0.04 -1.26 -5.04 135.00 134.46 1qni s PRO 152 Ca -0.04 0.26 -0.14 0.00 0.04 0.00 0.00 61.00 61.13 1qni s PRO 152 Cb -0.19 -2.14 0.15 0.00 0.04 0.00 0.00 34.50 32.35 1qni s PRO 152 CO -0.06 -0.86 1.61 -1.71 0.04 0.00 0.00 177.00 176.01 1qni n ASN 153 N -2.80 5.09 -0.47 6.66 5.15 -0.87 -4.70 115.26 123.32 1qni n ASN 153 Ca 0.06 -2.99 0.05 0.00 -0.60 0.00 0.00 54.58 51.10 1qni n ASN 153 Cb 0.57 -1.59 0.08 0.00 -0.53 0.00 0.00 39.78 38.32 1qni n ASN 153 CO 0.00 0.00 0.00 -0.90 1.40 0.00 0.00 177.26 177.76 1qni n ASP 154 N 5.78 2.28 0.00 1.20 5.68 -1.26 -5.00 116.55 125.23 1qni n ASP 154 Ca 0.40 -1.68 0.00 0.00 -0.50 0.00 0.00 54.79 53.01 1qni n ASP 154 Cb 0.42 -0.09 0.00 0.00 -1.14 0.00 0.00 41.12 40.30 1qni n ASP 154 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1qni n GLY 155 N 0.48 0.52 0.07 6.12 0.00 -1.26 -4.92 105.19 106.20 1qni n GLY 155 Ca 0.08 -0.40 0.10 0.00 0.00 0.00 0.00 46.02 45.81 1qni n GLY 155 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1qni n THR 156 N -2.87 0.00 -3.17 2.61 -2.24 -1.26 -4.83 114.28 102.53 1qni n THR 156 Ca 0.00 -0.03 0.03 0.00 -2.27 0.00 0.00 64.05 61.77 1qni n THR 156 Cb 0.00 1.00 -0.01 0.00 -2.10 0.00 0.00 70.33 69.23 1qni n THR 156 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1qni s ASP 157 N -2.93 -1.40 0.06 3.42 2.15 -1.26 -5.04 116.67 111.67 1qni s ASP 157 Ca 0.10 0.29 0.26 0.00 0.43 0.00 0.00 52.55 53.63 1qni s ASP 157 Cb 0.16 1.98 0.70 0.00 -0.30 0.00 0.00 42.92 45.47 1qni s ASP 157 CO 0.82 -0.30 1.58 0.49 -0.17 0.00 0.00 175.17 177.59 1qni n PHE 158 N 5.42 0.26 -1.64 -5.34 3.72 -1.26 -4.71 117.46 113.91 1qni n PHE 158 Ca 0.03 0.08 -0.45 0.00 -0.05 0.00 0.00 57.45 57.06 1qni n PHE 158 Cb 0.53 -0.51 -0.02 0.00 -0.94 0.00 0.00 39.48 38.54 1qni n PHE 158 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1qni n SER 159 N -1.75 2.13 0.26 4.37 3.41 -1.26 -4.88 113.62 115.90 1qni n SER 159 Ca 0.05 1.16 0.13 0.00 -0.26 0.00 0.00 58.87 59.96 1qni n SER 159 Cb 0.38 -1.36 0.68 0.00 -0.26 0.00 0.00 64.21 63.64 1qni n SER 159 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1qni h LEU 160 N 3.24 0.00 -1.37 1.04 3.38 -1.93 -2.80 115.31 116.88 1qni h LEU 160 Ca -0.44 0.00 0.08 0.00 0.09 0.00 0.00 57.88 57.61 1qni h LEU 160 Cb 1.31 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 42.01 1qni h LEU 160 CO 0.69 0.13 0.50 0.44 0.09 0.00 0.00 178.44 180.28 1qni h ASP 161 N 0.00 0.66 -0.43 -0.43 5.19 -1.89 -2.08 116.42 117.44 1qni h ASP 161 Ca -0.00 0.01 -0.18 0.00 -0.62 0.00 0.00 57.03 56.23 1qni h ASP 161 Cb 0.46 -0.13 -0.11 0.00 0.18 0.00 0.00 39.33 39.73 1qni h ASP 161 CO 0.02 0.41 0.04 0.59 -3.12 0.00 0.00 179.24 177.18 1qni n ASN 162 N -4.49 3.03 -4.67 6.45 3.02 -1.06 -4.96 115.26 112.58 1qni n ASN 162 Ca 0.12 -3.57 -0.35 0.00 -0.03 0.00 0.00 54.58 50.75 1qni n ASN 162 Cb 0.28 -0.65 -0.09 0.00 -0.61 0.00 0.00 39.78 38.71 1qni n ASN 162 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 1qni s SER 163 N -2.19 5.42 0.26 6.41 0.01 -0.78 -3.79 113.70 119.03 1qni s SER 163 Ca 0.46 0.14 -0.05 0.00 1.31 0.00 0.00 55.95 57.81 1qni s SER 163 Cb 0.40 -1.70 -0.02 0.00 0.21 0.00 0.00 66.02 64.92 1qni s SER 163 CO 0.04 0.31 0.34 -0.31 0.41 0.00 0.00 173.24 174.03 1qni s TYR 164 N -0.46 0.87 0.33 2.43 1.51 0.93 -4.62 117.35 118.34 1qni s TYR 164 Ca 0.09 -1.13 0.03 0.00 -1.01 0.00 0.00 57.07 55.05 1qni s TYR 164 Cb -0.12 -0.18 -0.05 0.00 -0.11 0.00 0.00 41.96 41.50 1qni s TYR 164 CO 0.02 -0.89 0.10 -0.08 -1.11 0.00 0.00 175.55 173.59 1qni s THR 165 N -3.83 0.74 0.07 -0.71 -1.32 -1.26 -0.93 115.64 108.39 1qni s THR 165 Ca 0.31 -2.00 0.01 0.00 -1.21 0.00 0.00 61.69 58.80 1qni s THR 165 Cb 0.02 -2.59 -0.04 0.00 -1.51 0.00 0.00 72.50 68.39 1qni s THR 165 CO 0.13 0.00 -0.06 -0.04 -2.21 0.00 0.00 174.62 172.44 1qni s MET 166 N -3.86 0.68 -0.24 7.08 -1.94 -1.26 -2.63 119.30 117.13 1qni s MET 166 Ca 0.33 -1.10 -0.13 0.00 -1.71 0.00 0.00 55.69 53.08 1qni s MET 166 Cb 0.06 -0.17 -0.04 0.00 2.01 0.00 0.00 34.83 36.69 1qni s MET 166 CO 0.15 -0.01 0.28 0.12 -0.01 0.00 0.00 175.02 175.55 1qni s PHE 167 N -2.85 3.30 -0.10 -0.03 5.36 0.31 -3.57 117.98 120.40 1qni s PHE 167 Ca 0.03 0.36 -0.00 0.00 -0.96 0.00 0.00 56.93 56.36 1qni s PHE 167 Cb 0.00 -2.42 -0.03 0.00 -0.34 0.00 0.00 43.02 40.23 1qni s PHE 167 CO -0.04 -0.05 -0.08 0.99 -1.46 0.00 0.00 175.22 174.58 1qni s THR 168 N 1.45 3.57 -0.15 0.12 2.01 -0.32 -0.16 115.64 122.15 1qni s THR 168 Ca 0.12 -0.50 -0.01 0.00 0.31 0.00 0.00 61.69 61.61 1qni s THR 168 Cb -0.15 -2.49 -0.01 0.00 0.01 0.00 0.00 72.50 69.86 1qni s THR 168 CO 0.08 0.55 -0.10 0.00 -0.69 0.00 0.00 174.62 174.45 1qni s ALA 169 N -0.24 2.70 0.02 7.40 0.00 -0.29 -0.15 121.76 131.19 1qni s ALA 169 Ca 0.03 -0.94 0.05 0.00 0.00 0.00 0.00 51.96 51.10 1qni s ALA 169 Cb -0.13 -1.35 -0.03 0.00 0.00 0.00 0.00 23.12 21.61 1qni s ALA 169 CO 0.03 0.11 -0.13 0.42 0.00 0.00 0.00 175.76 176.19 1qni s ILE 170 N 0.58 3.18 -0.22 0.00 1.01 0.48 -0.03 121.20 126.21 1qni s ILE 170 Ca -0.07 -0.97 -0.29 0.00 0.00 0.00 0.00 60.65 59.33 1qni s ILE 170 Cb -0.15 -2.35 -0.00 0.00 0.01 0.00 0.00 42.46 39.96 1qni s ILE 170 CO 0.03 0.38 1.19 -0.62 0.00 0.00 0.00 174.94 175.92 1qni s ASP 171 N -1.37 6.95 0.15 3.58 2.15 -0.39 -0.13 116.67 127.62 1qni s ASP 171 Ca 0.15 1.48 -0.17 0.00 0.43 0.00 0.00 52.55 54.44 1qni s ASP 171 Cb -0.11 -2.54 0.04 0.00 -0.30 0.00 0.00 42.92 40.01 1qni s ASP 171 CO 0.06 -0.79 1.72 0.00 -0.17 0.00 0.00 175.17 175.99 1qni h ALA 172 N 8.11 0.30 0.00 3.66 0.00 -1.07 1.06 119.26 131.31 1qni h ALA 172 Ca -0.24 0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.70 1qni h ALA 172 Cb 1.09 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 1qni h ALA 172 CO 0.99 -0.38 -0.24 0.93 0.00 0.00 0.00 179.25 180.54 1qni h GLU 173 N 0.13 0.00 0.00 0.00 4.39 -1.85 -3.30 114.58 113.95 1qni h GLU 173 Ca 0.15 0.00 -0.31 0.00 0.34 0.00 0.00 59.36 59.53 1qni h GLU 173 Cb 0.18 0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 28.77 1qni h GLU 173 CO -0.22 0.24 -2.17 2.41 -1.16 0.00 0.00 179.01 178.11 1qni n THR 174 N -3.49 1.17 -1.53 1.13 -1.04 -1.07 -4.99 114.28 104.47 1qni n THR 174 Ca -0.00 -0.65 -0.11 0.00 -2.04 0.00 0.00 64.05 61.25 1qni n THR 174 Cb 0.41 -0.75 -0.04 0.00 -1.82 0.00 0.00 70.33 68.14 1qni n THR 174 CO 0.00 0.00 0.00 0.23 -0.64 0.00 0.00 175.07 174.66 1qni n MET 175 N -2.76 -0.77 -4.19 -2.82 2.81 0.36 -5.01 117.12 104.74 1qni n MET 175 Ca -0.30 0.79 -0.35 0.00 -1.81 0.00 0.00 57.70 56.03 1qni n MET 175 Cb 1.01 -4.78 -0.08 0.00 -0.71 0.00 0.00 33.22 28.65 1qni n MET 175 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 1qni s ASP 176 N -2.80 5.62 0.23 7.83 1.01 -1.25 -4.73 116.67 122.59 1qni s ASP 176 Ca 0.00 0.22 -0.31 0.00 0.71 0.00 0.00 52.55 53.17 1qni s ASP 176 Cb 0.00 -1.65 -0.12 0.00 1.01 0.00 0.00 42.92 42.16 1qni s ASP 176 CO 0.00 0.36 1.66 -0.69 0.21 0.00 0.00 175.17 176.71 1qni s VAL 177 N -0.99 2.11 -0.20 -1.27 1.01 -1.26 -1.26 120.40 118.54 1qni s VAL 177 Ca 0.16 0.08 -0.20 0.00 0.00 0.00 0.00 61.98 62.02 1qni s VAL 177 Cb -0.12 -3.05 -0.17 0.00 0.00 0.00 0.00 36.38 33.04 1qni s VAL 177 CO 0.05 0.01 0.17 0.00 0.00 0.00 0.00 175.10 175.33 1qni h ALA 178 N 6.07 0.22 -2.33 5.51 0.00 -0.77 -3.46 119.26 124.51 1qni h ALA 178 Ca -0.44 -1.09 0.15 0.00 0.00 0.00 0.00 54.91 53.53 1qni h ALA 178 Cb 1.21 0.69 -0.10 0.00 0.00 0.00 0.00 17.79 19.58 1qni h ALA 178 CO 0.89 0.66 0.48 1.67 0.00 0.00 0.00 179.25 182.95 1qni s TRP 179 N -2.34 -0.21 0.02 0.00 1.48 -1.12 -4.26 118.94 112.52 1qni s TRP 179 Ca -0.26 -0.04 0.03 0.00 -1.06 0.00 0.00 56.10 54.77 1qni s TRP 179 Cb 0.05 0.60 -0.02 0.00 -1.16 0.00 0.00 33.47 32.95 1qni s TRP 179 CO 0.54 -0.73 -0.09 -0.65 -4.06 0.00 0.00 176.95 171.95 1qni s GLN 180 N -3.23 0.66 -0.21 3.25 -0.21 -0.43 -1.14 119.66 118.34 1qni s GLN 180 Ca 0.10 -0.55 0.02 0.00 0.02 0.00 0.00 55.36 54.95 1qni s GLN 180 Cb -0.01 -0.59 0.04 0.00 1.00 0.00 0.00 33.01 33.44 1qni s GLN 180 CO -0.02 0.15 -0.16 0.08 -2.12 0.00 0.00 175.29 173.22 1qni s VAL 181 N -0.72 2.11 0.28 1.09 1.01 0.77 -1.40 120.40 123.53 1qni s VAL 181 Ca -0.01 -1.24 -0.29 0.00 0.00 0.00 0.00 61.98 60.43 1qni s VAL 181 Cb -0.06 -2.04 -0.09 0.00 0.00 0.00 0.00 36.38 34.18 1qni s VAL 181 CO 0.00 0.29 1.16 -0.63 0.00 0.00 0.00 175.10 175.93 1qni s ILE 182 N 1.21 3.32 0.30 2.22 1.01 -0.60 -0.53 121.20 128.12 1qni s ILE 182 Ca -0.01 1.29 0.03 0.00 0.00 0.00 0.00 60.65 61.95 1qni s ILE 182 Cb -0.16 -3.82 -0.05 0.00 0.01 0.00 0.00 42.46 38.44 1qni s ILE 182 CO -0.10 0.29 0.12 0.68 0.00 0.00 0.00 174.94 175.93 1qni s VAL 183 N -0.97 0.57 0.62 2.92 -7.23 -1.08 -0.17 120.40 115.06 1qni s VAL 183 Ca 0.47 -2.00 -0.02 0.00 -1.81 0.00 0.00 61.98 58.62 1qni s VAL 183 Cb -0.34 -2.58 0.05 0.00 0.56 0.00 0.00 36.38 34.07 1qni s VAL 183 CO 0.43 0.00 0.88 -1.81 -0.31 0.00 0.00 175.10 174.29 1qni s ASP 184 N -3.39 5.01 0.77 4.85 1.01 -1.26 -4.38 116.67 119.28 1qni s ASP 184 Ca 0.35 0.10 0.00 0.00 0.71 0.00 0.00 52.55 53.72 1qni s ASP 184 Cb 0.06 -0.85 0.00 0.00 1.01 0.00 0.00 42.92 43.14 1qni s ASP 184 CO 0.15 -1.38 0.00 0.61 0.21 0.00 0.00 175.17 174.76 1qni n GLY 185 N -2.59 2.57 0.74 0.21 0.00 -1.26 -4.86 105.19 100.00 1qni n GLY 185 Ca 0.09 -0.33 -0.05 0.00 0.00 0.00 0.00 46.02 45.73 1qni n GLY 185 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1qni n ASN 186 N 0.37 0.14 -3.99 1.61 2.04 -1.24 -4.48 115.26 109.70 1qni n ASN 186 Ca 0.00 -1.50 -0.22 0.00 -0.44 0.00 0.00 54.58 52.42 1qni n ASN 186 Cb 0.00 0.34 -0.16 0.00 -2.53 0.00 0.00 39.78 37.43 1qni n ASN 186 CO 0.00 0.00 0.00 -0.76 -0.44 0.00 0.00 177.26 176.06 1qni s LEU 187 N 0.00 1.59 0.00 -4.53 1.43 -1.24 -4.41 118.68 111.52 1qni s LEU 187 Ca 0.08 -0.23 0.00 0.00 -1.03 0.00 0.00 54.13 52.95 1qni s LEU 187 Cb 0.00 -0.67 0.00 0.00 0.03 0.00 0.00 46.19 45.55 1qni s LEU 187 CO 0.06 0.02 0.00 -0.67 0.23 0.00 0.00 176.35 175.99 1qni n ASP 188 N 3.76 0.00 -4.67 2.29 -0.08 0.06 -3.76 116.55 114.14 1qni n ASP 188 Ca -0.23 0.00 -0.24 0.00 -1.51 0.00 0.00 54.79 52.81 1qni n ASP 188 Cb 0.52 0.00 -0.08 0.00 2.34 0.00 0.00 41.12 43.90 1qni n ASP 188 CO 0.00 0.00 0.00 0.20 0.12 0.00 0.00 177.20 177.52 1qni s ASN 189 N -0.60 4.37 0.03 1.67 -0.87 -1.25 -1.36 114.94 116.93 1qni s ASN 189 Ca 0.00 -0.90 -0.13 0.00 -1.57 0.00 0.00 52.86 50.25 1qni s ASN 189 Cb 0.00 -0.61 0.02 0.00 -0.02 0.00 0.00 41.25 40.64 1qni s ASN 189 CO 0.00 -0.25 0.29 0.28 -2.57 0.00 0.00 177.10 174.84 1qni s THR 190 N -2.48 0.08 0.22 1.60 -1.32 -1.26 -1.06 115.64 111.42 1qni s THR 190 Ca 0.36 -0.66 -0.09 0.00 -1.21 0.00 0.00 61.69 60.08 1qni s THR 190 Cb -0.01 -0.84 -0.01 0.00 -1.51 0.00 0.00 72.50 70.12 1qni s THR 190 CO 0.21 -0.36 0.37 -0.62 -2.21 0.00 0.00 174.62 172.00 1qni s ASP 191 N -1.87 -0.02 0.25 8.08 -1.08 -0.30 -4.41 116.67 117.32 1qni s ASP 191 Ca -0.07 -1.02 0.05 0.00 -0.52 0.00 0.00 52.55 50.99 1qni s ASP 191 Cb -0.02 0.51 -0.05 0.00 -1.46 0.00 0.00 42.92 41.90 1qni s ASP 191 CO -0.01 -1.03 -0.04 0.00 0.52 0.00 0.00 175.17 174.61 1qni s ALA 192 N -4.04 2.09 0.71 3.66 0.00 -1.26 -0.52 121.76 122.40 1qni s ALA 192 Ca 0.25 -1.83 -0.02 0.00 0.00 0.00 0.00 51.96 50.36 1qni s ALA 192 Cb 0.02 0.31 0.04 0.00 0.00 0.00 0.00 23.12 23.48 1qni s ALA 192 CO 0.08 -0.15 0.25 -0.40 0.00 0.00 0.00 175.76 175.54 1qni n ASP 193 N -0.50 0.17 -2.08 0.00 5.68 -0.91 -4.81 116.55 114.10 1qni n ASP 193 Ca -0.05 -1.18 -0.27 0.00 -0.50 0.00 0.00 54.79 52.79 1qni n ASP 193 Cb 0.63 -0.18 0.09 0.00 -1.14 0.00 0.00 41.12 40.53 1qni n ASP 193 CO 0.00 0.00 0.00 -1.22 -1.33 0.00 0.00 177.20 174.65 1qni n TYR 194 N -2.02 2.80 0.00 2.11 4.02 -1.26 -4.25 117.16 118.56 1qni n TYR 194 Ca 0.04 -2.50 0.00 0.00 -0.01 0.00 0.00 57.90 55.42 1qni n TYR 194 Cb 0.13 -0.97 0.00 0.00 -0.02 0.00 0.00 39.34 38.48 1qni n TYR 194 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 176.86 176.10 1qni n THR 195 N -0.91 0.00 0.00 -0.72 -2.24 -1.26 -4.75 114.28 104.39 1qni n THR 195 Ca 0.54 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.32 1qni n THR 195 Cb 0.90 -0.23 0.00 0.00 -2.10 0.00 0.00 70.33 68.90 1qni n THR 195 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1qni n GLY 196 N 1.13 0.47 0.11 3.38 0.00 -1.19 -4.37 105.19 104.72 1qni n GLY 196 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.86 1qni n GLY 196 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1qni h LYS 197 N 3.10 0.25 -6.61 1.61 3.64 -1.92 -3.43 116.57 113.22 1qni h LYS 197 Ca 0.00 -0.43 -0.65 0.00 -1.27 0.00 0.00 60.65 58.29 1qni h LYS 197 Cb 0.00 0.16 -0.17 0.00 -0.41 0.00 0.00 32.23 31.81 1qni h LYS 197 CO 0.00 1.16 -0.79 0.71 -2.27 0.00 0.00 179.45 178.26 1qni s TYR 198 N -2.64 2.48 -0.03 1.91 2.02 -1.26 -0.46 117.35 119.37 1qni s TYR 198 Ca -0.06 -0.28 -0.09 0.00 -0.37 0.00 0.00 57.07 56.27 1qni s TYR 198 Cb 0.07 -1.26 0.01 0.00 -0.40 0.00 0.00 41.96 40.39 1qni s TYR 198 CO 0.87 0.46 0.20 0.00 -1.57 0.00 0.00 175.55 175.51 1qni s ALA 199 N -1.49 -0.48 0.00 3.71 0.00 -0.99 -2.14 121.76 120.37 1qni s ALA 199 Ca 0.21 0.23 -0.05 0.00 0.00 0.00 0.00 51.96 52.35 1qni s ALA 199 Cb -0.09 -0.08 -0.00 0.00 0.00 0.00 0.00 23.12 22.95 1qni s ALA 199 CO 0.11 -0.18 0.09 0.95 0.00 0.00 0.00 175.76 176.74 1qni s THR 200 N -0.79 0.08 0.05 0.00 -4.23 0.33 0.38 115.64 111.46 1qni s THR 200 Ca -0.09 -0.67 0.03 0.00 -1.18 0.00 0.00 61.69 59.78 1qni s THR 200 Cb -0.05 -0.36 -0.03 0.00 1.34 0.00 0.00 72.50 73.40 1qni s THR 200 CO 0.02 -0.37 -0.09 -0.44 -0.54 0.00 0.00 174.62 173.19 1qni s SER 201 N -1.25 1.06 0.48 3.99 0.01 -0.44 -1.15 113.70 116.40 1qni s SER 201 Ca -0.13 -0.59 -0.03 0.00 1.31 0.00 0.00 55.95 56.50 1qni s SER 201 Cb -0.07 0.02 -0.02 0.00 0.21 0.00 0.00 66.02 66.16 1qni s SER 201 CO 0.01 -0.19 0.75 0.42 0.41 0.00 0.00 173.24 174.64 1qni s THR 202 N -1.49 4.38 -0.01 1.44 -4.23 -0.22 -0.29 115.64 115.22 1qni s THR 202 Ca -0.07 -0.14 0.01 0.00 -1.18 0.00 0.00 61.69 60.32 1qni s THR 202 Cb -0.09 -3.66 0.00 0.00 1.34 0.00 0.00 72.50 70.09 1qni s THR 202 CO 0.01 -0.57 -0.04 0.00 -0.54 0.00 0.00 174.62 173.47 1qni n TYR 204 N 3.28 0.00 -2.77 0.00 0.18 -1.26 -3.83 117.16 112.76 1qni n TYR 204 Ca -0.17 0.00 -0.27 0.00 1.88 0.00 0.00 57.90 59.34 1qni n TYR 204 Cb 0.56 0.00 -0.02 0.00 -0.38 0.00 0.00 39.34 39.49 1qni n TYR 204 CO 0.00 0.00 0.00 -1.71 -2.08 0.00 0.00 176.86 173.07 1qni n ASN 205 N -0.99 4.50 0.05 9.48 2.85 -1.26 -4.61 115.26 125.27 1qni n ASN 205 Ca 0.00 -3.68 0.07 0.00 -0.11 0.00 0.00 54.58 50.86 1qni n ASN 205 Cb 0.00 -0.52 0.32 0.00 1.24 0.00 0.00 39.78 