#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 2.47 -0.27 0.00 3.76 -1.26 -4.53 115.29 115.45 1qni s HIS 11 Ca 0.00 -0.57 -0.00 0.00 -0.15 0.00 0.00 55.06 54.34 1qni s HIS 11 Cb 0.00 -1.59 0.05 0.00 1.11 0.00 0.00 32.58 32.15 1qni s HIS 11 CO 0.00 -0.11 -0.05 0.08 -0.85 0.00 0.00 174.74 173.80 1qni s VAL 12 N -0.33 2.68 0.55 -0.90 1.01 -1.26 -5.02 120.40 117.14 1qni s VAL 12 Ca 0.02 -1.39 -0.08 0.00 0.00 0.00 0.00 61.98 60.53 1qni s VAL 12 Cb -0.12 -2.51 -0.04 0.00 0.00 0.00 0.00 36.38 33.71 1qni s VAL 12 CO 0.02 -0.01 0.91 0.00 0.00 0.00 0.00 175.10 176.02 1qni s ALA 13 N 1.22 3.25 -0.01 5.51 0.00 -1.26 -4.93 121.76 125.53 1qni s ALA 13 Ca -0.05 -0.29 -0.36 0.00 0.00 0.00 0.00 51.96 51.26 1qni s ALA 13 Cb -0.19 -2.84 -0.14 0.00 0.00 0.00 0.00 23.12 19.95 1qni s ALA 13 CO -0.03 -0.53 1.65 -2.30 0.00 0.00 0.00 175.76 174.55 1qni n PRO 14 N -2.51 1.75 0.00 0.00 -0.02 -1.26 -0.62 135.00 132.34 1qni n PRO 14 Ca 0.03 0.64 0.00 0.00 -2.02 0.00 0.00 63.50 62.15 1qni n PRO 14 Cb 0.55 -2.39 0.00 0.00 -0.02 0.00 0.00 33.50 31.64 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 3.67 3.02 3.90 -1.23 0.00 -1.26 -5.06 105.19 108.23 1qni n GLY 15 Ca 0.21 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.93 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 -0.59 3.67 0.25 1.61 2.02 0.21 -5.11 118.70 120.76 1qni s GLU 16 Ca 0.00 0.05 0.08 0.00 0.02 0.00 0.00 54.97 55.12 1qni s GLU 16 Cb 0.00 -2.69 -0.04 0.00 0.10 0.00 0.00 34.13 31.50 1qni s GLU 16 CO 0.00 0.29 0.08 -0.51 0.02 0.00 0.00 175.26 175.14 1qni s LEU 17 N -3.19 3.46 0.84 1.80 1.43 -1.26 -4.77 118.68 116.99 1qni s LEU 17 Ca 0.44 -0.45 -0.12 0.00 -1.03 0.00 0.00 54.13 52.97 1qni s LEU 17 Cb -0.11 -2.00 0.10 0.00 0.03 0.00 0.00 46.19 44.20 1qni s LEU 17 CO 0.27 -0.00 1.15 -1.81 0.23 0.00 0.00 176.35 176.18 1qni s ASP 18 N -3.63 4.19 -0.14 2.29 1.11 -1.26 -5.01 116.67 114.22 1qni s ASP 18 Ca 0.31 0.94 0.15 0.00 0.18 0.00 0.00 52.55 54.14 1qni s ASP 18 Cb -0.07 -1.52 -0.22 0.00 1.07 0.00 0.00 42.92 42.18 1qni s ASP 18 CO 0.22 -2.12 0.12 -0.62 1.18 0.00 0.00 175.17 173.95 1qni n GLU 19 N -3.48 1.15 -4.46 8.23 1.02 -0.26 -4.89 120.64 117.95 1qni n GLU 19 Ca 0.07 -0.04 -0.25 0.00 -0.02 0.00 0.00 57.16 56.93 1qni n GLU 19 Cb 0.59 -1.43 -0.13 0.00 -0.02 0.00 0.00 31.44 30.45 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 -2.55 1.83 -0.10 -0.32 1.51 -1.04 -0.51 117.35 116.18 1qni s TYR 20 Ca -0.08 -0.40 -0.15 0.00 -1.01 0.00 0.00 57.07 55.43 1qni s TYR 20 Cb 0.06 -1.04 -0.05 0.00 -0.11 0.00 0.00 41.96 40.82 1qni s TYR 20 CO 0.69 0.16 0.38 0.71 -1.11 0.00 0.00 175.55 176.39 1qni s TYR 21 N -0.99 3.56 -0.19 2.71 2.02 0.15 -1.01 117.35 123.61 1qni s TYR 21 Ca 0.07 0.81 -0.01 0.00 -0.37 0.00 0.00 57.07 57.57 1qni s TYR 21 Cb -0.09 -2.39 0.01 0.00 -0.40 0.00 0.00 41.96 39.09 1qni s TYR 21 CO 0.03 0.35 -0.15 0.20 -1.57 0.00 0.00 175.55 174.41 1qni s GLY 22 N 0.04 1.46 -0.56 0.71 0.00 0.12 -1.40 107.32 107.69 1qni s GLY 22 Ca 0.22 -1.19 -0.12 0.00 0.00 0.00 0.00 44.72 43.63 1qni s GLY 22 CO 0.09 0.31 0.47 -1.36 0.00 0.00 0.00 173.10 172.61 1qni s PHE 23 N 1.32 3.43 0.03 1.90 0.08 -0.66 0.11 117.98 124.19 1qni s PHE 23 Ca 0.05 -1.79 -0.26 0.00 0.12 0.00 0.00 56.93 55.05 1qni s PHE 23 Cb -0.14 -3.62 -0.05 0.00 -0.57 0.00 0.00 43.02 38.64 1qni s PHE 23 CO -0.09 -0.99 0.80 -1.58 -0.10 0.00 0.00 175.22 173.25 1qni s TRP 24 N 1.12 3.71 0.73 0.36 0.23 0.48 -2.65 118.94 122.92 1qni s TRP 24 Ca 0.08 1.49 -0.11 0.00 -2.03 0.00 0.00 56.10 55.53 1qni s TRP 24 Cb -0.24 -2.87 0.03 0.00 0.03 0.00 0.00 33.47 30.42 1qni s TRP 24 CO -0.01 0.21 1.08 -1.54 0.96 0.00 0.00 176.95 177.65 1qni s SER 25 N 0.19 4.96 0.00 2.95 1.04 -1.09 0.06