40.81 1qni n ASN 205 CO 0.00 0.00 0.00 -1.54 -2.11 0.00 0.00 177.26 173.61 1qni n SER 206 N -0.33 0.21 0.03 1.20 3.41 -1.26 -0.59 113.62 116.29 1qni n SER 206 Ca 0.34 0.56 0.12 0.00 -0.26 0.00 0.00 58.87 59.63 1qni n SER 206 Cb 0.50 -0.60 0.25 0.00 -0.26 0.00 0.00 64.21 64.09 1qni n SER 206 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1qni n GLU 207 N -1.74 0.16 -3.97 4.33 4.71 -1.26 -4.49 120.64 118.37 1qni n GLU 207 Ca 0.02 0.05 -0.28 0.00 -0.01 0.00 0.00 57.16 56.95 1qni n GLU 207 Cb 0.14 -1.61 -0.02 0.00 -1.01 0.00 0.00 31.44 28.94 1qni n GLU 207 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 177.13 177.76 1qni n ARG 208 N -1.84 -2.67 -4.26 3.49 1.74 0.24 -4.96 116.66 108.40 1qni n ARG 208 Ca 0.04 0.36 -0.23 0.00 -0.77 0.00 0.00 57.85 57.25 1qni n ARG 208 Cb 0.39 -4.29 -0.07 0.00 -1.02 0.00 0.00 32.46 27.48 1qni n ARG 208 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1qni s ALA 209 N -3.94 3.24 -0.24 7.54 0.00 -1.26 -4.86 121.76 122.24 1qni s ALA 209 Ca 0.07 -1.65 -0.00 0.00 0.00 0.00 0.00 51.96 50.38 1qni s ALA 209 Cb -0.03 -0.83 -0.15 0.00 0.00 0.00 0.00 23.12 22.12 1qni s ALA 209 CO 0.90 0.24 -0.22 1.55 0.00 0.00 0.00 175.76 178.23 1qni n VAL 210 N -0.95 1.34 -2.31 0.00 3.14 -1.26 -4.71 118.33 113.57 1qni n VAL 210 Ca -0.06 -0.49 -0.40 0.00 -2.96 0.00 0.00 64.34 60.43 1qni n VAL 210 Cb 0.59 -1.40 -0.03 0.00 -1.06 0.00 0.00 33.84 31.94 1qni n VAL 210 CO 0.00 0.00 0.00 1.51 -6.46 0.00 0.00 176.83 171.88 1qni s ASP 211 N -6.40 7.03 0.22 6.55 -4.77 -1.26 -4.91 116.67 113.14 1qni s ASP 211 Ca -0.32 2.46 -0.15 0.00 -3.30 0.00 0.00 52.55 51.24 1qni s ASP 211 Cb 0.09 -2.64 0.26 0.00 -1.09 0.00 0.00 42.92 39.54 1qni s ASP 211 CO 0.52 -0.33 1.58 0.25 0.70 0.00 0.00 175.17 177.90 1qni h LEU 212 N 3.60 -1.04 -1.28 2.11 6.46 -2.00 -1.21 115.31 121.94 1qni h LEU 212 Ca -0.48 0.26 0.04 0.00 -0.12 0.00 0.00 57.88 57.58 1qni h LEU 212 Cb 1.22 0.59 -0.04 0.00 -0.73 0.00 0.00 40.66 41.69 1qni h LEU 212 CO 0.66 -0.29 0.51 0.00 -0.62 0.00 0.00 178.44 178.70 1qni h ALA 213 N 1.47 1.55 -0.47 1.25 0.00 -1.98 -2.55 119.26 118.52 1qni h ALA 213 Ca 0.33 -0.04 -0.12 0.00 0.00 0.00 0.00 54.91 55.09 1qni h ALA 213 Cb 0.59 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1qni h ALA 213 CO -0.83 0.37 -0.18 0.78 0.00 0.00 0.00 179.25 179.39 1qni h GLY 214 N 0.93 1.01 2.00 0.00 0.00 -1.61 -2.41 103.07 103.00 1qni h GLY 214 Ca 0.31 -0.86 0.00 0.00 0.00 0.00 0.00 47.33 46.78 1qni h GLY 214 CO -0.09 0.78 0.00 -1.30 0.00 0.00 0.00 176.54 175.93 1qni n THR 215 N -4.12 0.95 0.21 4.70 -2.24 -0.97 -2.10 114.28 110.71 1qni n THR 215 Ca 0.01 0.38 0.05 0.00 -2.27 0.00 0.00 64.05 62.22 1qni n THR 215 Cb 0.43 -1.31 0.09 0.00 -2.10 0.00 0.00 70.33 67.43 1qni n THR 215 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 1qni n MET 216 N -2.14 1.44 0.18 -0.78 2.00 -1.00 -4.71 117.12 112.10 1qni n MET 216 Ca 0.01 -1.50 -0.15 0.00 0.00 0.00 0.00 57.70 56.06 1qni n MET 216 Cb 0.16 -1.23 -0.08 0.00 0.00 0.00 0.00 33.22 32.07 1qni n MET 216 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 175.97 175.88 1qni h ARG 217 N 2.08 -0.71 -6.88 0.03 2.43 -0.94 -3.43 114.38 106.96 1qni h ARG 217 Ca 0.00 0.05 -0.51 0.00 -0.81 0.00 0.00 59.98 58.71 1qni h ARG 217 Cb 0.56 0.16 0.04 0.00 -0.42 0.00 0.00 29.97 30.31 1qni h ARG 217 CO 0.00 -0.47 0.51 -0.80 -1.51 0.00 0.00 179.97 177.69 1qni s ASN 218 N -4.62 6.88 0.34 -3.80 0.01 -1.26 -4.93 114.94 107.56 1qni s ASN 218 Ca -0.17 2.34 0.07 0.00 -0.71 0.00 0.00 52.86 54.40 1qni s ASN 218 Cb 0.06 -2.62 0.62 0.00 0.41 0.00 0.00 41.25 39.72 1qni s ASN 218 CO 0.63 -0.42 1.82 0.44 -1.51 0.00 0.00 177.10 178.06 1qni h ASP 219 N 3.21 0.28 -4.40 -1.22 3.32 -1.99 -3.44 116.42 112.18 1qni h ASP 219 Ca -0.48 -0.08 -0.44 0.00 0.02 0.00 0.00 57.03 56.05 1qni h ASP 219 Cb 1.22 -0.07 -0.22 0.00 0.22 0.00 0.00 39.33 40.47 1qni h ASP 219 CO 0.65 0.52 -0.79 -0.13 -1.72 0.00 0.00 179.24 177.76 1qni s ARG 220 N -4.52 0.90 0.00 3.56 0.52 -1.26 -2.24 118.95 115.90 1qni s ARG 220 Ca -0.05 -0.93 0.00 0.00 -0.52 0.00 0.00 55.73 54.23 1qni s ARG 220 Cb 0.15 -0.94 0.00 0.00 0.52 0.00 0.00 34.95 34.67 1qni s ARG 220 CO 0.75 0.22 0.00 -0.25 0.02 0.00 0.00 175.30 176.04 1qni n ASP 221 N 1.43 0.00 -3.65 0.23 8.00 -0.53 -4.90 116.55 117.13 1qni n ASP 221 Ca -0.20 0.00 0.01 0.00 0.71 0.00 0.00 54.79 55.31 1qni n ASP 221 Cb 0.54 0.00 -0.00 0.00 -0.02 0.00 0.00 41.12 41.64 1qni n ASP 221 CO 0.00 0.00 0.00 -1.66 -0.39 0.00 0.00 177.20 175.15 1qni s TRP 222 N 3.87 -0.03 -0.18 1.24 -2.14 -1.25 -2.64 118.94 117.81 1qni s TRP 222 Ca 0.00 -0.10 0.00 0.00 2.66 0.00 0.00 56.10 58.67 1qni s TRP 222 Cb 0.00 0.56 0.01 0.00 -3.10 0.00 0.00 33.47 30.94 1qni s TRP 222 CO 0.00 -0.33 -0.17 0.08 -2.66 0.00 0.00 176.95 173.87 1qni s VAL 223 N -2.38 2.32 -0.21 -0.66 1.01 -0.47 -1.16 120.40 118.84 1qni s VAL 223 Ca 0.17 -0.86 -0.18 0.00 0.00 0.00 0.00 61.98 61.11 1qni s VAL 223 Cb 0.03 -1.98 -0.03 0.00 0.00 0.00 0.00 36.38 34.40 1qni s VAL 223 CO -0.03 0.52 0.49 -0.69 0.00 0.00 0.00 175.10 175.40 1qni s VAL 224 N 1.20 5.12 -0.20 2.92 1.01 0.61 -1.55 120.40 129.50 1qni s VAL 224 Ca 0.02 0.89 -0.09 0.00 0.00 0.00 0.00 61.98 62.80 1qni s VAL 224 Cb -0.14 -3.81 -0.04 0.00 0.00 0.00 0.00 36.38 32.38 1qni s VAL 224 CO -0.09 0.17 0.10 -0.69 0.00 0.00 0.00 175.10 174.59 1qni s VAL 225 N 1.71 5.05 -0.19 2.92 1.01 -0.18 -1.33 120.40 129.39 1qni s VAL 225 Ca 0.22 0.06 -0.07 0.00 0.00 0.00 0.00 61.98 62.19 1qni s VAL 225 Cb -0.15 -3.30 -0.04 0.00 0.00 0.00 0.00 36.38 32.89 1qni s VAL 225 CO 0.09 0.44 0.07 -0.36 0.00 0.00 0.00 175.10 175.34 1qni s PHE 226 N 0.46 3.22 -0.87 5.22 0.08 0.16 -2.01 117.98 124.25 1qni s PHE 226 Ca 0.05 0.01 -0.18 0.00 0.12 0.00 0.00 56.93 56.93 1qni s PHE 226 Cb -0.12 -2.11 0.14 0.00 -0.57 0.00 0.00 43.02 40.36 1qni s PHE 226 CO -0.00 0.08 1.03 1.21 -0.10 0.00 0.00 175.22 177.43 1qni s ASN 227 N 0.56 6.58 0.24 1.36 3.84 -0.46 -2.35 114.94 124.72 1qni s ASN 227 Ca 0.03 -2.03 -0.07 0.00 0.21 0.00 0.00 52.86 51.01 1qni s ASN 227 Cb -0.13 -2.36 0.26 0.00 -0.55 0.00 0.00 41.25 38.47 1qni s ASN 227 CO 0.01 -1.02 1.89 0.58 -2.79 0.00 0.00 177.10 175.77 1qni h VAL 228 N 5.68 1.16 -0.63 -5.21 2.07 -1.07 -1.44 116.25 116.81 1qni h VAL 228 Ca 0.08 -0.39 0.11 0.00 0.82 0.00 0.00 66.70 67.33 1qni h VAL 228 Cb 1.03 -0.06 -0.08 0.00 -1.52 0.00 0.00 31.29 30.66 1qni h VAL 228 CO 1.05 0.20 0.20 -0.08 0.02 0.00 0.00 177.57 178.97 1qni h GLU 229 N 1.12 0.35 0.00 1.57 4.81 -1.82 0.70 114.58 121.32 1qni h GLU 229 Ca 0.35 -0.02 -0.15 0.00 -0.13 0.00 0.00 59.36 59.40 1qni h GLU 229 Cb -0.02 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.26 1qni h GLU 229 CO -0.11 0.23 -0.71 0.00 -0.73 0.00 0.00 179.01 177.69 1qni h ARG 230 N 0.36 0.00 -0.16 1.92 3.08 -1.76 -2.79 114.38 115.03 1qni h ARG 230 Ca 0.33 0.00 -0.21 0.00 0.07 0.00 0.00 59.98 60.17 1qni h ARG 230 Cb 0.46 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.51 1qni h ARG 230 CO -0.36 0.71 -0.73 0.82 -1.07 0.00 0.00 179.97 179.35 1qni h ILE 231 N 0.00 1.30 -0.42 2.04 2.04 -0.23 -2.37 117.51 119.87 1qni h ILE 231 Ca -0.01 -1.97 -0.15 0.00 1.00 0.00 0.00 64.86 63.73 1qni h ILE 231 Cb 1.31 1.95 -0.01 0.00 -0.74 0.00 0.00 36.82 39.33 1qni h ILE 231 CO 0.09 0.62 -0.33 0.00 0.00 0.00 0.00 178.15 178.53 1qni h ALA 232 N 0.67 0.60 -0.30 1.87 0.00 -0.95 -2.07 119.26 119.09 1qni h ALA 232 Ca -0.04 -0.44 0.02 0.00 0.00 0.00 0.00 54.91 54.45 1qni h ALA 232 Cb 1.34 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.98 1qni h ALA 232 CO 0.15 0.68 0.16 0.00 0.00 0.00 0.00 179.25 180.23 1qni h ALA 233 N 0.80 0.36 -0.80 0.00 0.00 -1.49 0.28 119.26 118.42 1qni h ALA 233 Ca 0.08 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 1qni h ALA 233 Cb 0.93 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.61 1qni h ALA 233 CO 0.09 -0.22 0.45 0.00 0.00 0.00 0.00 179.25 179.57 1qni h ALA 234 N 1.14 1.03 -0.47 0.00 0.00 -1.33 -1.71 119.26 117.92 1qni h ALA 234 Ca 0.12 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 1qni h ALA 234 Cb 0.02 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.47 1qni h ALA 234 CO -0.07 0.52 0.04 0.28 0.00 0.00 0.00 179.25 180.02 1qni h VAL 235 N 1.11 1.26 -0.90 0.00 2.07 -0.91 -0.87 116.25 118.01 1qni h VAL 235 Ca 0.28 -0.98 -0.01 0.00 0.82 0.00 0.00 66.70 66.81 1qni h VAL 235 Cb 0.01 0.98 -0.04 0.00 -1.52 0.00 0.00 31.29 30.72 1qni h VAL 235 CO -0.05 0.34 0.53 0.50 0.02 0.00 0.00 177.57 178.92 1qni h LYS 236 N 0.66 1.23 0.00 1.57 3.64 -0.63 -1.03 116.57 122.01 1qni h LYS 236 Ca 0.14 -0.12 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 1qni h LYS 236 Cb 0.45 -0.25 0.00 0.00 -0.41 0.00 0.00 32.23 32.01 1qni h LYS 236 CO 0.02 0.87 0.00 0.00 -2.27 0.00 0.00 179.45 178.07 1qni n ALA 237 N -2.39 2.40 -1.10 5.00 0.00 -0.67 -4.86 120.51 118.89 1qni n ALA 237 Ca 0.10 -0.15 -0.03 0.00 0.00 0.00 0.00 53.44 53.35 1qni n ALA 237 Cb 0.07 -1.38 -0.01 0.00 0.00 0.00 0.00 19.45 18.12 1qni n ALA 237 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1qni n GLY 238 N 0.52 0.64 3.46 0.00 0.00 -0.39 -4.95 105.19 104.47 1qni n GLY 238 Ca 0.18 -0.44 -0.44 0.00 0.00 0.00 0.00 46.02 45.31 1qni n GLY 238 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1qni s ASN 239 N -2.53 6.99 0.27 1.61 0.01 -0.35 -4.90 114.94 116.03 1qni s ASN 239 Ca 0.00 -2.82 -0.21 0.00 -0.71 0.00 0.00 52.86 49.13 1qni s ASN 239 Cb 0.00 -2.40 0.04 0.00 0.41 0.00 0.00 41.25 39.30 1qni s ASN 239 CO 0.00 -0.80 0.79 0.72 -1.51 0.00 0.00 177.10 176.29 1qni s PHE 240 N 1.77 -0.11 0.44 2.20 -0.12 -1.26 -4.56 117.98 116.33 1qni s PHE 240 Ca 0.41 -0.36 0.04 0.00 -0.05 0.00 0.00 56.93 56.96 1qni s PHE 240 Cb -0.03 0.72 -0.02 0.00 -0.63 0.00 0.00 43.02 43.06 1qni s PHE 240 CO -0.02 -1.22 0.13 0.15 -0.05 0.00 0.00 175.22 174.21 1qni s LYS 241 N -3.45 2.02 0.12 1.99 1.02 -0.44 -4.88 119.74 116.11 1qni s LYS 241 Ca 0.12 -2.25 0.04 0.00 0.02 0.00 0.00 55.97 53.90 1qni s LYS 241 Cb -0.05 -0.68 -0.04 0.00 -0.52 0.00 0.00 37.83 36.54 1qni s LYS 241 CO 0.07 -0.52 -0.11 0.95 -0.92 0.00 0.00 175.35 174.83 1qni s THR 242 N -3.14 1.09 -0.05 2.17 -4.23 -1.26 -0.69 115.64 109.53 1qni s THR 242 Ca 0.20 -1.82 0.04 0.00 -1.18 0.00 0.00 61.69 58.93 1qni s THR 242 Cb 0.01 -1.58 -0.00 0.00 1.34 0.00 0.00 72.50 72.27 1qni s THR 242 CO 0.13 -0.61 -0.18 -0.63 -0.54 0.00 0.00 174.62 172.78 1qni s ILE 243 N -2.76 1.54 0.00 2.99 1.01 -1.26 -5.03 121.20 117.70 1qni s ILE 243 Ca 0.10 -0.77 0.00 0.00 0.00 0.00 0.00 60.65 59.99 1qni s ILE 243 Cb -0.01 -1.32 0.00 0.00 0.01 0.00 0.00 42.46 41.14 1qni s ILE 243 CO 0.01 0.44 0.00 0.61 0.00 0.00 0.00 174.94 176.00 1qni n GLY 244 N 3.19 2.73 0.22 6.18 0.00 -1.26 -2.41 105.19 113.84 1qni n GLY 244 Ca -0.18 -0.28 0.10 0.00 0.00 0.00 0.00 46.02 45.65 1qni n GLY 244 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1qni n ASP 245 N 1.03 0.66 -4.83 1.61 8.00 -1.26 -4.89 116.55 116.87 1qni n ASP 245 Ca 0.00 -1.53 -0.38 0.00 0.71 0.00 0.00 54.79 53.59 1qni n ASP 245 Cb 0.00 -0.04 -0.06 0.00 -0.02 0.00 0.00 41.12 41.00 1qni n ASP 245 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 1qni s SER 246 N -1.58 6.71 0.00 -2.24 0.15 -1.01 -4.96 113.70 110.77 1qni s SER 246 Ca 0.30 0.85 0.25 0.00 0.70 0.00 0.00 55.95 58.04 1qni s SER 246 Cb 0.15 -2.22 0.74 0.00 -1.71 0.00 0.00 66.02 62.98 1qni s SER 246 CO 0.23 0.32 1.56 0.29 1.20 0.00 0.00 173.24 176.84 1qni n LYS 247 N 2.02 1.90 -1.81 5.44 4.76 -1.26 -4.04 118.16 125.17 1qni n LYS 247 Ca -0.15 -1.33 -0.41 0.00 -2.87 0.00 0.00 58.31 53.55 1qni n LYS 247 Cb 0.53 -1.46 -0.02 0.00 -1.84 0.00 0.00 35.03 32.24 1qni n LYS 247 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1qni s VAL 248 N -1.91 2.15 0.18 -0.18 1.01 -1.26 -4.93 120.40 115.46 1qni s VAL 248 Ca 0.35 0.13 -0.31 0.00 0.00 0.00 0.00 61.98 62.14 1qni s VAL 248 Cb 0.20 -3.08 -0.09 0.00 0.00 0.00 0.00 36.38 33.41 1qni s VAL 248 CO 0.31 0.02 1.46 -2.84 0.00 0.00 0.00 175.10 174.05 1qni s PRO 249 N -0.58 4.28 -0.10 2.72 0.02 -1.26 -4.57 135.00 135.49 1qni s PRO 249 Ca 0.62 2.24 0.02 0.00 0.02 0.00 0.00 61.00 63.89 1qni s PRO 249 Cb -0.47 -3.17 0.01 0.00 0.02 0.00 0.00 34.50 30.90 1qni s PRO 249 CO 0.48 -0.47 -0.15 0.08 -0.33 0.00 0.00 177.00 176.61 1qni s VAL 250 N 0.70 1.44 0.13 3.83 1.01 0.14 -1.31 120.40 126.33 1qni s VAL 250 Ca 0.64 -0.61 0.07 0.00 0.00 0.00 0.00 61.98 62.09 1qni s VAL 250 Cb -0.41 -1.32 -0.04 0.00 0.00 0.00 0.00 36.38 34.61 1qni s VAL 250 CO 0.35 0.43 -0.09 0.68 0.00 0.00 0.00 175.10 176.47 1qni s VAL 251 N 0.99 3.37 -0.25 2.92 -7.23 -0.49 -1.33 120.40 118.38 1qni s VAL 251 Ca -0.07 -1.37 -0.16 0.00 -1.81 0.00 0.00 61.98 58.57 1qni s VAL 251 Cb -0.15 -2.61 -0.03 0.00 0.56 0.00 0.00 36.38 34.15 1qni s VAL 251 CO -0.01 0.04 0.43 -0.62 -0.31 0.00 0.00 175.10 174.63 1qni s ASP 252 N -2.41 6.36 -0.09 4.85 -1.08 -1.26 -1.56 116.67 121.47 1qni s ASP 252 Ca 0.23 0.43 0.13 0.00 -0.52 0.00 0.00 52.55 52.81 1qni s ASP 252 Cb -0.10 -2.24 0.33 0.00 -1.46 0.00 0.00 42.92 39.45 1qni s ASP 252 CO 0.15 -0.19 1.25 0.61 0.52 0.00 0.00 175.17 177.51 1qni n GLY 253 N 4.38 3.75 3.80 2.66 0.00 0.76 -4.83 105.19 115.72 1qni n GLY 253 Ca -0.07 -0.73 -0.34 0.00 0.00 0.00 0.00 46.02 44.88 1qni n GLY 253 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1qni s ARG 254 N -2.09 4.22 3.84 1.61 0.52 -1.16 -4.63 118.95 121.25 1qni s ARG 254 Ca 0.28 1.25 0.00 0.00 -0.52 0.00 0.00 55.73 56.74 1qni s ARG 254 Cb 0.22 -2.33 0.00 0.00 0.52 0.00 0.00 34.95 33.36 1qni s ARG 254 CO 0.08 -0.05 0.00 0.41 0.02 0.00 0.00 175.30 175.76 1qni n GLY 255 N -0.23 1.86 3.59 -3.53 0.00 -1.26 -4.25 105.19 101.37 1qni n GLY 255 Ca 0.06 -0.46 -0.42 0.00 0.00 0.00 0.00 46.02 45.20 1qni n GLY 255 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1qni s GLU 256 N 0.00 3.32 0.07 1.61 2.02 -1.26 -4.94 118.70 119.52 1qni s GLU 256 Ca 0.00 0.87 0.02 0.00 0.02 0.00 0.00 54.97 55.88 1qni s GLU 256 Cb 0.00 -4.14 -0.03 0.00 0.10 0.00 0.00 34.13 30.06 1qni s GLU 256 CO 0.00 -1.89 -0.08 0.45 0.02 0.00 0.00 175.26 173.77 1qni s SER 257 N 5.10 1.03 0.26 -0.19 0.15 -1.26 -5.01 113.70 113.78 1qni s SER 257 Ca 0.64 -0.74 0.25 0.00 0.70 0.00 0.00 55.95 56.80 1qni s SER 257 Cb -0.15 0.05 0.66 0.00 -1.71 0.00 0.00 66.02 64.87 1qni s SER 257 CO 0.29 -0.30 1.70 1.05 1.20 0.00 0.00 173.24 177.18 1qni h GLU 258 N 3.86 0.00 0.10 5.44 4.11 -1.93 -3.28 114.58 122.87 1qni h GLU 258 Ca -0.36 0.00 -0.28 0.00 0.07 0.00 0.00 59.36 58.79 1qni h GLU 258 Cb 1.19 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.43 1qni h GLU 258 CO 0.50 0.00 -1.38 0.74 0.07 0.00 0.00 179.01 178.95 1qni h PHE 259 N 0.00 0.38 -2.87 2.06 0.04 -1.91 -3.45 116.94 111.18 1qni h PHE 259 Ca 0.00 -0.27 -0.45 0.00 2.80 0.00 0.00 57.97 60.05 1qni h PHE 259 Cb 0.81 -0.02 -0.14 0.00 2.20 0.00 0.00 35.95 38.80 1qni h PHE 259 CO 0.00 1.27 -0.70 0.95 -0.60 0.00 0.00 178.31 179.23 1qni s THR 260 N -2.64 1.60 -0.07 -1.55 -4.23 -1.24 -1.36 115.64 106.15 1qni s THR 260 Ca -0.06 -2.15 -0.03 0.00 -1.18 0.00 0.00 61.69 58.27 1qni s THR 260 Cb 0.07 -2.20 0.04 0.00 1.34 0.00 0.00 72.50 71.75 1qni s THR 260 CO 0.86 -0.48 0.14 -0.60 -0.54 0.00 0.00 174.62 174.00 1qni s ARG 261 N -3.70 0.03 -0.61 3.99 6.06 -0.85 -4.40 118.95 119.46 1qni s ARG 261 Ca 0.25 0.49 -0.14 0.00 -2.50 0.00 0.00 55.73 53.83 1qni s ARG 261 Cb 0.02 -0.28 0.15 0.00 0.06 0.00 0.00 34.95 34.90 1qni s ARG 261 CO 0.08 -0.28 0.55 0.71 -2.50 0.00 0.00 175.30 173.87 1qni s TYR 262 N 2.01 3.42 -0.57 5.12 1.51 -1.26 -1.01 117.35 126.58 1qni s TYR 262 Ca 0.00 -1.62 -0.25 0.00 -1.01 0.00 0.00 57.07 54.19 1qni s TYR 262 Cb -0.12 -3.74 0.04 0.00 -0.11 0.00 0.00 41.96 38.03 1qni s TYR 262 CO -0.05 -1.00 1.01 0.42 -1.11 0.00 0.00 175.55 174.81 1qni s ILE 263 N 1.10 4.29 0.01 2.71 1.01 -0.60 -4.87 121.20 124.85 1qni s ILE 263 Ca 0.08 0.40 -0.34 0.00 0.00 0.00 0.00 60.65 60.80 1qni s ILE 263 Cb -0.24 -4.60 -0.12 0.00 0.01 0.00 0.00 42.46 37.52 1qni s ILE 263 CO -0.01 -1.19 1.78 -0.81 0.00 0.00 0.00 174.94 174.71 1qni n PRO 264 N 7.74 2.23 -4.66 2.79 -0.04 -1.26 -1.37 135.00 140.41 1qni n PRO 264 Ca 0.03 0.81 -0.24 0.00 -0.04 0.00 0.00 63.50 64.07 1qni n PRO 264 Cb 0.48 -2.64 -0.16 0.00 -0.04 0.00 0.00 33.50 31.14 1qni n PRO 264 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1qni s VAL 265 N 2.97 1.17 -0.24 0.52 1.01 -1.08 -4.90 120.40 119.85 1qni s VAL 265 Ca 0.87 -0.59 -0.42 0.00 0.00 0.00 0.00 61.98 61.85 1qni s VAL 265 Cb -0.67 -1.01 -0.18 0.00 0.00 0.00 0.00 36.38 34.53 1qni s VAL 265 CO 0.46 0.34 1.51 -2.65 0.00 0.00 0.00 175.10 174.77 1qni n PRO 266 N 3.08 0.58 0.00 2.72 -0.02 -1.26 -1.45 135.00 138.64 1qni n PRO 266 Ca -0.17 0.21 0.00 0.00 -2.02 0.00 0.00 63.50 61.52 1qni n PRO 266 Cb 0.54 -1.80 0.00 0.00 -0.02 0.00 0.00 33.50 32.22 1qni n PRO 266 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1qni n LYS 267 N 3.78 0.00 -4.18 -0.52 5.02 -0.95 -3.84 118.16 117.48 1qni n LYS 267 Ca 0.25 0.00 -0.30 0.00 -2.02 0.00 0.00 58.31 56.25 1qni n LYS 267 Cb 0.07 0.00 -0.06 0.00 -0.02 0.00 0.00 35.03 35.02 1qni n LYS 267 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1qni n ASN 268 N 0.97 0.00 -4.49 4.39 4.13 -1.26 -2.83 115.26 116.17 1qni n ASN 268 Ca 0.00 -1.15 -0.40 0.00 1.68 0.00 0.00 54.58 54.71 1qni n ASN 268 Cb 0.00 -2.26 0.02 0.00 -1.54 0.00 0.00 39.78 36.00 1qni n ASN 268 CO 0.00 0.00 0.00 -0.81 0.28 0.00 0.00 177.26 176.73 1qni n PRO 269 N -4.47 0.68 0.00 3.52 -0.04 -1.25 -4.57 135.00 128.86 1qni n PRO 269 Ca -0.27 0.25 0.00 0.00 -0.04 0.00 0.00 63.50 63.44 1qni n PRO 269 Cb 0.67 -1.70 0.00 0.00 -0.04 0.00 0.00 33.50 32.43 1qni n PRO 269 CO 0.00 0.00 0.00 1.58 -0.04 0.00 0.00 175.50 177.04 1qni n HIS 270 N -1.20 0.00 -1.96 0.54 -0.00 -0.44 -4.35 115.22 107.81 1qni n HIS 270 Ca 0.11 0.00 -0.34 0.00 0.46 0.00 0.00 57.72 57.96 1qni n HIS 270 Cb 0.43 0.00 0.03 0.00 -0.12 0.00 0.00 29.99 30.33 1qni n HIS 270 CO 0.00 0.00 0.00 0.20 0.46 0.00 0.00 176.34 177.00 1qni s GLY 271 N -1.47 2.30 -0.25 1.57 0.00 0.14 -3.84 107.32 105.77 1qni s GLY 271 Ca 0.00 0.62 -0.03 0.00 0.00 0.00 0.00 44.72 45.31 1qni s GLY 271 CO 0.00 0.96 0.21 -2.27 0.00 0.00 0.00 173.10 172.01 1qni s LEU 272 N -4.47 0.04 0.05 0.66 0.20 -1.25 -0.77 118.68 113.15 1qni s LEU 272 Ca 0.68 -0.69 0.09 0.00 0.69 0.00 0.00 54.13 54.91 1qni s LEU 272 Cb -0.21 0.19 -0.03 0.00 -0.43 0.00 0.00 46.19 45.71 1qni s LEU 272 CO 0.36 -0.38 -0.25 0.20 -0.29 0.00 0.00 176.35 176.00 1qni s ASN 273 N 2.27 3.33 -0.17 3.68 -0.87 0.34 -4.20 114.94 119.32 1qni s ASN 273 Ca 0.08 -0.57 -0.10 0.00 -1.57 0.00 0.00 52.86 50.70 1qni s ASN 273 Cb -0.15 -0.35 -0.05 0.00 -0.02 0.00 0.00 41.25 40.68 1qni s ASN 273 CO -0.24 0.25 0.15 -0.89 -2.57 0.00 0.00 177.10 173.80 1qni s THR 274 N -0.86 5.42 0.54 1.60 2.01 -1.26 -0.01 115.64 123.07 1qni s THR 274 Ca 0.13 0.24 -0.18 0.00 0.31 0.00 0.00 61.69 62.19 1qni s THR 274 Cb -0.10 -3.47 -0.06 0.00 0.01 0.00 0.00 72.50 68.88 1qni s THR 274 CO 0.03 0.48 1.06 -0.94 -0.69 0.00 0.00 174.62 174.57 1qni s SER 275 N 0.02 5.98 0.35 3.53 1.04 -0.73 -4.89 113.70 119.00 1qni s SER 275 Ca 0.11 1.93 0.05 0.00 0.48 0.00 0.00 55.95 58.52 1qni s SER 275 Cb -0.12 -2.55 0.71 0.00 0.10 0.00 0.00 66.02 64.16 1qni s SER 275 CO 0.00 -1.04 1.95 -0.65 0.98 0.00 0.00 173.24 174.49 1qni h PRO 276 N 1.02 0.78 0.00 4.02 0.11 -1.84 -0.30 132.00 135.78 1qni h PRO 276 Ca -0.48 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.58 1qni h PRO 276 Cb 1.23 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.16 1qni h PRO 276 CO 0.58 0.51 0.00 -0.40 -0.21 0.00 0.00 178.00 178.48 1qni n ASP 277 N -4.48 0.07 -0.34 -2.05 5.68 -1.26 -4.60 116.55 109.56 1qni n ASP 277 Ca 0.11 0.52 -0.04 0.00 -0.50 0.00 0.00 54.79 54.88 1qni n ASP 277 Cb 0.21 -0.54 -0.02 0.00 -1.14 0.00 0.00 41.12 39.64 1qni n ASP 277 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1qni n GLY 278 N -0.73 0.72 0.18 6.12 0.00 -0.12 -4.92 105.19 106.43 1qni n GLY 278 Ca 0.02 -0.58 0.02 0.00 0.00 0.00 0.00 46.02 45.47 1qni n GLY 278 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1qni n LYS 279 N -2.58 1.05 -4.02 1.61 2.85 -1.26 -4.51 118.16 111.30 1qni n LYS 279 Ca -0.04 -1.15 -0.15 0.00 -1.05 0.00 0.00 58.31 55.92 1qni n LYS 279 Cb 0.18 -1.08 -0.14 0.00 -0.65 0.00 0.00 35.03 33.34 1qni n LYS 279 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 177.40 178.06 1qni s TYR 280 N -0.62 0.27 -0.31 5.58 2.02 -1.26 -2.21 117.35 120.82 1qni s TYR 280 Ca 0.06 -0.04 -0.05 0.00 -0.37 0.00 0.00 57.07 56.67 1qni s TYR 280 Cb 0.04 -0.20 0.03 0.00 -0.40 0.00 0.00 41.96 41.43 1qni s TYR 280 CO 0.05 -0.02 0.05 -0.06 -1.57 0.00 0.00 175.55 174.00 1qni s PHE 281 N 0.08 3.21 -0.25 2.71 0.08 -0.18 -1.77 117.98 121.86 1qni s PHE 281 Ca -0.00 -1.47 -0.07 0.00 0.12 0.00 0.00 56.93 55.50 1qni s PHE 281 Cb -0.03 -2.20 -0.03 0.00 -0.57 0.00 0.00 43.02 40.20 1qni s PHE 281 CO -0.00 -0.72 0.07 0.42 -0.10 0.00 0.00 175.22 174.89 1qni s ILE 282 N 1.37 4.33 -0.19 0.64 1.01 0.98 -0.59 121.20 128.75 1qni s ILE 282 Ca -0.02 -0.17 -0.08 0.00 0.00 0.00 0.00 60.65 60.38 1qni s ILE 282 Cb -0.19 -3.02 -0.04 0.00 0.01 0.00 0.00 42.46 39.22 1qni s ILE 282 CO 0.01 0.34 0.09 0.00 0.00 0.00 0.00 174.94 175.38 1qni s ALA 283 N 1.59 3.53 -0.13 9.38 0.00 0.01 -0.50 121.76 135.64 1qni s ALA 283 Ca 0.06 -0.72 -0.22 0.00 0.00 0.00 0.00 51.96 51.08 1qni s ALA 283 Cb -0.15 -2.01 -0.03 0.00 0.00 0.00 0.00 23.12 20.93 1qni s ALA 283 CO 0.04 0.19 0.68 -0.80 0.00 0.00 0.00 175.76 175.87 1qni s ASN 284 N 0.30 6.86 0.35 0.00 0.01 0.05 -0.54 114.94 121.97 1qni s ASN 284 Ca 0.05 1.05 0.26 0.00 -0.71 0.00 0.00 52.86 53.51 1qni s ASN 284 Cb -0.12 -2.39 1.21 0.00 0.41 0.00 0.00 41.25 40.36 1qni s ASN 284 CO -0.01 -0.20 1.78 1.23 -1.51 0.00 0.00 177.10 178.39 1qni h GLY 285 N 7.47 0.00 0.00 0.66 0.00 -1.20 -1.17 103.07 108.82 1qni h GLY 285 Ca -0.36 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.97 1qni h GLY 285 CO 0.77 0.00 0.00 1.17 0.00 0.00 0.00 176.54 178.48 1qni n LYS 286 N -2.41 0.00 0.12 4.80 4.81 0.75 0.07 118.16 126.30 1qni n LYS 286 Ca 0.00 0.00 0.10 0.00 -0.87 0.00 0.00 58.31 57.54 1qni n LYS 286 Cb 0.16 0.00 0.47 0.00 0.02 0.00 0.00 35.03 35.68 1qni n LYS 286 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 1qni n LEU 287 N 0.00 0.51 -4.41 3.14 4.77 -1.13 -3.30 117.00 116.58 1qni n LEU 287 Ca 0.00 0.68 -0.34 0.00 -0.03 0.00 0.00 56.01 56.32 1qni n LEU 287 Cb 0.00 -0.67 -0.13 0.00 -2.33 0.00 0.00 43.42 40.29 1qni n LEU 287 CO 0.00 -0.69 -0.38 -0.55 -1.33 0.00 0.00 177.39 174.44 1qni s SER 288 N -3.94 4.50 0.00 -1.43 0.15 0.11 -4.92 113.70 108.17 1qni s SER 288 Ca 0.01 -0.25 0.00 0.00 0.70 0.00 0.00 55.95 56.41 1qni s SER 288 Cb 0.07 -1.74 0.00 0.00 -1.71 0.00 0.00 66.02 62.64 1qni s SER 288 CO 0.26 0.10 0.23 -0.81 1.20 0.00 0.00 173.24 174.22 1qni n PRO 289 N 3.98 0.27 -3.29 5.44 -0.04 -1.26 -4.22 135.00 135.88 1qni n PRO 289 Ca -0.18 0.00 -0.15 0.00 -0.04 0.00 0.00 63.50 63.13 1qni n PRO 289 Cb 0.52 -1.29 -0.03 0.00 -0.04 0.00 0.00 33.50 32.66 1qni n PRO 289 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1qni n THR 290 N 0.70 0.00 -3.92 0.52 -2.24 -1.26 0.09 114.28 108.16 1qni n THR 290 Ca 0.00 -1.17 -0.10 0.00 -2.27 0.00 0.00 64.05 60.50 1qni n THR 290 Cb 0.11 0.27 -0.12 0.00 -2.10 0.00 0.00 70.33 68.49 1qni n THR 290 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1qni s VAL 291 N -1.96 0.07 -0.17 2.28 1.01 -1.02 -1.18 120.40 119.42 1qni s VAL 291 Ca 0.02 -0.59 0.01 0.00 0.00 0.00 0.00 61.98 61.42 1qni s VAL 291 Cb 0.00 -0.22 0.02 0.00 0.00 0.00 0.00 36.38 36.17 1qni s VAL 291 CO 0.01 -0.32 -0.19 -0.44 0.00 0.00 0.00 175.10 174.16 1qni s SER 292 N -0.98 3.23 -0.45 3.32 0.01 0.30 -3.42 113.70 115.72 1qni s SER 292 Ca -0.11 -0.62 -0.12 0.00 1.31 0.00 0.00 55.95 56.41 1qni s SER 292 Cb -0.07 -1.49 0.08 0.00 0.21 0.00 0.00 66.02 64.75 1qni s SER 292 CO -0.00 0.02 0.33 -0.69 0.41 0.00 0.00 173.24 173.30 1qni s VAL 293 N 1.19 4.71 -0.14 3.43 1.01 -0.13 -0.81 120.40 129.67 1qni s VAL 293 Ca 0.02 -1.26 -0.19 0.00 0.00 0.00 0.00 61.98 60.55 1qni s VAL 293 Cb -0.14 -3.86 -0.04 0.00 0.00 0.00 0.00 36.38 32.35 1qni s VAL 293 CO -0.10 -0.55 0.54 -0.63 0.00 0.00 0.00 175.10 174.36 1qni s ILE 294 N 1.53 5.13 -0.38 2.22 1.01 0.24 -0.92 121.20 130.02 1qni s ILE 294 Ca 0.04 1.06 -0.25 0.00 0.00 0.00 0.00 60.65 61.49 1qni s ILE 294 Cb -0.24 -3.87 0.02 0.00 0.01 0.00 0.00 42.46 38.38 1qni s ILE 294 CO 0.04 0.26 0.89 0.00 0.00 0.00 0.00 174.94 176.13 1qni s ALA 295 N 1.01 3.38 0.41 9.38 0.00 -0.14 -1.01 121.76 134.78 1qni s ALA 295 Ca 0.28 -0.56 0.35 0.00 0.00 0.00 0.00 51.96 52.03 1qni s ALA 295 Cb -0.16 -3.51 1.75 0.00 0.00 0.00 0.00 23.12 21.21 1qni s ALA 295 CO 0.11 -1.65 2.15 0.82 0.00 0.00 0.00 175.76 177.19 1qni h ILE 296 N 5.85 0.22 0.00 0.00 2.04 -1.78 -2.18 117.51 121.65 1qni h ILE 296 Ca -0.24 -0.35 -0.06 0.00 1.00 0.00 0.00 64.86 65.22 1qni h ILE 296 Cb 1.08 1.28 -0.01 0.00 -0.74 0.00 0.00 36.82 38.43 1qni h ILE 296 CO 0.97 0.04 -0.27 -0.78 0.00 0.00 0.00 178.15 178.12 1qni h ASP 297 N 0.00 0.00 -0.10 1.72 1.82 -1.90 -2.59 116.42 115.37 1qni h ASP 297 Ca -0.00 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 1qni h ASP 297 Cb 0.27 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.28 1qni h ASP 297 CO 0.01 0.27 0.00 0.29 -1.61 0.00 0.00 179.24 178.20 1qni n LYS 298 N -4.17 1.90 -0.04 0.28 5.02 -0.82 -4.25 118.16 116.08 1qni n LYS 298 Ca -0.02 -1.33 -0.05 0.00 -2.02 0.00 0.00 58.31 54.89 1qni n LYS 298 Cb 0.32 -1.46 0.16 0.00 -0.02 0.00 0.00 35.03 34.04 1qni n LYS 298 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 1qni h LEU 299 N 2.98 0.63 -0.13 -0.35 3.38 -1.53 -2.24 115.31 118.05 1qni h LEU 299 Ca 0.00 -0.21 0.02 0.00 0.09 0.00 0.00 57.88 57.79 1qni h LEU 299 Cb 0.64 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.20 1qni h LEU 299 CO 0.00 0.83 -0.00 0.44 0.09 0.00 0.00 178.44 179.80 1qni h ASP 300 N 0.56 -0.06 -0.01 -0.43 3.32 -1.77 -1.66 116.42 116.38 1qni h ASP 300 Ca 0.09 0.03 -0.05 0.00 0.02 0.00 0.00 57.03 57.12 1qni h ASP 300 Cb 0.65 0.05 -0.01 0.00 0.22 0.00 0.00 39.33 40.24 1qni h ASP 300 CO 0.05 -0.01 -0.12 0.44 -1.72 0.00 0.00 179.24 177.88 1qni h ASP 301 N 0.04 0.26 -0.15 6.45 3.32 -1.82 -2.85 116.42 121.68 1qni h ASP 301 Ca 0.06 -0.05 -0.09 0.00 0.02 0.00 0.00 57.03 56.97 1qni h ASP 301 Cb 0.08 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 39.54 1qni h ASP 301 CO -0.11 0.42 -0.18 0.25 -1.72 0.00 0.00 179.24 177.89 1qni h LEU 302 N 0.26 0.55 -0.48 1.55 5.85 -0.72 -0.02 115.31 122.30 1qni h LEU 302 Ca 0.05 -0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.60 1qni h LEU 302 Cb 0.38 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.26 1qni h LEU 302 CO 0.02 0.75 0.00 0.49 -0.34 0.00 0.00 178.44 179.36 1qni n PHE 303 N -4.15 0.15 0.04 1.25 3.01 -0.70 -2.16 117.46 114.90 1qni n PHE 303 Ca 0.00 -0.08 0.01 0.00 1.01 0.00 0.00 57.45 58.39 1qni n PHE 303 Cb 0.37 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.85 1qni n PHE 303 CO 0.00 0.00 0.00 -1.91 1.01 0.00 0.00 176.76 175.86 1qni n GLU 304 N -0.18 0.09 -1.99 -1.08 4.07 -0.74 -4.99 120.64 115.82 1qni n GLU 304 Ca 0.08 -0.49 -0.18 0.00 -0.06 0.00 0.00 57.16 56.51 1qni n GLU 304 Cb 0.13 -0.96 -0.04 0.00 -0.06 0.00 0.00 31.44 30.52 1qni n GLU 304 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82 1qni n ASP 305 N -0.08 -5.14 0.21 4.31 8.00 -0.68 -4.87 116.55 118.31 1qni n ASP 305 Ca 0.01 0.17 0.13 0.00 0.71 0.00 0.00 54.79 55.81 1qni n ASP 305 Cb 0.02 -4.21 0.26 0.00 -0.02 0.00 0.00 41.12 37.18 1qni n ASP 305 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 1qni h LYS 306 N 0.00 0.00 -4.81 -1.24 1.57 -1.29 -3.46 116.57 107.34 1qni h LYS 306 Ca -0.39 0.00 -0.33 0.00 -1.87 0.00 0.00 60.65 58.06 1qni h LYS 306 Cb 1.24 0.00 -0.14 0.00 0.08 0.00 0.00 32.23 33.41 1qni h LYS 306 CO 0.51 0.00 -0.61 0.96 -0.57 0.00 0.00 179.45 179.74 1qni s ILE 307 N -3.25 0.37 0.41 1.86 -4.36 -1.25 -5.02 121.20 109.96 1qni s ILE 307 Ca 0.07 -2.00 -0.16 0.00 -0.26 0.00 0.00 60.65 58.30 1qni s ILE 307 Cb 0.06 -2.58 -0.09 0.00 1.25 0.00 0.00 42.46 41.10 1qni s ILE 307 CO 0.64 0.00 0.85 -0.70 0.24 0.00 0.00 174.94 175.97 1qni s GLU 308 N -4.03 3.99 0.18 0.37 2.56 -1.26 -4.81 118.70 115.71 1qni s GLU 308 Ca 0.38 0.80 -0.15 0.00 0.00 0.00 0.00 54.97 56.00 1qni s GLU 308 Cb 0.07 -2.29 0.17 0.00 2.00 0.00 0.00 34.13 34.08 1qni s GLU 308 CO 0.14 -0.03 1.67 -0.07 -0.56 0.00 0.00 175.26 176.41 1qni h LEU 309 N 1.64 -0.32 -0.02 2.70 3.38 -1.96 -0.50 115.31 120.24 1qni h LEU 309 Ca -0.48 0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.62 1qni h LEU 309 Cb 1.18 0.25 0.00 0.00 0.09 0.00 0.00 40.66 42.18 1qni h LEU 309 CO 0.63 -0.11 0.00 0.54 0.09 0.00 0.00 178.44 179.59 1qni n ARG 310 N -5.29 0.01 0.22 1.13 5.12 -1.26 -2.83 116.66 113.77 1qni n ARG 310 Ca 0.05 0.19 0.16 0.00 -1.93 0.00 0.00 57.85 56.32 1qni n ARG 310 Cb 0.26 -1.52 0.68 0.00 -1.16 0.00 0.00 32.46 30.73 1qni n ARG 310 CO 0.00 0.00 0.00 -0.44 -1.93 0.00 0.00 177.63 175.26 1qni h ASP 311 N 0.00 0.00 1.44 0.55 3.32 -1.46 -1.69 116.42 118.58 1qni h ASP 311 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1qni h ASP 311 Cb 0.32 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.87 1qni h ASP 311 CO 0.00 0.00 0.00 0.71 -1.72 0.00 0.00 179.24 178.23 1qni h THR 312 N 0.00 0.00 -3.04 0.35 1.35 -1.63 -3.43 112.91 106.51 1qni h THR 312 Ca 0.00 -0.70 -0.57 0.00 -0.55 0.00 0.00 66.41 64.59 1qni h THR 312 Cb 0.34 1.68 -0.04 0.00 -1.73 0.00 0.00 68.15 68.40 1qni h THR 312 CO 0.00 0.00 1.07 -0.63 -0.25 0.00 0.00 175.52 175.71 1qni s ILE 313 N -3.42 3.89 -0.13 6.82 -1.09 -0.64 -0.97 121.20 125.66 1qni s ILE 313 Ca 0.04 0.96 0.18 0.00 -2.23 0.00 0.00 60.65 59.60 1qni s ILE 313 Cb 0.07 -4.00 -0.17 0.00 -1.58 0.00 0.00 42.46 36.78 1qni s ILE 313 CO 0.59 -0.51 0.70 0.52 -1.23 0.00 0.00 174.94 175.01 1qni n VAL 314 N 6.65 1.07 -3.50 2.92 0.31 -0.10 -4.97 118.33 120.70 1qni n VAL 314 Ca 0.17 -0.69 -0.16 0.00 -0.01 0.00 0.00 64.34 63.65 1qni n VAL 314 Cb 0.47 -0.61 -0.05 0.00 -0.91 0.00 0.00 33.84 32.74 1qni n VAL 314 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1qni s ALA 315 N -2.95 -1.70 -0.45 3.52 0.00 -1.22 -4.60 121.76 114.36 1qni s ALA 315 Ca -0.04 1.06 0.07 0.00 0.00 0.00 0.00 51.96 53.05 1qni s ALA 315 Cb 0.09 0.25 0.28 0.00 0.00 0.00 0.00 23.12 23.74 1qni s ALA 315 CO 0.82 -0.48 0.89 -1.91 0.00 0.00 0.00 175.76 175.08 1qni n GLU 316 N 0.55 0.87 -2.41 0.00 2.13 -1.26 -0.95 120.64 119.57 1qni n GLU 316 Ca -0.18 -2.23 -0.38 0.00 0.66 0.00 0.00 57.16 55.03 1qni n GLU 316 Cb 0.59 -1.32 -0.03 0.00 0.27 0.00 0.00 31.44 30.95 1qni n GLU 316 CO 0.00 0.00 0.00 -1.25 -0.41 0.00 0.00 177.13 175.47 1qni s PRO 317 N -0.11 4.25 -0.08 5.31 0.04 -1.22 -4.74 135.00 138.45 1qni s PRO 317 Ca 0.30 1.74 -0.25 0.00 0.04 0.00 0.00 61.00 62.83 1qni s PRO 317 Cb 0.25 -2.78 -0.03 0.00 0.04 0.00 0.00 34.50 31.99 1qni s PRO 317 CO -0.14 -0.12 0.78 -2.00 0.04 0.00 0.00 177.00 175.55 1qni s GLU 318 N -2.13 4.43 -0.06 4.56 2.12 -1.26 -2.44 118.70 123.92 1qni s GLU 318 Ca 0.54 1.00 -0.02 0.00 0.36 0.00 0.00 54.97 56.85 1qni s GLU 318 Cb -0.28 -3.48 -0.03 0.00 0.26 0.00 0.00 34.13 30.60 1qni s GLU 318 CO 0.36 -0.05 -0.07 1.28 -0.54 0.00 0.00 175.26 176.25 1qni n LEU 319 N 4.13 1.07 0.00 2.70 4.77 0.11 -4.97 117.00 124.81 1qni n LEU 319 Ca 0.01 0.04 0.00 0.00 -0.03 0.00 0.00 56.01 56.04 1qni n LEU 319 Cb 0.51 -0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.42 1qni n LEU 319 CO 0.48 0.24 0.00 0.61 -1.33 0.00 0.00 177.39 177.39 1qni n GLY 320 N 2.80 -1.34 3.66 -0.72 0.00 -1.15 -5.08 105.19 103.36 1qni n GLY 320 Ca -0.11 -0.95 -0.41 0.00 0.00 0.00 0.00 46.02 44.55 1qni n GLY 320 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1qni s LEU 321 N 0.00 4.14 0.00 0.99 1.43 -1.26 -4.15 118.68 119.83 1qni s LEU 321 Ca 0.00 1.09 0.00 0.00 -1.03 0.00 0.00 54.13 54.19 1qni s LEU 321 Cb 0.00 -3.18 0.00 0.00 0.03 0.00 0.00 46.19 43.04 1qni s LEU 321 CO 0.00 -0.42 0.00 0.61 0.23 0.00 0.00 176.35 176.77 1qni n GLY 322 N 3.60 0.63 3.66 -3.19 0.00 -1.21 -2.23 105.19 106.46 1qni n GLY 322 Ca 0.04 -0.49 -0.43 0.00 0.00 0.00 0.00 46.02 45.15 1qni n GLY 322 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1qni s PRO 323 N -3.76 4.23 -0.20 1.61 0.04 -1.25 0.20 135.00 135.86 1qni s PRO 323 Ca 0.00 1.80 -0.08 0.00 0.04 0.00 0.00 61.00 62.77 1qni s PRO 323 Cb 0.00 -3.80 -0.09 0.00 0.04 0.00 0.00 34.50 30.64 1qni s PRO 323 CO 0.00 -0.73 -0.24 1.28 0.04 0.00 0.00 177.00 177.36 1qni n LEU 324 N 6.63 1.75 -4.11 -3.56 4.77 -0.76 -0.18 117.00 121.54 1qni n LEU 324 Ca 0.15 0.17 -0.08 0.00 -0.03 0.00 0.00 56.01 56.21 1qni n LEU 324 Cb 0.44 -0.60 -0.10 0.00 -2.33 0.00 0.00 43.42 40.83 1qni n LEU 324 CO 0.58 0.50 -0.37 -1.00 -1.33 0.00 0.00 177.39 175.77 1qni s HIS 325 N -2.37 0.62 0.07 -1.77 3.76 -1.26 -0.68 115.29 113.66 1qni s HIS 325 Ca -0.27 -0.99 0.03 0.00 -0.15 0.00 0.00 55.06 53.68 1qni s HIS 325 Cb 0.10 -0.42 -0.03 0.00 1.11 0.00 0.00 32.58 33.34 1qni s HIS 325 CO 0.37 -0.30 -0.09 0.99 -0.85 0.00 0.00 174.74 174.86 1qni s THR 326 N -3.65 0.76 0.24 1.30 2.01 -1.26 -0.93 115.64 114.11 1qni s THR 326 Ca 0.07 -1.45 -0.10 0.00 0.31 0.00 0.00 61.69 60.53 1qni s THR 326 Cb 0.06 -1.10 -0.01 0.00 0.01 0.00 0.00 72.50 71.45 1qni s THR 326 CO -0.08 -0.52 0.39 0.28 -0.69 0.00 0.00 174.62 174.01 1qni s THR 327 N -2.14 0.00 0.10 -0.82 -1.32 0.12 -4.80 115.64 106.78 1qni s THR 327 Ca -0.00 -1.56 0.02 0.00 -1.21 0.00 0.00 61.69 58.94 1qni s THR 327 Cb -0.05 -2.29 -0.04 0.00 -1.51 0.00 0.00 72.50 68.61 1qni s THR 327 CO -0.01 0.00 -0.07 -0.36 -2.21 0.00 0.00 174.62 171.97 1qni s PHE 328 N -4.01 0.94 -2.03 9.09 0.40 -1.26 -0.49 117.98 120.62 1qni s PHE 328 Ca 0.27 -0.86 0.18 0.00 -0.60 0.00 0.00 56.93 55.92 1qni s PHE 328 Cb 0.01 -0.53 0.27 0.00 0.51 0.00 0.00 43.02 43.29 1qni s PHE 328 CO 0.10 -0.11 1.20 -0.40 0.70 0.00 0.00 175.22 176.72 1qni n ASP 329 N 0.05 2.89 0.00 1.36 5.68 -1.18 -4.65 116.55 120.69 1qni n ASP 329 Ca -0.13 -1.85 0.00 0.00 -0.50 0.00 0.00 54.79 52.31 1qni n ASP 329 Cb 0.60 -0.14 0.00 0.00 -1.14 0.00 0.00 41.12 40.45 1qni n ASP 329 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1qni n GLY 330 N 1.08 0.28 0.51 6.12 0.00 -1.26 -3.19 105.19 108.73 1qni n GLY 330 Ca 0.14 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.21 1qni n GLY 330 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1qni n ARG 331 N -1.14 1.57 0.00 1.61 1.74 -1.26 -4.95 116.66 114.22 1qni n ARG 331 Ca 0.00 -1.54 0.00 0.00 -0.77 0.00 0.00 57.85 55.54 1qni n ARG 331 Cb 0.22 -1.23 0.00 0.00 -1.02 0.00 0.00 32.46 30.43 1qni n ARG 331 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1qni n GLY 332 N 0.53 0.54 3.78 -0.13 0.00 -1.26 -5.08 105.19 103.58 1qni n GLY 332 Ca 0.08 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.82 1qni n GLY 332 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1qni s ASN 333 N -2.61 5.47 0.14 1.61 0.01 -1.26 -1.75 114.94 116.56 1qni s ASN 333 Ca 0.00 -0.10 0.09 0.00 -0.71 0.00 0.00 52.86 52.15 1qni s ASN 333 Cb 0.00 -1.43 -0.04 0.00 0.41 0.00 0.00 41.25 40.19 1qni s ASN 333 CO 0.00 0.11 -0.22 0.00 -1.51 0.00 0.00 177.10 175.49 1qni s ALA 334 N -1.59 2.10 -0.11 0.60 0.00 0.60 -3.09 121.76 120.28 1qni s ALA 334 Ca 0.30 -1.43 0.01 0.00 0.00 0.00 0.00 51.96 50.84 1qni s ALA 334 Cb -0.11 -0.26 0.02 0.00 0.00 0.00 0.00 23.12 22.76 1qni s ALA 334 CO 0.22 0.37 -0.13 0.71 0.00 0.00 0.00 175.76 176.93 1qni s TYR 335 N -1.52 1.78 -0.00 0.00 1.51 0.36 -1.13 117.35 118.35 1qni s TYR 335 Ca 0.13 -0.85 0.08 0.00 -1.01 0.00 0.00 57.07 55.42 1qni s TYR 335 Cb -0.08 -1.33 -0.02 0.00 -0.11 0.00 0.00 41.96 40.41 1qni s TYR 335 CO 0.06 -0.47 -0.24 0.99 -1.11 0.00 0.00 175.55 174.78 1qni s THR 336 N 1.17 1.90 0.05 -0.71 2.01 0.26 -0.71 115.64 119.61 1qni s THR 336 Ca -0.04 -1.09 -0.22 0.00 0.31 0.00 0.00 61.69 60.66 1qni s THR 336 Cb -0.14 -1.59 -0.06 0.00 0.01 0.00 0.00 72.50 70.72 1qni s THR 336 CO -0.04 0.48 0.64 0.42 -0.69 0.00 0.00 174.62 175.43 1qni s THR 337 N -0.62 4.76 -0.46 -0.82 -4.23 -0.11 0.12 115.64 114.28 1qni s THR 337 Ca 0.09 1.37 -0.02 0.00 -1.18 0.00 0.00 61.69 61.95 1qni s THR 337 Cb -0.09 -3.98 0.12 0.00 1.34 0.00 0.00 72.50 69.89 1qni s THR 337 CO -0.00 0.46 0.25 -0.76 -0.54 0.00 0.00 174.62 174.03 1qni s LEU 338 N -0.55 5.17 0.14 4.79 1.43 0.18 -1.82 118.68 128.01 1qni s LEU 338 Ca 0.32 -2.28 -0.23 0.00 -1.03 0.00 0.00 54.13 50.92 1qni s LEU 338 Cb -0.20 -1.81 -0.00 0.00 0.03 0.00 0.00 46.19 44.21 1qni s LEU 338 CO 0.20 -0.48 1.64 0.15 0.23 0.00 0.00 176.35 178.09 1qni h PHE 339 N 7.71 -0.58 -0.02 0.29 3.57 -0.30 0.14 116.94 127.75 1qni h PHE 339 Ca -0.09 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.43 1qni h PHE 339 Cb 1.02 0.28 -0.00 0.00 2.79 0.00 0.00 35.95 40.04 1qni h PHE 339 CO 0.58 -0.30 -0.02 0.82 -2.23 0.00 0.00 178.31 177.15 1qni h ILE 340 N -0.27 1.41 0.00 1.41 2.04 -1.64 -2.98 117.51 117.48 1qni h ILE 340 Ca 0.11 -1.26 0.00 0.00 1.00 0.00 0.00 64.86 64.71 1qni h ILE 340 Cb 0.43 2.23 0.00 0.00 -0.74 0.00 0.00 36.82 38.74 1qni h ILE 340 CO -0.31 0.33 0.00 0.47 0.00 0.00 0.00 178.15 178.65 1qni n ASP 341 N -4.79 0.00 -3.37 1.72 8.00 -1.08 -4.91 116.55 112.12 1qni n ASP 341 Ca -0.08 0.46 -0.19 0.00 0.71 0.00 0.00 54.79 55.68 1qni n ASP 341 Cb 0.28 -0.48 0.06 0.00 -0.02 0.00 0.00 41.12 40.96 1qni n ASP 341 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 1qni n SER 342 N -1.48 -6.31 -3.56 -2.24 2.88 0.43 -4.91 113.62 98.44 1qni n SER 342 Ca 0.05 -0.79 -0.09 0.00 -1.33 0.00 0.00 58.87 56.71 1qni n SER 342 Cb 0.20 -4.69 -0.02 0.00 -0.75 0.00 0.00 64.21 58.95 1qni n SER 342 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1qni s GLN 343 N -4.82 1.14 -0.13 -1.46 -2.07 -0.76 -1.40 119.66 110.15 1qni s GLN 343 Ca 0.46 -0.49 -0.05 0.00 -1.82 0.00 0.00 55.36 53.45 1qni s GLN 343 Cb -0.09 0.48 -0.04 0.00 -1.09 0.00 0.00 33.01 32.27 1qni s GLN 343 CO 0.78 -0.51 0.06 0.08 -1.32 0.00 0.00 175.29 174.37 1qni s VAL 344 N -3.44 4.76 -0.16 3.63 1.01 -0.49 0.50 120.40 126.22 1qni s VAL 344 Ca 0.06 -0.06 -0.01 0.00 0.00 0.00 0.00 61.98 61.96 1qni s VAL 344 Cb -0.02 -3.08 -0.01 0.00 0.00 0.00 0.00 36.38 33.27 1qni s VAL 344 CO -0.07 0.55 -0.10 0.00 0.00 0.00 0.00 175.10 175.48 1qni s LYS 346 N 0.67 3.23 0.13 0.00 2.20 0.84 -0.57 119.74 126.24 1qni s LYS 346 Ca -0.05 -0.82 0.06 0.00 -0.36 0.00 0.00 55.97 54.80 1qni s LYS 346 Cb -0.15 -3.80 -0.04 0.00 -1.51 0.00 0.00 37.83 32.32 1qni s LYS 346 CO 0.02 -0.56 -0.15 1.67 -0.36 0.00 0.00 175.35 175.98 1qni s TRP 347 N 1.67 1.47 -0.11 4.03 1.48 -0.28 0.23 118.94 127.43 1qni s TRP 347 Ca 0.05 -0.55 -0.18 0.00 -1.06 0.00 0.00 56.10 54.36 1qni s TRP 347 Cb -0.18 -0.76 -0.04 0.00 -1.16 0.00 0.00 33.47 31.33 1qni s TRP 347 CO 0.09 0.18 0.49 1.21 -4.06 0.00 0.00 176.95 174.86 1qni s ASN 348 N -2.55 6.71 0.12 -2.66 3.84 0.35 -0.29 114.94 120.46 1qni s ASN 348 Ca 0.11 0.85 -0.13 0.00 0.21 0.00 0.00 52.86 53.90 1qni s ASN 348 Cb -0.05 -2.29 -0.07 0.00 -0.55 0.00 0.00 41.25 38.29 1qni s ASN 348 CO 0.04 0.02 1.43 0.40 -2.79 0.00 0.00 177.10 176.19 1qni h ILE 349 N 4.65 1.28 -0.55 -5.21 2.04 -1.67 -2.78 117.51 115.27 1qni h ILE 349 Ca -0.42 -1.58 0.00 0.00 1.00 0.00 0.00 64.86 63.87 1qni h ILE 349 Cb 1.18 1.53 -0.03 0.00 -0.74 0.00 0.00 36.82 38.76 1qni h ILE 349 CO 0.75 0.52 0.36 0.00 0.00 0.00 0.00 178.15 179.78 1qni h ALA 350 N 0.72 0.70 -0.11 1.87 0.00 -1.94 -2.08 119.26 118.42 1qni h ALA 350 Ca 0.04 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 1qni h ALA 350 Cb 0.99 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 1qni h ALA 350 CO 0.10 0.15 -0.21 -0.44 0.00 0.00 0.00 179.25 178.84 1qni h ASP 351 N 0.75 0.18 0.22 0.00 3.32 -1.93 -1.65 116.42 117.30 1qni h ASP 351 Ca 0.20 -0.04 -0.12 0.00 0.02 0.00 0.00 57.03 57.08 1qni h ASP 351 Cb -0.08 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.41 1qni h ASP 351 CO -0.04 0.40 -0.47 0.00 -1.72 0.00 0.00 179.24 177.41 1qni h ALA 352 N 1.62 0.99 0.07 3.45 0.00 -1.14 0.38 119.26 124.63 1qni h ALA 352 Ca 0.03 -0.46 -0.00 0.00 0.00 0.00 0.00 54.91 54.48 1qni h ALA 352 Cb 0.47 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1qni h ALA 352 CO 0.03 0.64 -0.03 0.82 0.00 0.00 0.00 179.25 180.71 1qni h ILE 353 N 0.24 1.12 -0.13 0.00 2.04 -0.72 -1.21 117.51 118.84 1qni h ILE 353 Ca 0.01 -0.68 0.01 0.00 1.00 0.00 0.00 64.86 65.21 1qni h ILE 353 Cb 0.92 1.56 -0.01 0.00 -0.74 0.00 0.00 36.82 38.55 1qni h ILE 353 CO 0.08 0.17 0.04 0.11 0.00 0.00 0.00 178.15 178.54 1qni h LYS 354 N -0.40 0.10 -0.92 2.37 1.57 -1.17 -2.24 116.57 115.87 1qni h LYS 354 Ca -0.01 -0.01 0.07 0.00 -1.87 0.00 0.00 60.65 58.83 1qni h LYS 354 Cb 0.35 -0.02 -0.06 0.00 0.08 0.00 0.00 32.23 32.58 1qni h LYS 354 CO 0.02 0.06 0.60 1.25 -0.57 0.00 0.00 179.45 180.81 1qni h HIS 355 N 0.10 1.07 0.00 -1.35 2.76 -0.88 -0.03 115.15 116.82 1qni h HIS 355 Ca 0.06 0.03 -0.06 0.00 -2.20 0.00 0.00 60.37 58.19 1qni h HIS 355 Cb 0.04 -0.35 -0.01 0.00 1.55 0.00 0.00 27.41 28.64 1qni h HIS 355 CO -0.11 0.56 -0.30 -0.92 -1.30 0.00 0.00 177.93 175.86 1qni h TYR 356 N 1.05 0.00 0.00 5.26 3.20 -0.84 -2.47 116.97 123.18 1qni h TYR 356 Ca 0.40 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.27 1qni h TYR 356 Cb 0.20 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.47 1qni h TYR 356 CO -0.00 0.30 0.00 0.09 -1.64 0.00 0.00 178.16 176.91 1qni n ASN 357 N -4.11 0.00 0.00 -2.11 3.02 -0.08 -4.87 115.26 107.11 1qni n ASN 357 Ca -0.02 0.30 0.00 0.00 -0.03 0.00 0.00 54.58 54.83 1qni n ASN 357 Cb 0.35 -0.43 0.00 0.00 -0.61 0.00 0.00 39.78 39.09 1qni n ASN 357 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1qni n GLY 358 N 1.23 1.29 1.11 7.41 0.00 -0.93 -5.10 105.19 110.21 1qni n GLY 358 Ca 0.09 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.00 1qni n GLY 358 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1qni n ASP 359 N 0.00 -2.39 0.00 1.61 8.00 -0.87 -4.98 116.55 117.92 1qni n ASP 359 Ca 0.00 -0.41 0.00 0.00 0.71 0.00 0.00 54.79 55.09 1qni n ASP 359 Cb 0.00 -0.34 0.00 0.00 -0.02 0.00 0.00 41.12 40.76 1qni n ASP 359 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1qni n ARG 360 N -3.13 -0.36 -1.63 -1.24 1.74 -1.26 -4.69 116.66 106.08 1qni n ARG 360 Ca 0.05 -0.26 -0.38 0.00 -0.77 0.00 0.00 57.85 56.48 1qni n ARG 360 Cb 0.20 -0.76 0.05 0.00 -1.02 0.00 0.00 32.46 30.94 1qni n ARG 360 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1qni n VAL 361 N -0.02 3.62 -3.15 1.55 0.31 -1.26 -4.95 118.33 114.42 1qni n VAL 361 Ca 0.00 -0.50 -0.41 0.00 -0.01 0.00 0.00 64.34 63.42 1qni n VAL 361 Cb 0.11 -1.21 -0.07 0.00 -0.91 0.00 0.00 33.84 31.76 1qni n VAL 361 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 1qni s ASN 362 N -1.16 6.47 0.07 4.52 0.02 -1.26 -4.75 114.94 118.85 1qni s ASN 362 Ca 0.74 0.43 0.16 0.00 -1.02 0.00 0.00 52.86 53.16 1qni s ASN 362 Cb -0.43 -2.31 -0.13 0.00 0.02 0.00 0.00 41.25 38.39 1qni s ASN 362 CO 0.48 -0.43 0.87 0.10 0.02 0.00 0.00 177.10 178.14 1qni h TYR 363 N 8.15 0.00 -3.17 2.20 -0.00 -1.89 -3.46 116.97 118.80 1qni h TYR 363 Ca -0.27 0.00 -0.56 0.00 0.00 0.00 0.00 58.73 57.90 1qni h TYR 363 Cb 1.12 0.00 -0.04 0.00 0.00 0.00 0.00 36.73 37.82 1qni h TYR 363 CO 0.75 0.64 0.65 0.42 -0.00 0.00 0.00 178.16 180.63 1qni s ILE 364 N -2.87 4.62 -0.18 -0.90 1.01 -1.26 -0.50 121.20 121.12 1qni s ILE 364 Ca -0.02 1.92 0.05 0.00 0.00 0.00 0.00 60.65 62.59 1qni s ILE 364 Cb 0.09 -4.23 -0.22 0.00 0.01 0.00 0.00 42.46 38.10 1qni s ILE 364 CO 0.81 -0.03 0.13 0.54 0.00 0.00 0.00 174.94 176.38 1qni n ARG 365 N 5.34 0.68 -3.56 2.79 5.12 0.13 -4.96 116.66 122.21 1qni n ARG 365 Ca 0.10 0.17 -0.13 0.00 -1.93 0.00 0.00 57.85 56.06 1qni n ARG 365 Cb 0.48 -1.61 -0.05 0.00 -1.16 0.00 0.00 32.46 30.11 1qni n ARG 365 CO 0.00 0.00 0.00 -1.14 -1.93 0.00 0.00 177.63 174.56 1qni s GLN 366 N -2.54 0.74 -0.14 5.56 0.74 -0.93 -5.01 119.66 118.09 1qni s GLN 366 Ca -0.21 0.18 -0.00 0.00 0.05 0.00 0.00 55.36 55.37 1qni s GLN 366 Cb 0.08 0.35 0.03 0.00 1.10 0.00 0.00 33.01 34.57 1qni s GLN 366 CO 0.73 -0.23 -0.07 0.15 -0.55 0.00 0.00 175.29 175.31 1qni s LYS 367 N -1.16 1.59 -0.21 1.67 1.02 -1.26 -0.12 119.74 121.28 1qni s LYS 367 Ca -0.05 -0.42 -0.06 0.00 0.02 0.00 0.00 55.97 55.47 1qni s LYS 367 Cb -0.00 -1.85 -0.03 0.00 -0.52 0.00 0.00 37.83 35.43 1qni s LYS 367 CO 0.04 -0.34 0.02 -1.17 -0.92 0.00 0.00 175.35 172.98 1qni s LEU 368 N 1.64 3.35 0.10 3.17 0.20 -0.42 -4.96 118.68 121.76 1qni s LEU 368 Ca 0.03 -0.18 -0.31 0.00 0.69 0.00 0.00 54.13 54.37 1qni s LEU 368 Cb -0.14 -1.86 -0.09 0.00 -0.43 0.00 0.00 46.19 43.67 1qni s LEU 368 CO -0.08 0.05 1.75 -1.81 -0.29 0.00 0.00 176.35 175.97 1qni s ASP 369 N 1.07 6.51 -0.00 3.68 1.01 -1.26 -1.39 116.67 126.27 1qni s ASP 369 Ca 0.03 2.64 0.01 0.00 0.71 0.00 0.00 52.55 55.93 1qni s ASP 369 Cb -0.14 -2.57 -0.04 0.00 1.01 0.00 0.00 42.92 41.18 1qni s ASP 369 CO 0.02 -0.95 0.04 -0.69 0.21 0.00 0.00 175.17 173.80 1qni s VAL 370 N 2.65 4.43 -1.06 -1.27 1.01 -0.49 -4.89 120.40 120.78 1qni s VAL 370 Ca 0.78 -0.51 -0.22 0.00 0.00 0.00 0.00 61.98 62.02 1qni s VAL 370 Cb -0.43 -3.00 0.01 0.00 0.00 0.00 0.00 36.38 32.96 1qni s VAL 370 CO 0.34 0.36 1.70 -1.10 0.00 0.00 0.00 175.10 176.40 1qni s GLN 371 N -1.65 3.25 -0.09 2.72 1.11 -1.26 -4.54 119.66 119.21 1qni s GLN 371 Ca 0.21 -1.06 -0.03 0.00 0.01 0.00 0.00 55.36 54.49 1qni s GLN 371 Cb -0.12 -5.30 0.01 0.00 -1.01 0.00 0.00 33.01 26.60 1qni s GLN 371 CO 0.12 -2.76 0.06 0.66 0.01 0.00 0.00 175.29 173.38 1qni n TYR 372 N 10.86 -1.62 -3.01 0.91 4.01 -1.26 -4.69 117.16 122.36 1qni n TYR 372 Ca 0.39 0.87 -0.06 0.00 -0.16 0.00 0.00 57.90 58.94 1qni n TYR 372 Cb 0.48 -2.42 0.01 0.00 -0.31 0.00 0.00 39.34 37.10 1qni n TYR 372 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 1qni n GLN 373 N 0.50 -1.99 -2.44 -0.72 3.00 -1.26 -2.57 117.38 111.90 1qni n GLN 373 Ca -0.10 1.81 -0.41 0.00 -0.01 0.00 0.00 57.00 58.28 1qni n GLN 373 Cb 0.16 -3.41 -0.03 0.00 0.00 0.00 0.00 30.24 26.95 1qni n GLN 373 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.06 174.92 1qni s PRO 374 N -1.64 4.50 0.00 -1.09 0.02 -1.26 -0.57 135.00 134.96 1qni s PRO 374 Ca 0.08 1.79 0.00 0.00 0.02 0.00 0.00 61.00 62.89 1qni s PRO 374 Cb -0.01 -3.29 0.00 0.00 0.02 0.00 0.00 34.50 31.22 1qni s PRO 374 CO 0.51 -0.10 0.00 0.41 -0.33 0.00 0.00 177.00 177.50 1qni n GLY 375 N 2.50 0.17 3.79 0.52 0.00 0.26 -4.12 105.19 108.30 1qni n GLY 375 Ca 0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.76 1qni n GLY 375 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1qni s HIS 376 N 1.45 2.80 0.01 1.61 3.76 -1.24 -4.24 115.29 119.44 1qni s HIS 376 Ca 0.00 1.50 0.03 0.00 -0.15 0.00 0.00 55.06 56.44 1qni s HIS 376 Cb 0.00 -2.99 -0.01 0.00 1.11 0.00 0.00 32.58 30.69 1qni s HIS 376 CO 0.00 -1.55 -0.09 1.21 -0.85 0.00 0.00 174.74 173.45 1qni s ASN 377 N -3.46 1.09 -0.22 1.40 2.47 -1.26 -2.16 114.94 112.80 1qni s ASN 377 Ca 0.60 -0.29 -0.09 0.00 0.42 0.00 0.00 52.86 53.50 1qni s ASN 377 Cb -0.16 -0.08 0.09 0.00 -1.45 0.00 0.00 41.25 39.65 1qni s ASN 377 CO 0.54 0.03 0.48 -2.28 -3.72 0.00 0.00 177.10 172.15 1qni s HIS 378 N -0.56 -0.88 -0.05 0.43 2.46 -0.25 -4.75 115.29 111.69 1qni s HIS 378 Ca 0.00 1.68 -0.01 0.00 0.47 0.00 0.00 55.06 57.20 1qni s HIS 378 Cb -0.05 0.42 -0.04 0.00 -0.13 0.00 0.00 32.58 32.78 1qni s HIS 378 CO 0.00 -0.49 0.05 0.00 -2.47 0.00 0.00 174.74 171.83 1qni s ALA 379 N 2.33 3.48 0.01 1.58 0.00 -1.26 0.28 121.76 128.18 1qni s ALA 379 Ca -0.05 -0.83 -0.34 0.00 0.00 0.00 0.00 51.96 50.74 1qni s ALA 379 Cb -0.11 -1.56 -0.12 0.00 0.00 0.00 0.00 23.12 21.33 1qni s ALA 379 CO -0.15 0.64 1.78 -1.13 0.00 0.00 0.00 175.76 176.91 1qni n SER 380 N 1.63 3.39 -1.22 0.00 3.41 -0.40 -1.54 113.62 118.90 1qni n SER 380 Ca -0.16 1.01 -0.15 0.00 -0.26 0.00 0.00 58.87 59.31 1qni n SER 380 Cb 0.53 -1.40 -0.06 0.00 -0.26 0.00 0.00 64.21 63.02 1qni n SER 380 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1qni n LEU 381 N 5.58 -1.17 0.28 1.04 4.77 -1.25 -2.98 117.00 123.27 1qni n LEU 381 Ca 0.20 0.31 0.14 0.00 -0.03 0.00 0.00 56.01 56.64 1qni n LEU 381 Cb 0.30 -2.19 0.84 0.00 -2.33 0.00 0.00 43.42 40.04 1qni n LEU 381 CO 0.69 -0.69 1.06 0.00 -1.33 0.00 0.00 177.39 177.12 1qni h THR 382 N 0.00 0.52 -0.10 -5.08 1.03 -1.55 -2.27 112.91 105.46 1qni h THR 382 Ca -0.31 -0.26 0.00 0.00 -0.01 0.00 0.00 66.41 65.83 1qni h THR 382 Cb 1.01 1.17 0.00 0.00 -1.07 0.00 0.00 68.15 69.26 1qni h THR 382 CO 0.44 0.06 0.00 -0.62 -0.01 0.00 0.00 175.52 175.39 1qni n GLU 383 N -3.72 1.62 -4.61 0.00 1.02 -1.26 -4.37 120.64 109.32 1qni n GLU 383 Ca -0.02 -0.92 -0.28 0.00 -0.02 0.00 0.00 57.16 55.92 1qni n GLU 383 Cb 0.16 -1.42 -0.10 0.00 -0.02 0.00 0.00 31.44 30.06 1qni n GLU 383 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 1qni s SER 384 N -1.72 3.58 0.52 1.62 1.04 -0.87 -4.90 113.70 112.96 1qni s SER 384 Ca 0.34 -1.45 0.28 0.00 0.48 0.00 0.00 55.95 55.61 1qni s SER 384 Cb 0.18 -0.10 1.39 0.00 0.10 0.00 0.00 66.02 67.60 1qni s SER 384 CO 0.29 -0.59 2.03 0.03 0.98 0.00 0.00 173.24 175.97 1qni h ARG 385 N 1.75 0.00 -0.97 4.02 3.08 -1.29 -3.13 114.38 117.84 1qni h ARG 385 Ca -0.43 0.00 -0.25 0.00 0.07 0.00 0.00 59.98 59.37 1qni h ARG 385 Cb 1.26 0.00 -0.15 0.00 0.08 0.00 0.00 29.97 31.16 1qni h ARG 385 CO 0.76 0.12 0.32 -0.25 -1.07 0.00 0.00 179.97 179.85 1qni n ASP 386 N -3.50 3.45 -4.47 7.04 8.00 -1.26 -4.94 116.55 120.87 1qni n ASP 386 Ca -0.01 -2.85 -0.48 0.00 0.71 0.00 0.00 54.79 52.16 1qni n ASP 386 Cb 0.27 -0.68 -0.07 0.00 -0.02 0.00 0.00 41.12 40.63 1qni n ASP 386 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1qni n ALA 387 N -0.31 1.07 0.78 2.24 0.00 -1.12 -4.80 120.51 118.38 1qni n ALA 387 Ca 0.31 -0.17 0.13 0.00 0.00 0.00 0.00 53.44 53.72 1qni n ALA 387 Cb 1.11 -2.62 0.45 0.00 0.00 0.00 0.00 19.45 18.38 1qni n ALA 387 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1qni n ASP 388 N 10.59 0.48 -3.83 0.00 5.68 -1.16 -4.27 116.55 124.04 1qni n ASP 388 Ca 0.41 0.44 -0.28 0.00 -0.50 0.00 0.00 54.79 54.86 1qni n ASP 388 Cb 0.26 -0.51 0.04 0.00 -1.14 0.00 0.00 41.12 39.77 1qni n ASP 388 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1qni n GLY 389 N 1.40 -0.48 0.10 6.12 0.00 -1.19 -4.92 105.19 106.22 1qni n GLY 389 Ca 0.06 0.19 -0.14 0.00 0.00 0.00 0.00 46.02 46.14 1qni n GLY 389 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1qni n LYS 390 N -4.68 0.48 -4.71 1.61 4.76 -1.26 -3.11 118.16 111.26 1qni n LYS 390 Ca -0.01 0.11 -0.29 0.00 -2.87 0.00 0.00 58.31 55.25 1qni n LYS 390 Cb 0.55 -1.38 -0.14 0.00 -1.84 0.00 0.00 35.03 32.22 1qni n LYS 390 CO 0.00 0.00 0.00 -1.58 -1.37 0.00 0.00 177.40 174.45 1qni s TRP 391 N -2.39 2.22 -0.05 2.13 0.23 -1.26 -1.80 118.94 118.01 1qni s TRP 391 Ca -0.26 -0.40 0.02 0.00 -2.03 0.00 0.00 56.10 53.43 1qni s TRP 391 Cb 0.07 -1.29 0.02 0.00 0.03 0.00 0.00 33.47 32.29 1qni s TRP 391 CO 0.45 0.18 -0.09 -1.17 0.96 0.00 0.00 176.95 177.27 1qni s LEU 392 N -1.47 1.54 -0.15 2.99 2.96 0.09 -1.27 118.68 123.37 1qni s LEU 392 Ca 0.11 -0.23 0.01 0.00 -0.22 0.00 0.00 54.13 53.80 1qni s LEU 392 Cb -0.10 -0.67 -0.00 0.00 0.50 0.00 0.00 46.19 45.92 1qni s LEU 392 CO 0.03 0.00 -0.16 -0.69 -1.32 0.00 0.00 176.35 174.21 1qni s VAL 393 N 0.73 2.63 -0.19 1.68 1.01 0.14 -0.04 120.40 126.36 1qni s VAL 393 Ca -0.13 -0.79 -0.01 0.00 0.00 0.00 0.00 61.98 61.05 1qni s VAL 393 Cb -0.15 -2.10 0.00 0.00 0.00 0.00 0.00 36.38 34.13 1qni s VAL 393 CO 0.02 0.52 -0.12 -0.69 0.00 0.00 0.00 175.10 174.83 1qni s VAL 394 N 0.73 2.79 -0.46 2.92 1.01 -0.76 -1.09 120.40 125.53 1qni s VAL 394 Ca -0.07 -0.70 -0.12 0.00 0.00 0.00 0.00 61.98 61.09 1qni s VAL 394 Cb -0.16 -2.22 0.09 0.00 0.00 0.00 0.00 36.38 34.10 1qni s VAL 394 CO 0.01 0.49 0.35 -0.76 0.00 0.00 0.00 175.10 175.19 1qni s LEU 395 N 1.18 5.57 0.46 3.92 1.02 -0.92 -0.36 118.68 129.56 1qni s LEU 395 Ca 0.02 -1.59 -0.06 0.00 0.02 0.00 0.00 54.13 52.52 1qni s LEU 395 Cb -0.14 -2.08 -0.04 0.00 0.02 0.00 0.00 46.19 43.94 1qni s LEU 395 CO -0.05 -0.65 0.77 -0.44 0.02 0.00 0.00 176.35 176.00 1qni s SER 396 N 2.61 6.32 0.00 2.29 0.01 0.01 -0.58 113.70 124.37 1qni s SER 396 Ca 0.04 0.95 0.22 0.00 1.31 0.00 0.00 55.95 58.47 1qni s SER 396 Cb -0.25 -2.26 0.00 0.00 0.21 0.00 0.00 66.02 63.73 1qni s SER 396 CO 0.03 -0.53 1.06 0.29 0.41 0.00 0.00 173.24 174.51 1qni n LYS 397 N -2.02 0.03 -4.31 12.44 4.76 0.26 -3.34 118.16 125.98 1qni n LYS 397 Ca 0.01 -0.02 -0.20 0.00 -2.87 0.00 0.00 58.31 55.23 1qni n LYS 397 Cb 0.55 -1.50 -0.13 0.00 -1.84 0.00 0.00 35.03 32.11 1qni n LYS 397 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 1qni s PHE 398 N -2.99 1.24 0.00 2.13 0.08 -1.06 -4.88 117.98 112.51 1qni s PHE 398 Ca 0.09 -0.38 0.00 0.00 0.12 0.00 0.00 56.93 56.76 1qni s PHE 398 Cb 0.17 -0.73 0.00 0.00 -0.57 0.00 0.00 43.02 41.89 1qni s PHE 398 CO 0.81 0.05 0.00 -1.13 -0.10 0.00 0.00 175.22 174.85 1qni n SER 399 N 1.71 4.04 0.00 1.36 3.41 -1.25 -4.43 113.62 118.46 1qni n SER 399 Ca -0.19 -0.02 0.00 0.00 -0.26 0.00 0.00 58.87 58.40 1qni n SER 399 Cb 0.54 0.85 0.00 0.00 -0.26 0.00 0.00 64.21 65.34 1qni n SER 399 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1qni n LYS 400 N -1.25 0.00 -0.06 4.33 5.02 -1.26 0.04 118.16 124.97 1qni n LYS 400 Ca 0.00 0.00 0.10 0.00 -2.02 0.00 0.00 58.31 56.39 1qni n LYS 400 Cb 0.00 0.00 0.40 0.00 -0.02 0.00 0.00 35.03 35.41 1qni n LYS 400 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1qni n ASP 401 N 3.50 1.27 0.24 4.39 5.75 -1.26 -4.34 116.55 126.09 1qni n ASP 401 Ca 0.00 -1.65 0.10 0.00 -0.01 0.00 0.00 54.79 53.23 1qni n ASP 401 Cb 0.00 -0.08 0.59 0.00 -1.03 0.00 0.00 41.12 40.60 1qni n ASP 401 CO 0.00 0.00 0.00 0.03 -0.11 0.00 0.00 177.20 177.12 1qni h ARG 402 N 1.67 0.00 -4.81 0.11 2.47 -0.81 -3.46 114.38 109.55 1qni h ARG 402 Ca 0.00 0.00 -0.35 0.00 -1.26 0.00 0.00 59.98 58.37 1qni h ARG 402 Cb 0.37 0.00 -0.14 0.00 -1.65 0.00 0.00 29.97 28.54 1qni h ARG 402 CO 0.00 0.19 -0.59 -0.06 0.56 0.00 0.00 179.97 180.07 1qni s PHE 403 N -4.03 1.47 0.40 3.04 0.08 -1.26 -5.11 117.98 112.57 1qni s PHE 403 Ca -0.02 -1.30 -0.26 0.00 0.12 0.00 0.00 56.93 55.47 1qni s PHE 403 Cb 0.12 -0.80 -0.10 0.00 -0.57 0.00 0.00 43.02 41.68 1qni s PHE 403 CO 0.62 -0.49 1.29 1.28 -0.10 0.00 0.00 175.22 177.83 1qni n LEU 404 N -0.46 4.01 -4.77 -0.37 4.77 -1.26 -4.90 117.00 114.02 1qni n LEU 404 Ca 0.01 1.13 -0.41 0.00 -0.03 0.00 0.00 56.01 56.72 1qni n LEU 404 Cb 0.66 -1.51 -0.01 0.00 -2.33 0.00 0.00 43.42 40.23 1qni n LEU 404 CO 0.35 -0.55 1.08 -2.16 -1.33 0.00 0.00 177.39 174.78 1qni s PRO 405 N -2.15 4.20 -0.01 3.23 0.04 -1.26 -4.92 135.00 134.13 1qni s PRO 405 Ca 0.59 2.44 0.10 0.00 0.04 0.00 0.00 61.00 64.17 1qni s PRO 405 Cb -0.52 -3.01 0.16 0.00 0.04 0.00 0.00 34.50 31.18 1qni s PRO 405 CO 0.59 -0.41 1.07 1.33 0.04 0.00 0.00 177.00 179.62 1qni n VAL 406 N 0.73 0.18 0.00 -0.36 0.24 -1.26 -5.14 118.33 112.73 1qni n VAL 406 Ca 0.01 -0.54 0.00 0.00 -2.04 0.00 0.00 64.34 61.77 1qni n VAL 406 Cb 0.40 0.59 0.00 0.00 -1.47 0.00 0.00 33.84 33.36 1qni n VAL 406 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1qni n GLY 407 N 0.04 1.22 0.38 7.63 0.00 -1.26 -4.69 105.19 108.51 1qni n GLY 407 Ca 0.03 -2.17 0.15 0.00 0.00 0.00 0.00 46.02 44.04 1qni n GLY 407 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1qni h PRO 408 N 0.00 0.56 -5.97 1.61 0.11 -2.04 -3.37 132.00 122.89 1qni h PRO 408 Ca 0.00 -0.03 -0.59 0.00 0.11 0.00 0.00 66.00 65.49 1qni h PRO 408 Cb 0.00 -0.13 -0.07 0.00 0.11 0.00 0.00 31.00 30.91 1qni h PRO 408 CO 0.00 0.37 0.65 -1.17 -0.21 0.00 0.00 178.00 177.64 1qni s LEU 409 N -9.71 4.07 0.23 2.35 0.20 -1.26 -5.04 118.68 109.53 1qni s LEU 409 Ca -0.09 1.16 0.06 0.00 0.69 0.00 0.00 54.13 55.95 1qni s LEU 409 Cb 0.23 -3.37 -0.03 0.00 -0.43 0.00 0.00 46.19 42.58 1qni s LEU 409 CO 0.79 -0.63 0.23 -1.00 -0.29 0.00 0.00 176.35 175.45 1qni s HIS 410 N 3.10 3.22 0.81 5.38 3.76 -1.26 -4.73 115.29 125.57 1qni s HIS 410 Ca 0.40 -0.07 -0.11 0.00 -0.15 0.00 0.00 55.06 55.13 1qni s HIS 410 Cb -0.15 -1.47 0.10 0.00 1.11 0.00 0.00 32.58 32.17 1qni s HIS 410 CO 0.08 0.50 1.17 -1.25 -0.85 0.00 0.00 174.74 174.39 1qni s PRO 411 N -3.75 1.75 0.75 8.40 0.04 -1.26 -4.93 135.00 136.00 1qni s PRO 411 Ca 0.33 -0.10 -0.04 0.00 0.04 0.00 0.00 61.00 61.23 1qni s PRO 411 Cb -0.09 -1.99 0.13 0.00 0.04 0.00 0.00 34.50 32.60 1qni s PRO 411 CO 0.26 -1.67 1.04 -1.21 0.04 0.00 0.00 177.00 175.46 1qni s GLU 412 N -5.56 1.58 -0.23 4.56 0.41 0.22 -3.93 118.70 115.75 1qni s GLU 412 Ca 0.64 -0.89 -0.04 0.00 -0.41 0.00 0.00 54.97 54.27 1qni s GLU 412 Cb -0.09 -2.24 0.08 0.00 -1.78 0.00 0.00 34.13 30.09 1qni s GLU 412 CO 0.49 -1.57 0.09 1.21 -0.49 0.00 0.00 175.26 174.98 1qni s ASN 413 N -4.73 3.03 -0.33 -0.19 2.47 -1.21 -2.12 114.94 111.85 1qni s ASN 413 Ca 0.67 -0.98 -0.10 0.00 0.42 0.00 0.00 52.86 52.87 1qni s ASN 413 Cb -0.06 -0.45 0.01 0.00 -1.45 0.00 0.00 41.25 39.30 1qni s ASN 413 CO 0.46 -0.37 0.16 -1.81 -3.72 0.00 0.00 177.10 171.82 1qni s ASP 414 N 1.98 5.55 -0.21 -4.21 1.01 -0.67 -0.81 116.67 119.33 1qni s ASP 414 Ca 0.04 -0.74 -0.10 0.00 0.71 0.00 0.00 52.55 52.46 1qni s ASP 414 Cb -0.16 -1.99 -0.05 0.00 1.01 0.00 0.00 42.92 41.73 1qni s ASP 414 CO -0.18 -0.27 0.13 -1.10 0.21 0.00 0.00 175.17 173.96 1qni s GLN 415 N 1.57 4.14 -0.11 8.23 -0.21 0.52 -0.98 119.66 132.82 1qni s GLN 415 Ca 0.03 -0.24 -0.24 0.00 0.02 0.00 0.00 55.36 54.92 1qni s GLN 415 Cb -0.18 -3.42 -0.03 0.00 1.00 0.00 0.00 33.01 30.38 1qni s GLN 415 CO 0.06 0.25 0.77 -1.17 -2.12 0.00 0.00 175.29 173.07 1qni s LEU 416 N 0.51 4.25 -0.07 2.90 2.96 -0.14 -1.83 118.68 127.26 1qni s LEU 416 Ca 0.07 1.19 0.04 0.00 -0.22 0.00 0.00 54.13 55.21 1qni s LEU 416 Cb -0.12 -3.17 0.00 0.00 0.50 0.00 0.00 46.19 43.41 1qni s LEU 416 CO -0.00 -0.25 -0.18 -0.63 -1.32 0.00 0.00 176.35 173.96 1qni s ILE 417 N 1.43 1.59 -0.21 6.68 1.01 0.94 -0.95 121.20 131.69 1qni s ILE 417 Ca 0.38 -0.77 -0.29 0.00 0.00 0.00 0.00 60.65 59.98 1qni s ILE 417 Cb -0.17 -1.39 0.00 0.00 0.01 0.00 0.00 42.46 40.91 1qni s ILE 417 CO 0.16 0.46 1.02 -0.62 0.00 0.00 0.00 174.94 175.96 1qni s ASP 418 N 0.33 7.12 -0.02 3.58 -1.08 0.57 -0.73 116.67 126.43 1qni s ASP 418 Ca -0.12 1.39 0.03 0.00 -0.52 0.00 0.00 52.55 53.33 1qni s ASP 418 Cb -0.15 -2.54 0.05 0.00 -1.46 0.00 0.00 42.92 38.82 1qni s ASP 418 CO 0.05 -0.62 0.96 2.30 0.52 0.00 0.00 175.17 178.38 1qni n ILE 419 N 5.16 0.98 0.28 4.11 -5.35 -0.74 -2.03 119.36 121.77 1qni n ILE 419 Ca 0.11 -1.04 0.15 0.00 -0.27 0.00 0.00 62.75 61.70 1qni n ILE 419 Cb 0.47 0.45 0.78 0.00 -1.74 0.00 0.00 39.64 39.59 1qni n ILE 419 CO 0.00 0.00 0.00 0.77 -1.76 0.00 0.00 176.55 175.56 1qni h SER 420 N 0.00 0.00 -4.71 7.28 4.64 -1.49 -3.44 113.55 115.84 1qni h SER 420 Ca 0.00 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.17 1qni h SER 420 Cb 0.67 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.76 1qni h SER 420 CO 0.00 0.08 -0.03 0.61 -0.87 0.00 0.00 176.83 176.62 1qni n GLY 421 N -0.51 2.10 0.18 -0.77 0.00 -1.26 -4.99 105.19 99.94 1qni n GLY 421 Ca -0.01 -2.17 0.13 0.00 0.00 0.00 0.00 46.02 43.97 1qni n GLY 421 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1qni h GLU 422 N 0.00 0.00 -5.93 1.61 4.81 -1.97 -3.44 114.58 109.66 1qni h GLU 422 Ca -0.09 0.00 -0.69 0.00 -0.13 0.00 0.00 59.36 58.46 1qni h GLU 422 Cb 0.39 0.00 -0.30 0.00 0.63 0.00 0.00 28.75 29.47 1qni h GLU 422 CO 0.13 0.00 -0.86 -2.00 -0.73 0.00 0.00 179.01 175.55 1qni s GLU 423 N -3.29 2.66 0.25 1.92 2.12 -1.26 -5.00 118.70 116.10 1qni s GLU 423 Ca 0.06 -0.86 -0.30 0.00 0.36 0.00 0.00 54.97 54.24 1qni s GLU 423 Cb 0.09 -2.24 -0.09 0.00 0.26 0.00 0.00 34.13 32.15 1qni s GLU 423 CO 0.57 0.38 1.17 -1.64 -0.54 0.00 0.00 175.26 175.19 1qni s MET 424 N -0.14 4.54 -0.08 4.30 -1.94 -1.26 -4.74 119.30 119.97 1qni s MET 424 Ca -0.04 1.88 -0.02 0.00 -1.71 0.00 0.00 55.69 55.81 1qni s MET 424 Cb -0.14 -3.20 0.03 0.00 2.01 0.00 0.00 34.83 33.54 1qni s MET 424 CO 0.04 0.04 0.03 0.15 -0.01 0.00 0.00 175.02 175.27 1qni s LYS 425 N -0.98 0.36 0.26 2.03 1.02 -0.86 -4.99 119.74 116.59 1qni s LYS 425 Ca 0.48 0.12 -0.30 0.00 0.02 0.00 0.00 55.97 56.29 1qni s LYS 425 Cb -0.33 -1.03 -0.10 0.00 -0.52 0.00 0.00 37.83 35.85 1qni s LYS 425 CO 0.41 -0.38 1.40 -1.17 -0.92 0.00 0.00 175.35 174.69 1qni s LEU 426 N 2.03 4.39 0.00 3.17 2.96 -1.26 -0.31 118.68 129.66 1qni s LEU 426 Ca 0.04 2.65 0.00 0.00 -0.22 0.00 0.00 54.13 56.60 1qni s LEU 426 Cb -0.13 -3.63 0.00 0.00 0.50 0.00 0.00 46.19 42.93 1qni s LEU 426 CO -0.05 -0.66 0.00 0.52 -1.32 0.00 0.00 176.35 174.84 1qni n VAL 427 N 2.05 0.00 -3.75 1.68 0.31 -0.12 -4.87 118.33 113.62 1qni n VAL 427 Ca 0.05 0.00 -0.13 0.00 -0.01 0.00 0.00 64.34 64.25 1qni n VAL 427 Cb 0.41 -0.62 -0.10 0.00 -0.91 0.00 0.00 33.84 32.62 1qni n VAL 427 CO 0.00 0.00 0.00 -2.28 -1.32 0.00 0.00 176.83 173.23 1qni s HIS 428 N -1.75 -0.30 -0.41 3.52 5.65 -0.97 -4.97 115.29 116.05 1qni s HIS 428 Ca 0.00 0.66 -0.05 0.00 0.25 0.00 0.00 55.06 55.92 1qni s HIS 428 Cb 0.00 0.12 0.10 0.00 -1.18 0.00 0.00 32.58 31.62 1qni s HIS 428 CO 0.00 -0.28 0.22 -0.51 -0.65 0.00 0.00 174.74 173.52 1qni s ASP 429 N -0.47 5.37 -0.44 9.88 1.11 -1.26 -0.96 116.67 129.90 1qni s ASP 429 Ca -0.06 -1.80 -0.15 0.00 0.18 0.00 0.00 52.55 50.72 1qni s ASP 429 Cb -0.04 -1.88 0.04 0.00 1.07 0.00 0.00 42.92 42.12 1qni s ASP 429 CO 0.02 -0.53 0.35 -0.83 1.18 0.00 0.00 175.17 175.36 1qni s GLY 430 N 1.96 2.02 0.33 0.21 0.00 -0.15 -4.96 107.32 106.73 1qni s GLY 430 Ca 0.05 -1.88 -0.28 0.00 0.00 0.00 0.00 44.72 42.60 1qni s GLY 430 CO -0.02 1.00 1.25 2.56 0.00 0.00 0.00 173.10 177.89 1qni s PRO 431 N 1.70 4.36 0.02 2.90 0.04 -1.26 -1.66 135.00 141.10 1qni s PRO 431 Ca 0.05 2.08 0.00 0.00 0.04 0.00 0.00 61.00 63.18 1qni s PRO 431 Cb -0.21 -3.04 -0.01 0.00 0.04 0.00 0.00 34.50 31.28 1qni s PRO 431 CO 0.09 -0.13 -0.03 0.99 0.04 0.00 0.00 177.00 177.96 1qni s THR 432 N -1.18 0.15 0.60 1.26 2.01 -0.90 -4.93 115.64 112.65 1qni s THR 432 Ca 0.49 -0.67 -0.06 0.00 0.31 0.00 0.00 61.69 61.76 1qni s THR 432 Cb -0.37 -0.24 0.01 0.00 0.01 0.00 0.00 72.50 71.91 1qni s THR 432 CO 0.49 -0.33 0.91 -0.47 -0.69 0.00 0.00 174.62 174.53 1qni s TYR 433 N -1.02 3.25 -0.10 4.92 5.04 -1.26 0.69 117.35 128.88 1qni s TYR 433 Ca -0.10 0.66 -0.04 0.00 -2.44 0.00 0.00 57.07 55.15 1qni s TYR 433 Cb -0.07 -2.76 0.01 0.00 0.35 0.00 0.00 41.96 39.48 1qni s TYR 433 CO -0.01 -0.85 0.10 0.00 -1.34 0.00 0.00 175.55 173.46 1qni n ALA 434 N -2.61 -1.24 -0.09 3.97 0.00 -1.26 -4.10 120.51 115.18 1qni n ALA 434 Ca 0.05 0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.50 1qni n ALA 434 Cb 0.58 -0.26 0.00 0.00 0.00 0.00 0.00 19.45 19.77 1qni n ALA 434 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1qni n GLU 435 N -0.35 0.00 -2.99 0.00 2.13 -1.26 -4.25 120.64 113.92 1qni n GLU 435 Ca -0.03 0.00 -0.30 0.00 0.66 0.00 0.00 57.16 57.49 1qni n GLU 435 Cb 0.11 0.00 -0.03 0.00 0.27 0.00 0.00 31.44 31.79 1qni n GLU 435 CO 0.00 0.00 0.00 -1.25 -0.41 0.00 0.00 177.13 175.47 1qni s PRO 436 N 0.00 3.75 0.00 5.31 0.04 -1.26 -3.03 135.00 139.81 1qni s PRO 436 Ca 0.00 0.36 0.00 0.00 0.04 0.00 0.00 61.00 61.40 1qni s PRO 436 Cb 0.00 -2.46 0.00 0.00 0.04 0.00 0.00 34.50 32.08 1qni s PRO 436 CO 0.00 0.04 0.00 0.72 0.04 0.00 0.00 177.00 177.80 1qni n HIS 437 N -1.15 0.00 -3.41 0.56 8.25 -1.26 -4.91 115.22 113.29 1qni n HIS 437 Ca 0.01 0.00 -0.19 0.00 -0.26 0.00 0.00 57.72 57.28 1qni n HIS 437 Cb 0.54 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.63 1qni n HIS 437 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1qni s ASP 438 N -0.10 5.36 0.17 0.41 2.15 -0.83 -4.18 116.67 119.65 1qni s ASP 438 Ca 0.00 -0.55 -0.14 0.00 0.43 0.00 0.00 52.55 52.28 1qni s ASP 438 Cb 0.00 -0.72 0.02 0.00 -0.30 0.00 0.00 42.92 41.92 1qni s ASP 438 CO 0.00 -0.62 0.42 0.00 -0.17 0.00 0.00 175.17 174.79 1qni s ILE 440 N -3.89 0.49 -0.09 0.00 2.07 -0.87 -4.91 121.20 113.99 1qni s ILE 440 Ca 0.10 -0.23 -0.01 0.00 -1.41 0.00 0.00 60.65 59.10 1qni s ILE 440 Cb 0.01 -0.44 -0.03 0.00 0.13 0.00 0.00 42.46 42.13 1qni s ILE 440 CO -0.04 0.16 -0.03 -0.76 -1.91 0.00 0.00 174.94 172.36 1qni s LEU 441 N 0.11 3.38 0.02 8.50 1.43 -1.26 -1.26 118.68 129.60 1qni s LEU 441 Ca -0.01 0.04 0.02 0.00 -1.03 0.00 0.00 54.13 53.15 1qni s LEU 441 Cb -0.05 -1.77 -0.02 0.00 0.03 0.00 0.00 46.19 44.38 1qni s LEU 441 CO -0.00 0.33 -0.08 0.68 0.23 0.00 0.00 176.35 177.51 1qni s VAL 442 N -0.60 0.56 0.59 -1.59 -7.23 -0.85 -3.81 120.40 107.47 1qni s VAL 442 Ca 0.09 -0.70 -0.20 0.00 -1.81 0.00 0.00 61.98 59.36 1qni s VAL 442 Cb -0.12 -0.55 -0.03 0.00 0.56 0.00 0.00 36.38 36.24 1qni s VAL 442 CO 0.02 -0.12 1.33 0.54 -0.31 0.00 0.00 175.10 176.56 1qni n ARG 443 N 2.16 1.46 -0.27 4.82 1.74 -1.26 -0.74 116.66 124.56 1qni n ARG 443 Ca -0.18 0.55 0.08 0.00 -0.77 0.00 0.00 57.85 57.53 1qni n ARG 443 Cb 0.56 -2.56 0.22 0.00 -1.02 0.00 0.00 32.46 29.67 1qni n ARG 443 CO 0.00 0.00 0.00 -0.09 -1.52 0.00 0.00 177.63 176.02 1qni h ARG 444 N 1.06 0.39 0.00 5.56 2.43 -1.31 -1.19 114.38 121.33 1qni h ARG 444 Ca -0.51 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.64 1qni h ARG 444 Cb 1.32 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.78 1qni h ARG 444 CO 0.55 0.26 0.00 -0.40 -1.51 0.00 0.00 179.97 178.87 1qni n ASP 445 N -5.05 0.00 -0.49 -3.80 5.68 -1.26 -3.03 116.55 108.60 1qni n ASP 445 Ca 0.17 -0.12 0.13 0.00 -0.50 0.00 0.00 54.79 54.47 1qni n ASP 445 Cb 0.50 -0.26 0.49 0.00 -1.14 0.00 0.00 41.12 40.71 1qni n ASP 445 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1qni n GLN 446 N -1.26 1.66 -4.74 0.11 6.02 -0.45 -4.77 117.38 113.95 1qni n GLN 446 Ca 0.12 -0.98 -0.32 0.00 -0.01 0.00 0.00 57.00 55.81 1qni n GLN 446 Cb 0.18 -1.45 -0.17 0.00 1.02 0.00 0.00 30.24 29.82 1qni n GLN 446 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1qni s ILE 447 N -1.94 2.05 -0.30 5.09 -1.09 -1.17 -3.71 121.20 120.13 1qni s ILE 447 Ca 0.37 -0.98 0.03 0.00 -2.23 0.00 0.00 60.65 57.84 1qni s ILE 447 Cb 0.20 -1.81 0.08 0.00 -1.58 0.00 0.00 42.46 39.36 1qni s ILE 447 CO 0.31 0.55 -0.02 -0.54 -1.23 0.00 0.00 174.94 174.02 1qni s LYS 448 N 0.75 1.77 0.33 2.79 1.02 -1.26 -5.03 119.74 120.12 1qni s LYS 448 Ca -0.09 -1.63 0.05 0.00 0.02 0.00 0.00 55.97 54.33 1qni s LYS 448 Cb -0.16 -3.04 -0.01 0.00 -0.52 0.00 0.00 37.83 34.10 1qni s LYS 448 CO -0.00 -0.78 0.48 0.99 -0.92 0.00 0.00 175.35 175.11 1qni s THR 449 N 1.01 4.35 -0.01 2.17 2.01 -1.26 -4.42 115.64 119.48 1qni s THR 449 Ca 0.03 -0.90 0.03 0.00 0.31 0.00 0.00 61.69 61.15 1qni s THR 449 Cb -0.19 -3.53 -0.03 0.00 0.01 0.00 0.00 72.50 68.76 1qni s THR 449 CO -0.07 -0.23 -0.09 -0.54 -0.69 0.00 0.00 174.62 173.00 1qni s LYS 450 N -4.19 2.54 -0.01 4.92 1.02 -0.50 -5.04 119.74 118.47 1qni s LYS 450 Ca 0.43 -0.71 0.16 0.00 0.02 0.00 0.00 55.97 55.87 1qni s LYS 450 Cb -0.09 -2.47 -0.19 0.00 -0.52 0.00 0.00 37.83 34.55 1qni s LYS 450 CO 0.32 0.61 0.68 1.63 -0.92 0.00 0.00 175.35 177.67 1qni n LYS 451 N 1.78 0.63 -4.14 1.68 4.01 -1.26 -4.87 118.16 115.99 1qni n LYS 451 Ca -0.16 0.22 -0.09 0.00 -0.51 0.00 0.00 58.31 57.76 1qni n LYS 451 Cb 0.53 -1.77 -0.10 0.00 -0.51 0.00 0.00 35.03 33.18 1qni n LYS 451 CO 0.00 0.00 0.00 0.96 -1.11 0.00 0.00 177.40 177.25 1qni s ILE 452 N -2.78 0.17 0.46 -0.18 -4.36 -1.26 -4.68 121.20 108.57 1qni s ILE 452 Ca -0.04 -1.89 -0.07 0.00 -0.26 0.00 0.00 60.65 58.38 1qni s ILE 452 Cb 0.08 -1.93 -0.04 0.00 1.25 0.00 0.00 42.46 41.82 1qni s ILE 452 CO 0.82 -0.59 0.79 -0.31 0.24 0.00 0.00 174.94 175.89 1qni s TYR 453 N -3.99 3.54 -0.05 1.37 2.02 -0.50 -5.05 117.35 114.69 1qni s TYR 453 Ca 0.20 0.89 -0.09 0.00 -0.37 0.00 0.00 57.07 57.71 1qni s TYR 453 Cb 0.07 -2.35 -0.05 0.00 -0.40 0.00 0.00 41.96 39.24 1qni s TYR 453 CO -0.01 -0.24 0.24 -1.21 -1.57 0.00 0.00 175.55 172.77 1qni s GLU 454 N -4.49 3.60 0.00 -0.62 0.41 -1.26 -4.71 118.70 111.62 1qni s GLU 454 Ca 0.49 0.01 0.05 0.00 -0.41 0.00 0.00 54.97 55.11 1qni s GLU 454 Cb -0.10 -3.16 0.27 0.00 -1.78 0.00 0.00 34.13 29.35 1qni s GLU 454 CO 0.41 0.71 1.04 0.54 -0.49 0.00 0.00 175.26 177.48 1qni n ARG 455 N 1.64 0.06 -0.44 1.61 5.12 -1.26 -1.53 116.66 121.87 1qni n ARG 455 Ca -0.16 0.27 0.08 0.00 -1.93 0.00 0.00 57.85 56.11 1qni n ARG 455 Cb 0.54 -1.50 0.25 0.00 -1.16 0.00 0.00 32.46 30.58 1qni n ARG 455 CO 0.00 0.00 0.00 0.27 -1.93 0.00 0.00 177.63 175.97 1qni n ASN 456 N -1.33 3.66 -4.75 0.55 2.04 -1.26 -5.03 115.26 109.15 1qni n ASN 456 Ca 0.02 -3.08 -0.41 0.00 -0.44 0.00 0.00 54.58 50.67 1qni n ASN 456 Cb 0.05 -0.54 -0.02 0.00 -2.53 0.00 0.00 39.78 36.73 1qni n ASN 456 CO 0.00 0.00 0.00 -0.62 -0.44 0.00 0.00 177.26 176.20 1qni s ASP 457 N -2.06 6.76 0.42 0.53 -1.08 -0.58 -4.91 116.67 115.76 1qni s ASP 457 Ca 0.42 2.59 0.16 0.00 -0.52 0.00 0.00 52.55 55.20 1qni s ASP 457 Cb 0.34 -2.63 1.05 0.00 -1.46 0.00 0.00 42.92 40.23 1qni s ASP 457 CO 0.08 -0.60 1.90 -0.65 0.52 0.00 0.00 175.17 176.42 1qni h PRO 458 N 4.68 0.41 0.00 4.34 0.11 -1.95 -2.56 132.00 137.02 1qni h PRO 458 Ca -0.46 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1qni h PRO 458 Cb 1.22 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1qni h PRO 458 CO 0.74 0.27 0.38 -0.92 -0.21 0.00 0.00 178.00 178.26 1qni h TYR 459 N 0.42 0.00 -0.08 0.65 3.20 -1.98 -1.20 116.97 117.98 1qni h TYR 459 Ca 0.40 0.00 -0.19 0.00 3.14 0.00 0.00 58.73 62.08 1qni h TYR 459 Cb 0.93 0.00 -0.39 0.00 1.54 0.00 0.00 36.73 38.81 1qni h TYR 459 CO -0.00 0.00 -1.05 1.97 -1.64 0.00 0.00 178.16 177.44 1qni n PHE 460 N -2.44 0.25 -0.21 -3.82 1.16 -0.97 -4.87 117.46 106.55 1qni n PHE 460 Ca -0.01 -0.83 -0.06 0.00 -1.87 0.00 0.00 57.45 54.68 1qni n PHE 460 Cb 0.41 -0.17 0.04 0.00 -1.61 0.00 0.00 39.48 38.15 1qni n PHE 460 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1qni h ALA 461 N 1.30 0.76 -0.94 1.98 0.00 -1.25 -2.07 119.26 119.03 1qni h ALA 461 Ca -0.21 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 54.67 1qni h ALA 461 Cb 1.77 -0.24 -0.05 0.00 0.00 0.00 0.00 17.79 19.27 1qni h ALA 461 CO 0.12 0.21 0.62 0.66 0.00 0.00 0.00 179.25 180.86 1qni h SER 462 N 0.81 1.06 0.39 0.00 4.64 -1.90 -1.63 113.55 116.91 1qni h SER 462 Ca 0.22 -0.02 -0.01 0.00 -0.47 0.00 0.00 61.79 61.50 1qni h SER 462 Cb -0.06 -0.26 -0.00 0.00 -0.31 0.00 0.00 62.40 61.77 1qni h SER 462 CO -0.04 0.76 -0.23 0.00 -0.87 0.00 0.00 176.83 176.45 1qni h ARG 464 N -0.58 0.00 0.03 0.00 0.11 -1.32 0.11 114.38 112.73 1qni h ARG 464 Ca -0.04 0.00 -0.21 0.00 0.10 0.00 0.00 59.98 59.82 1qni h ARG 464 Cb 0.47 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.54 1qni h ARG 464 CO 0.05 0.00 -0.97 0.00 0.10 0.00 0.00 179.97 179.15 1qni h ALA 465 N 2.17 0.41 0.00 0.08 0.00 -0.89 -1.27 119.26 119.77 1qni h ALA 465 Ca 0.00 -0.79 -0.19 0.00 0.00 0.00 0.00 54.91 53.93 1qni h ALA 465 Cb 0.44 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.12 1qni h ALA 465 CO 0.00 1.00 -0.89 0.37 0.00 0.00 0.00 179.25 179.73 1qni h GLN 466 N 0.07 0.01 -0.14 0.00 5.75 -0.32 -2.90 115.11 117.58 1qni h GLN 466 Ca -0.05 -0.02 -0.02 0.00 -0.15 0.00 0.00 58.65 58.41 1qni h GLN 466 Cb 1.65 0.01 -0.01 0.00 1.07 0.00 0.00 27.48 30.20 1qni h GLN 466 CO 0.15 0.89 0.02 0.00 -2.65 0.00 0.00 178.83 177.24 1qni h ALA 467 N 1.10 0.19 -0.14 3.38 0.00 -0.62 -2.29 119.26 120.89 1qni h ALA 467 Ca -0.01 -0.17 0.04 0.00 0.00 0.00 0.00 54.91 54.76 1qni h ALA 467 Cb 1.57 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 19.27 1qni h ALA 467 CO 0.12 -0.13 -0.11 1.49 0.00 0.00 0.00 179.25 180.62 1qni h GLU 468 N 0.01 -0.11 -0.74 0.00 4.57 -1.25 0.14 114.58 117.20 1qni h GLU 468 Ca 0.04 0.01 0.10 0.00 -1.18 0.00 0.00 59.36 58.33 1qni h GLU 468 Cb 0.32 0.03 -0.05 0.00 -0.16 0.00 0.00 28.75 28.89 1qni h GLU 468 CO 0.00 -0.08 0.49 0.87 -1.18 0.00 0.00 179.01 179.11 1qni h LYS 469 N -0.12 0.62 -0.01 1.92 1.57 -1.44 0.26 116.57 119.38 1qni h LYS 469 Ca 0.09 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 1qni h LYS 469 Cb 0.25 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.42 1qni h LYS 469 CO -0.21 0.41 -0.01 -0.25 -0.57 0.00 0.00 179.45 178.82 1qni n ASP 470 N -4.49 0.97 -3.41 0.86 8.00 -0.57 -4.93 116.55 112.97 1qni n ASP 470 Ca 0.12 -1.28 -0.22 0.00 0.71 0.00 0.00 54.79 54.12 1qni n ASP 470 Cb 0.34 -0.00 0.08 0.00 -0.02 0.00 0.00 41.12 41.51 1qni n ASP 470 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1qni n GLY 471 N 1.13 -0.45 3.41 0.44 0.00 0.93 -5.01 105.19 105.64 1qni n GLY 471 Ca 0.20 0.20 -0.31 0.00 0.00 0.00 0.00 46.02 46.11 1qni n GLY 471 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1qni s VAL 472 N -3.30 2.53 -0.45 1.61 -7.23 0.05 -5.00 120.40 108.61 1qni s VAL 472 Ca 0.51 -1.26 -0.15 0.00 -1.81 0.00 0.00 61.98 59.27 1qni s VAL 472 Cb -0.23 -2.03 0.05 0.00 0.56 0.00 0.00 36.38 34.73 1qni s VAL 472 CO 0.69 0.35 0.35 -0.89 -0.31 0.00 0.00 175.10 175.30 1qni s THR 473 N -0.87 5.24 0.30 5.32 2.01 -1.26 -4.34 115.64 122.04 1qni s THR 473 Ca 0.13 -0.90 0.04 0.00 0.31 0.00 0.00 61.69 61.28 1qni s THR 473 Cb -0.10 -4.04 0.30 0.00 0.01 0.00 0.00 72.50 68.67 1qni s THR 473 CO 0.04 -0.46 1.81 -0.07 -0.69 0.00 0.00 174.62 175.25 1qni h LEU 474 N 8.70 0.83 -0.18 4.42 3.38 -1.95 0.26 115.31 130.77 1qni h LEU 474 Ca -0.28 0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.76 1qni h LEU 474 Cb 1.11 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.77 1qni h LEU 474 CO 0.81 0.38 0.00 -0.62 0.09 0.00 0.00 178.44 179.10 1qni n GLU 475 N -4.67 0.05 0.00 1.13 4.71 -1.26 -4.08 120.64 116.52 1qni n GLU 475 Ca 0.21 0.31 0.00 0.00 -0.01 0.00 0.00 57.16 57.67 1qni n GLU 475 Cb 0.47 -1.59 0.00 0.00 -1.01 0.00 0.00 31.44 29.31 1qni n GLU 475 CO 0.00 0.00 0.00 -1.13 0.09 0.00 0.00 177.13 176.09 1qni n SER 476 N -1.68 0.00 -4.88 1.62 3.41 -0.76 -5.00 113.62 106.34 1qni n SER 476 Ca 0.03 -0.02 -0.31 0.00 -0.26 0.00 0.00 58.87 58.30 1qni n SER 476 Cb 0.17 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.07 1qni n SER 476 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1qni s ASP 477 N 0.00 6.59 -0.41 4.04 1.01 0.83 -5.00 116.67 123.73 1qni s ASP 477 Ca 0.00 0.88 0.04 0.00 0.71 0.00 0.00 52.55 54.18 1qni s ASP 477 Cb 0.00 -2.21 0.17 0.00 1.01 0.00 0.00 42.92 41.89 1qni s ASP 477 CO 0.00 -0.09 0.35 0.20 0.21 0.00 0.00 175.17 175.84 1qni s ASN 478 N -2.49 1.30 0.26 0.27 0.01 -1.26 -3.98 114.94 109.06 1qni s ASN 478 Ca 0.47 -3.02 0.08 0.00 -0.71 0.00 0.00 52.86 49.68 1qni s ASN 478 Cb -0.11 -0.35 -0.05 0.00 0.41 0.00 0.00 41.25 41.14 1qni s ASN 478 CO 0.23 -0.17 -0.12 -0.54 -1.51 0.00 0.00 177.10 174.99 1qni s LYS 479 N 0.09 1.53 -0.29 -0.60 1.02 -0.87 -4.98 119.74 115.63 1qni s LYS 479 Ca 0.33 -1.73 0.02 0.00 0.02 0.00 0.00 55.97 54.61 1qni s LYS 479 Cb 0.04 -1.32 0.08 0.00 -0.52 0.00 0.00 37.83 36.11 1qni s LYS 479 CO -0.19 0.15 -0.00 0.08 -0.92 0.00 0.00 175.35 174.47 1qni s VAL 480 N -2.86 1.88 -0.26 3.17 1.01 -1.26 -0.90 120.40 121.18 1qni s VAL 480 Ca 0.27 -1.79 -0.14 0.00 0.00 0.00 0.00 61.98 60.32 1qni s VAL 480 Cb 0.00 -2.24 -0.04 0.00 0.00 0.00 0.00 36.38 34.10 1qni s VAL 480 CO 0.11 -0.37 0.31 -0.63 0.00 0.00 0.00 175.10 174.52 1qni s ILE 481 N 1.16 5.23 -0.12 2.22 1.01 -0.74 -4.97 121.20 125.00 1qni s ILE 481 Ca 0.03 0.46 -0.14 0.00 0.00 0.00 0.00 60.65 61.00 1qni s ILE 481 Cb -0.19 -3.64 -0.05 0.00 0.01 0.00 0.00 42.46 38.59 1qni s ILE 481 CO -0.09 0.22 0.33 -0.13 0.00 0.00 0.00 174.94 175.26 1qni s ARG 482 N 1.74 4.13 -0.45 2.79 0.52 -1.26 -1.23 118.95 125.20 1qni s ARG 482 Ca 0.13 0.19 0.08 0.00 -0.52 0.00 0.00 55.73 55.61 1qni s ARG 482 Cb -0.15 -3.37 0.29 0.00 0.52 0.00 0.00 34.95 32.24 1qni s ARG 482 CO 0.09 0.37 0.66 -3.47 0.02 0.00 0.00 175.30 172.97 1qni n ASP 483 N 3.09 1.44 0.00 0.23 2.03 0.16 -5.01 116.55 118.49 1qni n ASP 483 Ca -0.12 -3.01 0.00 0.00 0.52 0.00 0.00 54.79 52.17 1qni n ASP 483 Cb 0.52 -0.63 0.00 0.00 -0.72 0.00 0.00 41.12 40.29 1qni n ASP 483 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1qni n GLY 484 N 0.84 1.86 0.00 0.27 0.00 -1.26 -1.73 105.19 105.16 1qni n GLY 484 Ca 0.25 -0.17 0.12 0.00 0.00 0.00 0.00 46.02 46.21 1qni n GLY 484 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1qni n ASN 485 N 10.11 0.53 -4.86 1.61 3.02 -1.26 -4.86 115.26 119.55 1qni n ASN 485 Ca 0.00 -0.29 -0.36 0.00 -0.03 0.00 0.00 54.58 53.89 1qni n ASN 485 Cb 0.00 0.30 -0.06 0.00 -0.61 0.00 0.00 39.78 39.41 1qni n ASN 485 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1qni s LYS 486 N -3.00 3.69 -0.07 3.52 1.02 -0.71 -0.62 119.74 123.56 1qni s LYS 486 Ca 0.11 0.12 -0.01 0.00 0.02 0.00 0.00 55.97 56.21 1qni s LYS 486 Cb 0.17 -3.15 0.03 0.00 -0.52 0.00 0.00 37.83 34.36 1qni s LYS 486 CO 0.71 0.69 -0.01 0.08 -0.92 0.00 0.00 175.35 175.90 1qni s VAL 487 N -1.16 0.47 -0.37 3.17 1.01 -0.50 0.38 120.40 123.39 1qni s VAL 487 Ca 0.24 0.06 -0.08 0.00 0.00 0.00 0.00 61.98 62.19 1qni s VAL 487 Cb -0.14 -0.60 0.05 0.00 0.00 0.00 0.00 36.38 35.69 1qni s VAL 487 CO 0.12 0.27 0.17 -0.13 0.00 0.00 0.00 175.10 175.54 1qni s ARG 488 N 1.86 2.65 -0.32 2.72 0.52 -0.36 -0.56 118.95 125.46 1qni s ARG 488 Ca 0.04 -1.25 -0.15 0.00 -0.52 0.00 0.00 55.73 53.86 1qni s ARG 488 Cb -0.12 -3.62 -0.02 0.00 0.52 0.00 0.00 34.95 31.71 1qni s ARG 488 CO -0.05 -0.76 0.34 0.08 0.02 0.00 0.00 175.30 174.92 1qni s VAL 489 N 1.44 5.19 -0.21 3.52 1.01 0.82 -1.80 120.40 130.37 1qni s VAL 489 Ca 0.01 0.12 -0.08 0.00 0.00 0.00 0.00 61.98 62.03 1qni s VAL 489 Cb -0.20 -3.77 -0.04 0.00 0.00 0.00 0.00 36.38 32.37 1qni s VAL 489 CO 0.03 -0.01 0.08 -0.31 0.00 0.00 0.00 175.10 174.89 1qni s TYR 490 N 1.98 3.20 0.08 5.22 1.51 -0.07 0.12 117.35 129.39 1qni s TYR 490 Ca 0.11 -0.04 0.05 0.00 -1.01 0.00 0.00 57.07 56.18 1qni s TYR 490 Cb -0.16 -2.15 -0.03 0.00 -0.11 0.00 0.00 41.96 39.50 1qni s TYR 490 CO 0.11 -0.01 -0.14 -1.64 -1.11 0.00 0.00 175.55 172.76 1qni s MET 491 N 0.84 0.88 0.34 -0.62 -1.94 -0.22 -2.06 119.30 116.53 1qni s MET 491 Ca 0.04 -1.04 0.08 0.00 -1.71 0.00 0.00 55.69 53.07 1qni s MET 491 Cb -0.13 -0.87 -0.04 0.00 2.01 0.00 0.00 34.83 35.79 1qni s MET 491 CO 0.02 0.19 0.18 -0.08 -0.01 0.00 0.00 175.02 175.32 1qni s THR 492 N -1.49 3.11 -0.13 2.05 -1.32 -1.26 -1.65 115.64 114.96 1qni s THR 492 Ca 0.01 -1.61 -0.11 0.00 -1.21 0.00 0.00 61.69 58.77 1qni s THR 492 Cb -0.09 -3.03 0.04 0.00 -1.51 0.00 0.00 72.50 67.91 1qni s THR 492 CO 0.02 -0.17 0.33 -0.94 -2.21 0.00 0.00 174.62 171.66 1qni s SER 493 N -3.89 -0.35 0.12 8.08 1.04 0.44 0.25 113.70 119.39 1qni s SER 493 Ca 0.39 0.68 -0.21 0.00 0.48 0.00 0.00 55.95 57.28 1qni s SER 493 Cb -0.03 0.67 0.06 0.00 0.10 0.00 0.00 66.02 66.81 1qni s SER 493 CO 0.24 -0.13 0.53 0.68 0.98 0.00 0.00 173.24 175.54 1qni s VAL 494 N 0.35 0.03 0.00 5.02 -7.23 -0.93 -0.70 120.40 116.93 1qni s VAL 494 Ca -0.01 -0.22 0.00 0.00 -1.81 0.00 0.00 61.98 59.93 1qni s VAL 494 Cb -0.03 -1.05 0.00 0.00 0.56 0.00 0.00 36.38 35.86 1qni s VAL 494 CO -0.01 -0.12 0.00 0.00 -0.31 0.00 0.00 175.10 174.66 1qni n ALA 495 N -0.13 0.00 -0.84 1.32 0.00 -1.26 -0.65 120.51 118.96 1qni n ALA 495 Ca -0.17 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.07 1qni n ALA 495 Cb 0.63 0.00 0.07 0.00 0.00 0.00 0.00 19.45 20.15 1qni n ALA 495 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1qni n PRO 496 N 9.93 1.97 -3.97 0.00 -0.04 -1.26 -4.91 135.00 136.72 1qni n PRO 496 Ca 0.00 -2.00 -0.09 0.00 -0.04 0.00 0.00 63.50 61.37 1qni n PRO 496 Cb 0.00 -1.78 -0.11 0.00 -0.04 0.00 0.00 33.50 31.56 1qni n PRO 496 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 1qni s GLN 497 N -2.29 0.28 0.22 0.54 -0.21 0.18 -3.94 119.66 114.43 1qni s GLN 497 Ca 0.39 -0.54 -0.07 0.00 0.02 0.00 0.00 55.36 55.17 1qni s GLN 497 Cb 0.31 0.10 -0.06 0.00 1.00 0.00 0.00 33.01 34.36 1qni s GLN 497 CO 0.02 -0.05 0.49 0.71 -2.12 0.00 0.00 175.29 174.34 1qni s TYR 498 N -1.29 3.45 -0.90 0.91 2.02 -1.26 -2.19 117.35 118.08 1qni s TYR 498 Ca -0.14 0.71 0.16 0.00 -0.37 0.00 0.00 57.07 57.42 1qni s TYR 498 Cb -0.09 -2.13 0.68 0.00 -0.40 0.00 0.00 41.96 40.02 1qni s TYR 498 CO -0.01 0.30 1.51 0.41 -1.57 0.00 0.00 175.55 176.19 1qni n GLY 499 N -0.27 -1.05 3.03 0.71 0.00 0.14 -4.63 105.19 103.12 1qni n GLY 499 Ca -0.01 -0.02 -0.16 0.00 0.00 0.00 0.00 46.02 45.83 1qni n GLY 499 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1qni s MET 500 N -3.06 0.57 0.00 1.61 -2.45 -1.26 -4.89 119.30 109.82 1qni s MET 500 Ca 0.06 -0.49 0.00 0.00 -1.25 0.00 0.00 55.69 54.02 1qni s MET 500 Cb 0.09 -0.48 0.00 0.00 1.25 0.00 0.00 34.83 35.69 1qni s MET 500 CO 0.29 0.12 0.77 0.25 1.05 0.00 0.00 175.02 177.50 1qni n THR 501 N 2.26 0.60 -3.64 10.11 -2.24 -1.26 -4.84 114.28 115.27 1qni n THR 501 Ca -0.17 -0.66 -0.06 0.00 -2.27 0.00 0.00 64.05 60.88 1qni n THR 501 Cb 0.56 0.75 -0.07 0.00 -2.10 0.00 0.00 70.33 69.47 1qni n THR 501 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1qni s ASP 502 N -0.60 -0.36 0.01 3.42 -1.08 -1.26 -1.96 116.67 114.85 1qni s ASP 502 Ca 0.00 0.67 -0.24 0.00 -0.52 0.00 0.00 52.55 52.46 1qni s ASP 502 Cb 0.00 0.77 0.05 0.00 -1.46 0.00 0.00 42.92 42.29 1qni s ASP 502 CO 0.00 -0.11 0.54 0.72 0.52 0.00 0.00 175.17 176.83 1qni s PHE 503 N 0.39 -0.46 0.12 -5.34 -0.71 -1.03 -4.99 117.98 105.97 1qni s PHE 503 Ca 0.02 0.63 0.08 0.00 -1.04 0.00 0.00 56.93 56.62 1qni s PHE 503 Cb -0.05 0.33 -0.04 0.00 -1.21 0.00 0.00 43.02 42.05 1qni s PHE 503 CO -0.10 -0.60 -0.13 0.15 -1.34 0.00 0.00 175.22 173.20 1qni s LYS 504 N -1.94 1.97 0.25 1.99 1.02 -1.26 -1.44 119.74 120.32 1qni s LYS 504 Ca -0.08 -1.14 -0.14 0.00 0.02 0.00 0.00 55.97 54.63 1qni s LYS 504 Cb -0.01 -2.20 -0.00 0.00 -0.52 0.00 0.00 37.83 35.10 1qni s LYS 504 CO 0.02 0.48 0.50 0.14 -0.92 0.00 0.00 175.35 175.57 1qni s VAL 505 N -1.29 0.00 0.03 3.17 -7.23 -0.78 -4.96 120.40 109.36 1qni s VAL 505 Ca 0.21 -1.35 0.02 0.00 -1.81 0.00 0.00 61.98 59.04 1qni s VAL 505 Cb -0.10 -2.16 -0.04 0.00 0.56 0.00 0.00 36.38 34.64 1qni s VAL 505 CO 0.13 -0.01 0.06 -0.54 -0.31 0.00 0.00 175.10 174.43 1qni s LYS 506 N -4.00 2.92 -0.13 4.82 1.02 -1.26 -1.91 119.74 121.20 1qni s LYS 506 Ca 0.21 -0.60 -0.37 0.00 0.02 0.00 0.00 55.97 55.22 1qni s LYS 506 Cb -0.01 -2.76 -0.15 0.00 -0.52 0.00 0.00 37.83 34.39 1qni s LYS 506 CO 0.08 0.61 1.71 -1.91 -0.92 0.00 0.00 175.35 174.91 1qni n GLU 507 N 0.90 1.54 0.00 1.68 2.13 -0.52 -0.65 120.64 125.72 1qni n GLU 507 Ca -0.11 0.56 0.00 0.00 0.66 0.00 0.00 57.16 58.27 1qni n GLU 507 Cb 0.52 -2.29 0.00 0.00 0.27 0.00 0.00 31.44 29.94 1qni n GLU 507 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1qni n GLY 508 N 3.92 0.43 3.76 8.31 0.00 -0.91 -4.63 105.19 116.07 1qni n GLY 508 Ca 0.23 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.84 1qni n GLY 508 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1qni s ASP 509 N -1.89 6.64 -0.62 1.61 1.11 0.18 -4.64 116.67 119.06 1qni s ASP 509 Ca 0.00 2.75 -0.24 0.00 0.18 0.00 0.00 52.55 55.24 1qni s ASP 509 Cb 0.00 -2.64 0.05 0.00 1.07 0.00 0.00 42.92 41.39 1qni s ASP 509 CO 0.00 -0.67 1.03 -0.70 1.18 0.00 0.00 175.17 176.02 1qni s GLU 510 N -1.31 3.25 -0.18 8.23 2.12 0.20 -1.35 118.70 129.66 1qni s GLU 510 Ca 0.54 -0.40 -0.15 0.00 0.36 0.00 0.00 54.97 55.32 1qni s GLU 510 Cb -0.42 -4.13 -0.04 0.00 0.26 0.00 0.00 34.13 29.80 1qni s GLU 510 CO 0.51 -1.73 0.34 0.08 -0.54 0.00 0.00 175.26 173.92 1qni s VAL 511 N 4.39 5.26 -0.22 3.70 1.01 0.98 -1.41 120.40 134.10 1qni s VAL 511 Ca 0.30 0.61 0.00 0.00 0.00 0.00 0.00 61.98 62.88 1qni s VAL 511 Cb -0.13 -3.67 0.03 0.00 0.00 0.00 0.00 36.38 32.61 1qni s VAL 511 CO 0.16 0.33 -0.12 -0.89 0.00 0.00 0.00 175.10 174.57 1qni s THR 512 N 0.86 2.47 -0.28 3.92 2.01 0.28 -0.28 115.64 124.62 1qni s THR 512 Ca 0.17 -1.07 -0.11 0.00 0.31 0.00 0.00 61.69 61.00 1qni s THR 512 Cb -0.14 -2.20 -0.05 0.00 0.01 0.00 0.00 72.50 70.12 1qni s THR 512 CO 0.06 0.30 0.18 -0.69 -0.69 0.00 0.00 174.62 173.78 1qni s VAL 513 N 1.28 5.21 -0.19 3.82 1.01 -0.01 -0.13 120.40 131.40 1qni s VAL 513 Ca 0.01 0.13 -0.07 0.00 0.00 0.00 0.00 61.98 62.04 1qni s VAL 513 Cb -0.16 -3.48 -0.04 0.00 0.00 0.00 0.00 36.38 32.70 1qni s VAL 513 CO -0.08 0.25 0.06 -0.31 0.00 0.00 0.00 175.10 175.02 1qni s TYR 514 N 1.75 3.22 -0.09 5.22 1.51 0.12 -2.12 117.35 126.96 1qni s TYR 514 Ca 0.07 0.00 0.04 0.00 -1.01 0.00 0.00 57.07 56.17 1qni s TYR 514 Cb -0.16 -2.09 -0.00 0.00 -0.11 0.00 0.00 41.96 39.60 1qni s TYR 514 CO 0.10 0.09 -0.22 0.42 -1.11 0.00 0.00 175.55 174.83 1qni s ILE 515 N 0.50 1.91 -0.10 2.71 -1.09 0.20 -1.06 121.20 124.27 1qni s ILE 515 Ca 0.03 -0.95 0.02 0.00 -2.23 0.00 0.00 60.65 57.53 1qni s ILE 515 Cb -0.13 -1.66 -0.01 0.00 -1.58 0.00 0.00 42.46 39.08 1qni s ILE 515 CO 0.01 0.53 -0.18 -0.89 -1.23 0.00 0.00 174.94 173.18 1qni s THR 516 N 0.29 2.65 -0.42 2.92 2.01 -0.66 -1.76 115.64 120.68 1qni s THR 516 Ca -0.16 -0.83 -0.15 0.00 0.31 0.00 0.00 61.69 60.87 1qni s THR 516 Cb -0.17 -2.06 0.03 0.00 0.01 0.00 0.00 72.50 70.31 1qni s THR 516 CO 0.07 0.55 0.31 0.21 -0.69 0.00 0.00 174.62 175.07 1qni s ASN 517 N 0.10 6.08 0.00 3.53 2.47 -0.65 -0.42 114.94 126.06 1qni s ASN 517 Ca -0.08 -0.98 0.28 0.00 0.42 0.00 0.00 52.86 52.49 1qni s ASN 517 Cb -0.15 -2.15 0.99 0.00 -1.45 0.00 0.00 41.25 38.48 1qni s ASN 517 CO 0.05 -0.48 1.74 0.18 -3.72 0.00 0.00 177.10 174.87 1qni n LEU 518 N 5.15 0.30 -4.74 3.21 4.77 0.12 -1.03 117.00 124.78 1qni n LEU 518 Ca -0.11 0.19 -0.37 0.00 -0.03 0.00 0.00 56.01 55.70 1qni n LEU 518 Cb 0.46 -0.33 0.05 0.00 -2.33 0.00 0.00 43.42 41.27 1qni n LEU 518 CO 0.42 0.07 0.88 -1.81 -1.33 0.00 0.00 177.39 175.62 1qni s ASP 519 N -2.85 4.94 0.00 -1.43 1.01 -1.26 -4.83 116.67 112.25 1qni s ASP 519 Ca 0.17 2.53 0.05 0.00 0.71 0.00 0.00 52.55 56.01 1qni s ASP 519 Cb 0.19 -2.61 -0.01 0.00 1.01 0.00 0.00 42.92 41.50 1qni s ASP 519 CO 0.57 -1.77 0.43 0.23 0.21 0.00 0.00 175.17 174.84 1qni n MET 520 N -1.66 2.77 -2.66 8.23 2.81 -1.26 -3.67 117.12 121.67 1qni n MET 520 Ca 0.14 -0.39 -0.42 0.00 -1.81 0.00 0.00 57.70 55.23 1qni n MET 520 Cb 0.48 -0.91 -0.03 0.00 -0.71 0.00 0.00 33.22 32.06 1qni n MET 520 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 1qni s VAL 521 N -1.00 4.74 0.50 2.03 1.01 -1.26 -4.99 120.40 121.43 1qni s VAL 521 Ca 0.04 1.97 -0.22 0.00 0.00 0.00 0.00 61.98 63.77 1qni s VAL 521 Cb 0.04 -4.26 -0.08 0.00 0.00 0.00 0.00 36.38 32.08 1qni s VAL 521 CO 0.14 0.13 1.04 -0.62 0.00 0.00 0.00 175.10 175.79 1qni n GLU 522 N 4.05 1.26 -0.56 2.72 1.02 -1.26 -2.00 120.64 125.87 1qni n GLU 522 Ca 0.07 0.46 0.00 0.00 -0.02 0.00 0.00 57.16 57.67 1qni n GLU 522 Cb 0.50 -2.17 0.00 0.00 -0.02 0.00 0.00 31.44 29.75 1qni n GLU 522 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1qni n ASP 523 N -0.13 0.00 -4.49 1.62 -0.08 -1.26 -4.92 116.55 107.29 1qni n ASP 523 Ca 0.11 0.00 -0.44 0.00 -1.51 0.00 0.00 54.79 52.95 1qni n ASP 523 Cb 0.43 -0.86 -0.01 0.00 2.34 0.00 0.00 41.12 43.02 1qni n ASP 523 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 1qni s VAL 524 N -2.63 4.71 0.05 5.18 1.01 -0.85 -4.97 120.40 122.90 1qni s VAL 524 Ca 0.00 -2.19 -0.05 0.00 0.00 0.00 0.00 61.98 59.75 1qni s VAL 524 Cb 0.00 -4.96 -0.05 0.00 0.00 0.00 0.00 36.38 31.37 1qni s VAL 524 CO 0.00 -1.71 0.28 -0.89 0.00 0.00 0.00 175.10 172.78 1qni s THR 525 N 2.56 5.29 0.35 3.92 2.01 -1.26 -3.97 115.64 124.55 1qni s THR 525 Ca 0.44 0.02 0.09 0.00 0.31 0.00 0.00 61.69 62.55 1qni s THR 525 Cb -0.01 -3.59 -0.06 0.00 0.01 0.00 0.00 72.50 68.84 1qni s THR 525 CO -0.00 0.25 -0.05 -1.00 -0.69 0.00 0.00 174.62 173.13 1qni s HIS 526 N -1.42 2.46 0.37 4.92 3.76 -0.03 -4.51 115.29 120.84 1qni s HIS 526 Ca 0.32 -0.51 0.06 0.00 -0.15 0.00 0.00 55.06 54.79 1qni s HIS 526 Cb -0.13 -1.48 -0.02 0.00 1.11 0.00 0.00 32.58 32.06 1qni s HIS 526 CO 0.20 0.53 0.24 0.20 -0.85 0.00 0.00 174.74 175.06 1qni s GLY 527 N -3.66 2.53 -0.20 -2.22 0.00 -1.26 -0.15 107.32 102.36 1qni s GLY 527 Ca 0.34 -1.72 -0.11 0.00 0.00 0.00 0.00 44.72 43.22 1qni s GLY 527 CO 0.18 -1.61 0.48 -0.12 0.00 0.00 0.00 173.10 172.02 1qni s PHE 528 N -3.31 -0.73 -0.08 1.90 5.36 -0.92 -4.27 117.98 115.94 1qni s PHE 528 Ca 0.34 1.51 -0.04 0.00 -0.96 0.00 0.00 56.93 57.77 1qni s PHE 528 Cb 0.02 0.36 0.03 0.00 -0.34 0.00 0.00 43.02 43.10 1qni s PHE 528 CO 0.24 -0.39 0.18 0.00 -1.46 0.00 0.00 175.22 173.78 1qni s MET 530 N 0.88 2.82 0.19 0.00 1.75 -1.14 -1.03 119.30 122.77 1qni s MET 530 Ca -0.07 -1.04 -0.32 0.00 -1.25 0.00 0.00 55.69 53.02 1qni s MET 530 Cb -0.08 -3.38 -0.16 0.00 2.84 0.00 0.00 34.83 34.05 1qni s MET 530 CO -0.05 -0.56 1.09 0.28 -0.65 0.00 0.00 175.02 175.13 1qni n VAL 531 N 4.82 1.13 -1.90 10.11 0.31 -0.67 -2.24 118.33 129.88 1qni n VAL 531 Ca -0.14 -0.28 -0.17 0.00 -0.01 0.00 0.00 64.34 63.74 1qni n VAL 531 Cb 0.46 -0.78 -0.04 0.00 -0.91 0.00 0.00 33.84 32.56 1qni n VAL 531 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1qni n ASN 532 N 1.86 -4.69 -0.05 4.52 4.13 -1.26 -4.80 115.26 114.96 1qni n ASN 532 Ca 0.14 0.27 0.02 0.00 1.68 0.00 0.00 54.58 56.69 1qni n ASN 532 Cb 0.25 -4.10 0.02 0.00 -1.54 0.00 0.00 39.78 34.42 1qni n ASN 532 CO 0.00 0.00 0.00 1.41 0.28 0.00 0.00 177.26 178.95 1qni n HIS 533 N -2.83 0.00 -3.99 3.10 8.25 -0.95 -4.98 115.22 113.82 1qni n HIS 533 Ca -0.18 -0.41 -0.29 0.00 -0.26 0.00 0.00 57.72 56.58 1qni n HIS 533 Cb 0.60 -0.05 -0.01 0.00 1.12 0.00 0.00 29.99 31.65 1qni n HIS 533 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1qni n GLY 534 N -0.48 -0.35 3.01 -1.41 0.00 -1.26 -4.94 105.19 99.78 1qni n GLY 534 Ca 0.03 0.15 -0.20 0.00 0.00 0.00 0.00 46.02 46.00 1qni n GLY 534 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1qni s VAL 535 N -3.61 0.78 -0.11 1.61 1.01 -1.26 -5.07 120.40 113.75 1qni s VAL 535 Ca 0.33 -0.38 -0.25 0.00 0.00 0.00 0.00 61.98 61.68 1qni s VAL 535 Cb -0.18 -0.68 0.06 0.00 0.00 0.00 0.00 36.38 35.59 1qni s VAL 535 CO 0.88 0.23 0.60 -0.55 0.00 0.00 0.00 175.10 176.26 1qni s SER 536 N 0.03 -0.58 0.06 3.32 0.15 -1.26 -2.88 113.70 112.54 1qni s SER 536 Ca -0.00 0.80 -0.26 0.00 0.70 0.00 0.00 55.95 57.19 1qni s SER 536 Cb -0.07 0.75 0.07 0.00 -1.71 0.00 0.00 66.02 65.06 1qni s SER 536 CO 0.00 -0.45 0.61 0.00 1.20 0.00 0.00 173.24 174.59 1qni s MET 537 N -0.71 1.14 -0.06 5.44 0.23 -0.75 -3.93 119.30 120.66 1qni s MET 537 Ca -0.08 -0.15 -0.10 0.00 -1.03 0.00 0.00 55.69 54.33 1qni s MET 537 Cb -0.02 0.53 -0.05 0.00 -1.53 0.00 0.00 34.83 33.76 1qni s MET 537 CO 0.06 -0.43 0.26 -2.00 -2.03 0.00 0.00 175.02 170.88 1qni s GLU 538 N -2.51 3.65 -0.33 3.16 2.12 -0.80 -2.15 118.70 121.83 1qni s GLU 538 Ca -0.05 0.10 -0.01 0.00 0.36 0.00 0.00 54.97 55.37 1qni s GLU 538 Cb -0.01 -3.19 0.12 0.00 0.26 0.00 0.00 34.13 31.31 1qni s GLU 538 CO -0.02 0.73 0.16 0.42 -0.54 0.00 0.00 175.26 176.01 1qni s ILE 539 N -1.08 0.38 0.88 -3.70 1.09 0.79 -4.78 121.20 114.78 1qni s ILE 539 Ca 0.20 -1.40 -0.13 0.00 -1.10 0.00 0.00 60.65 58.21 1qni s ILE 539 Cb -0.14 -1.30 0.15 0.00 -1.06 0.00 0.00 42.46 40.11 1qni s ILE 539 CO 0.09 -0.81 1.24 -0.44 -0.10 0.00 0.00 174.94 174.92 1qni s SER 540 N 1.48 3.76 -0.28 3.58 0.01 -1.26 -0.85 113.70 120.14 1qni s SER 540 Ca 0.13 0.44 -0.38 0.00 1.31 0.00 0.00 55.95 57.45 1qni s SER 540 Cb -0.19 -0.69 -0.14 0.00 0.21 0.00 0.00 66.02 65.20 1qni s SER 540 CO -0.19 -2.34 1.91 -2.65 0.41 0.00 0.00 173.24 170.38 1qni n PRO 541 N -3.52 1.26 -1.12 12.44 -0.02 -1.25 -1.44 135.00 141.34 1qni n PRO 541 Ca 0.12 0.43 -0.04 0.00 -2.02 0.00 0.00 63.50 61.99 1qni n PRO 541 Cb 0.60 -2.27 -0.02 0.00 -0.02 0.00 0.00 33.50 31.79 1qni n PRO 541 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1qni n GLN 542 N 6.47 -0.47 -4.05 -0.52 1.13 -0.20 -1.41 117.38 118.33 1qni n GLN 542 Ca 0.31 0.53 -0.24 0.00 -1.94 0.00 0.00 57.00 55.66 1qni n GLN 542 Cb 0.18 -4.18 -0.04 0.00 0.11 0.00 0.00 30.24 26.31 1qni n GLN 542 CO 0.00 0.00 0.00 -1.14 -1.44 0.00 0.00 177.06 174.48 1qni s GLN 543 N -1.89 3.11 0.00 -1.09 0.74 -0.52 -4.49 119.66 115.53 1qni s GLN 543 Ca 0.00 -0.87 0.05 0.00 0.05 0.00 0.00 55.36 54.60 1qni s GLN 543 Cb 0.00 -2.72 -0.02 0.00 1.10 0.00 0.00 33.01 31.37 1qni s GLN 543 CO 0.00 0.45 -0.17 0.99 -0.55 0.00 0.00 175.29 176.01 1qni s THR 544 N -1.93 1.34 0.03 -0.34 2.01 -1.26 -1.63 115.64 113.85 1qni s THR 544 Ca 0.33 -0.83 -0.14 0.00 0.31 0.00 0.00 61.69 61.36 1qni s THR 544 Cb -0.09 -1.13 0.02 0.00 0.01 0.00 0.00 72.50 71.30 1qni s THR 544 CO 0.26 0.29 0.30 0.00 -0.69 0.00 0.00 174.62 174.78 1qni s ALA 545 N -0.53 -0.70 0.14 7.40 0.00 -0.72 -4.72 121.76 122.64 1qni s ALA 545 Ca 0.06 0.08 0.01 0.00 0.00 0.00 0.00 51.96 52.11 1qni s ALA 545 Cb -0.07 0.26 -0.04 0.00 0.00 0.00 0.00 23.12 23.26 1qni s ALA 545 CO 0.00 -0.37 -0.01 -1.54 0.00 0.00 0.00 175.76 173.84 1qni s SER 546 N -1.88 1.02 -0.20 0.00 1.04 -1.26 -0.63 113.70 111.79 1qni s SER 546 Ca -0.07 -1.13 -0.16 0.00 0.48 0.00 0.00 55.95 55.07 1qni s SER 546 Cb -0.02 0.14 0.06 0.00 0.10 0.00 0.00 66.02 66.30 1qni s SER 546 CO -0.01 -0.57 0.53 0.54 0.98 0.00 0.00 173.24 174.71 1qni s VAL 547 N -3.72 -0.01 0.02 5.02 0.11 -0.90 -2.36 120.40 118.56 1qni s VAL 547 Ca 0.20 0.02 0.08 0.00 -2.93 0.00 0.00 61.98 59.35 1qni s VAL 547 Cb 0.06 -0.75 -0.03 0.00 -1.53 0.00 0.00 36.38 34.13 1qni s VAL 547 CO 0.01 0.01 -0.22 0.28 -3.33 0.00 0.00 175.10 171.84 1qni s THR 548 N 0.74 2.42 0.25 5.04 -1.32 -1.26 -0.83 115.64 120.69 1qni s THR 548 Ca -0.04 -1.18 -0.10 0.00 -1.21 0.00 0.00 61.69 59.16 1qni s THR 548 Cb -0.05 -1.94 -0.01 0.00 -1.51 0.00 0.00 72.50 68.99 1qni s THR 548 CO -0.05 0.44 0.42 0.72 -2.21 0.00 0.00 174.62 173.94 1qni s PHE 549 N -0.78 0.55 -0.26 9.09 -0.12 0.61 -4.97 117.98 122.10 1qni s PHE 549 Ca 0.12 -0.88 -0.12 0.00 -0.05 0.00 0.00 56.93 56.00 1qni s PHE 549 Cb -0.10 0.05 -0.05 0.00 -0.63 0.00 0.00 43.02 42.29 1qni s PHE 549 CO 0.02 -0.95 0.24 0.99 -0.05 0.00 0.00 175.22 175.47 1qni s THR 550 N -3.95 5.28 0.11 -4.49 2.01 -1.26 -0.02 115.64 113.33 1qni s THR 550 Ca 0.26 0.30 -0.33 0.00 0.31 0.00 0.00 61.69 62.23 1qni s THR 550 Cb 0.01 -3.57 -0.13 0.00 0.01 0.00 0.00 72.50 68.82 1qni s THR 550 CO 0.10 0.26 1.71 0.00 -0.69 0.00 0.00 174.62 176.00 1qni n ALA 551 N 4.86 1.61 -1.00 7.40 0.00 -0.46 -4.91 120.51 128.01 1qni n ALA 551 Ca -0.13 0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.69 1qni n ALA 551 Cb 0.52 -2.45 0.00 0.00 0.00 0.00 0.00 19.45 17.51 1qni n ALA 551 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1qni n GLY 552 N 3.85 -0.61 3.71 0.00 0.00 -1.26 -2.14 105.19 108.75 1qni n GLY 552 Ca 0.18 -1.43 -0.32 0.00 0.00 0.00 0.00 46.02 44.46 1qni n GLY 552 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1qni s LYS 553 N 0.00 1.63 0.55 1.61 -2.85 -1.26 -4.18 119.74 115.25 1qni s LYS 553 Ca 0.00 1.45 -0.21 0.00 -1.00 0.00 0.00 55.97 56.21 1qni s LYS 553 Cb 0.00 -1.80 -0.05 0.00 -2.06 0.00 0.00 37.83 33.92 1qni s LYS 553 CO 0.00 -2.16 1.35 -1.25 0.10 0.00 0.00 175.35 173.39 1qni s PRO 554 N -4.61 3.10 0.00 1.78 0.04 -1.26 -4.88 135.00 129.17 1qni s PRO 554 Ca 0.66 2.21 0.00 0.00 0.04 0.00 0.00 61.00 63.91 1qni s PRO 554 Cb -0.22 -2.22 0.00 0.00 0.04 0.00 0.00 34.50 32.10 1qni s PRO 554 CO 0.55 -1.21 0.00 0.41 0.04 0.00 0.00 177.00 176.78 1qni n GLY 555 N 0.73 0.58 3.85 0.56 0.00 0.30 -4.98 105.19 106.23 1qni n GLY 555 Ca 0.11 -1.81 -0.37 0.00 0.00 0.00 0.00 46.02 43.94 1qni n GLY 555 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1qni s VAL 556 N -1.95 5.09 -0.12 1.61 1.01 -1.26 -1.62 120.40 123.16 1qni s VAL 556 Ca 0.00 0.70 -0.03 0.00 0.00 0.00 0.00 61.98 62.65 1qni s VAL 556 Cb 0.00 -3.67 0.05 0.00 0.00 0.00 0.00 36.38 32.76 1qni s VAL 556 CO 0.00 0.53 0.06 -0.31 0.00 0.00 0.00 175.10 175.38 1qni s TYR 557 N -1.13 0.40 0.52 5.22 2.02 -0.77 -5.01 117.35 118.59 1qni s TYR 557 Ca 0.24 -0.24 -0.17 0.00 -0.37 0.00 0.00 57.07 56.53 1qni s TYR 557 Cb -0.16 -0.72 -0.08 0.00 -0.40 0.00 0.00 41.96 40.61 1qni s TYR 557 CO 0.13 -0.42 1.00 -1.58 -1.57 0.00 0.00 175.55 173.11 1qni s TRP 558 N 2.06 3.33 0.07 2.71 0.52 -1.26 -1.15 118.94 125.22 1qni s TRP 558 Ca 0.03 1.50 0.05 0.00 0.02 0.00 0.00 56.10 57.70 1qni s TRP 558 Cb -0.15 -2.85 -0.03 0.00 -1.15 0.00 0.00 33.47 29.29 1qni s TRP 558 CO -0.07 -0.50 -0.15 1.52 0.02 0.00 0.00 176.95 177.78 1qni s TYR 559 N -2.50 1.28 0.25 -1.98 -0.85 -0.59 -1.68 117.35 111.27 1qni s TYR 559 Ca 0.61 -0.44 -0.14 0.00 -0.52 0.00 0.00 57.07 56.58 1qni s TYR 559 Cb -0.11 -0.72 -0.00 0.00 0.38 0.00 0.00 41.96 41.50 1qni s TYR 559 CO 0.29 0.07 0.50 1.52 -1.52 0.00 0.00 175.55 176.42 1qni s TYR 560 N -1.20 0.28 -0.11 -3.49 1.13 -0.20 -1.50 117.35 112.26 1qni s TYR 560 Ca -0.01 -0.65 -0.21 0.00 -1.41 0.00 0.00 57.07 54.79 1qni s TYR 560 Cb -0.10 0.25 -0.04 0.00 -1.10 0.00 0.00 41.96 40.98 1qni s TYR 560 CO 0.02 -1.01 0.62 0.00 -2.51 0.00 0.00 175.55 172.67 1qni n ASN 562 N 4.06 3.60 -4.09 0.00 2.04 -1.26 -4.83 115.26 114.78 1qni n ASN 562 Ca -0.03 -2.21 -0.34 0.00 -0.44 0.00 0.00 54.58 51.56 1qni n ASN 562 Cb 0.51 -0.39 -0.13 0.00 -2.53 0.00 0.00 39.78 37.24 1qni n ASN 562 CO 0.00 0.00 0.00 0.86 -0.44 0.00 0.00 177.26 177.68 1qni s TRP 563 N -1.38 3.63 -0.37 -2.53 -0.11 -1.26 -4.91 118.94 112.01 1qni s TRP 563 Ca 0.36 -2.59 -0.37 0.00 1.22 0.00 0.00 56.10 54.72 1qni s TRP 563 Cb 0.21 -3.07 -0.13 0.00 -1.50 0.00 0.00 33.47 28.98 1qni s TRP 563 CO 0.20 -0.96 2.16 0.34 -4.62 0.00 0.00 176.95 174.07 1qni n PHE 564 N 4.48 1.55 0.00 5.86 -0.00 -1.26 -4.64 117.46 123.45 1qni n PHE 564 Ca -0.01 0.38 0.00 0.00 -0.00 0.00 0.00 57.45 57.82 1qni n PHE 564 Cb 0.42 -2.48 0.00 0.00 -0.00 0.00 0.00 39.48 37.41 1qni n PHE 564 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1qni s HIS 566 N -1.15 -0.35 0.48 0.00 5.65 -1.26 -4.97 115.29 113.70 1qni s HIS 566 Ca 0.00 0.01 0.26 0.00 0.25 0.00 0.00 55.06 55.58 1qni s HIS 566 Cb 0.00 0.64 1.50 0.00 -1.18 0.00 0.00 32.58 33.54 1qni s HIS 566 CO 0.00 -1.03 2.12 0.00 -0.65 0.00 0.00 174.74 175.18 1qni h ALA 567 N 2.00 1.46 -0.75 1.58 0.00 -2.00 -0.84 119.26 120.71 1qni h ALA 567 Ca -0.26 -0.08 -0.27 0.00 0.00 0.00 0.00 54.91 54.30 1qni h ALA 567 Cb 1.28 -0.01 -0.16 0.00 0.00 0.00 0.00 17.79 18.89 1qni h ALA 567 CO 0.30 0.11 0.34 1.28 0.00 0.00 0.00 179.25 181.28 1qni n LEU 568 N -3.85 6.01 -0.23 0.00 4.77 -1.26 -4.61 117.00 117.83 1qni n LEU 568 Ca -0.02 -3.15 0.01 0.00 -0.03 0.00 0.00 56.01 52.82 1qni n LEU 568 Cb 0.18 -0.75 0.13 0.00 -2.33 0.00 0.00 43.42 40.65 1qni n LEU 568 CO 0.30 0.83 1.04 -0.74 -1.33 0.00 0.00 177.39 177.49 1qni h HIS 569 N 2.15 0.55 -0.03 -1.77 2.76 -1.49 -1.61 115.15 115.70 1qni h HIS 569 Ca 0.33 0.03 0.01 0.00 -2.20 0.00 0.00 60.37 58.54 1qni h HIS 569 Cb 2.37 -0.14 -0.00 0.00 1.55 0.00 0.00 27.41 31.18 1qni h HIS 569 CO 1.28 0.17 0.03 0.52 -1.30 0.00 0.00 177.93 178.63 1qni h MET 570 N 0.52 0.00 -0.00 5.26 2.86 -1.84 -2.09 114.93 119.64 1qni h MET 570 Ca 0.34 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.98 1qni h MET 570 Cb 0.40 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.06 1qni h MET 570 CO -0.30 0.00 -0.45 0.39 1.06 0.00 0.00 176.91 177.61 1qni n GLU 571 N -4.30 0.13 -2.21 1.72 4.71 -0.63 -4.68 120.64 115.39 1qni n GLU 571 Ca -0.02 -0.08 -0.32 0.00 -0.01 0.00 0.00 57.16 56.73 1qni n GLU 571 Cb 0.12 -1.50 -0.04 0.00 -1.01 0.00 0.00 31.44 29.01 1qni n GLU 571 CO 0.00 0.00 0.00 1.41 0.09 0.00 0.00 177.13 178.63 1qni s MET 572 N -2.92 2.90 0.22 3.49 1.75 -0.79 -4.84 119.30 119.12 1qni s MET 572 Ca 0.13 -1.25 0.05 0.00 -1.25 0.00 0.00 55.69 53.37 1qni s MET 572 Cb 0.18 -5.30 -0.02 0.00 2.84 0.00 0.00 34.83 32.54 1qni s MET 572 CO 0.67 -3.42 0.16 1.33 -0.65 0.00 0.00 175.02 173.12 1qni n VAL 573 N 7.44 0.00 -3.84 10.11 0.24 -1.26 -2.31 118.33 128.72 1qni n VAL 573 Ca 0.45 -1.55 -0.03 0.00 -2.04 0.00 0.00 64.34 61.16 1qni n VAL 573 Cb 0.47 0.73 0.01 0.00 -1.47 0.00 0.00 33.84 33.58 1qni n VAL 573 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1qni s GLY 574 N -2.51 0.01 -0.02 7.63 0.00 -0.56 -4.77 107.32 107.09 1qni s GLY 574 Ca 0.23 -0.19 0.02 0.00 0.00 0.00 0.00 44.72 44.78 1qni s GLY 574 CO 0.16 1.59 -0.06 0.50 0.00 0.00 0.00 173.10 175.29 1qni s ARG 575 N -2.49 0.69 -0.18 2.90 0.52 -0.83 -1.55 118.95 118.02 1qni s ARG 575 Ca 0.19 -0.20 -0.04 0.00 -0.52 0.00 0.00 55.73 55.16 1qni s ARG 575 Cb -0.02 -0.68 -0.02 0.00 0.52 0.00 0.00 34.95 34.75 1qni s ARG 575 CO 0.04 0.06 -0.03 1.41 0.02 0.00 0.00 175.30 176.81 1qni s MET 576 N 0.26 3.61 -0.25 3.54 -2.45 -0.30 -2.47 119.30 121.24 1qni s MET 576 Ca -0.03 -0.54 -0.08 0.00 -1.25 0.00 0.00 55.69 53.79 1qni s MET 576 Cb -0.08 -2.98 -0.04 0.00 1.25 0.00 0.00 34.83 32.99 1qni s MET 576 CO -0.00 0.10 0.10 -0.51 1.05 0.00 0.00 175.02 175.76 1qni s LEU 577 N 0.73 3.65 -0.26 4.11 1.43 -0.52 -1.85 118.68 125.97 1qni s LEU 577 Ca -0.01 -0.11 -0.06 0.00 -1.03 0.00 0.00 54.13 52.92 1qni s LEU 577 Cb -0.14 -1.98 -0.00 0.00 0.03 0.00 0.00 46.19 44.09 1qni s LEU 577 CO 0.02 -0.01 0.04 -0.69 0.23 0.00 0.00 176.35 175.95 1qni s VAL 578 N 1.47 3.88 0.13 -1.59 1.01 -0.64 -1.86 120.40 122.80 1qni s VAL 578 Ca 0.06 -0.52 0.04 0.00 0.00 0.00 0.00 61.98 61.56 1qni s VAL 578 Cb -0.15 -2.90 -0.04 0.00 0.00 0.00 0.00 36.38 33.29 1qni s VAL 578 CO 0.05 0.23 0.14 -1.83 0.00 0.00 0.00 175.10 173.69 1qni s GLU 579 N 1.52 2.97 0.24 2.72 -1.05 -0.80 -0.54 118.70 123.76 1qni s GLU 579 Ca 0.04 -0.77 -0.31 0.00 -0.15 0.00 0.00 54.97 53.77 1qni s GLU 579 Cb -0.16 -2.72 -0.13 0.00 -0.44 0.00 0.00 34.13 30.68 1qni s GLU 579 CO 0.01 0.52 1.50 0.00 0.95 0.00 0.00 175.26 178.24 1qni n ALA 580 N -0.12 1.64 0.95 -0.84 0.00 -1.26 -1.43 120.51 119.44 1qni n ALA 580 Ca -0.08 0.41 0.08 0.00 0.00 0.00 0.00 53.44 53.84 1qni n ALA 580 Cb 0.54 -2.35 0.45 0.00 0.00 0.00 0.00 19.45 18.08 1qni n ALA 580 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50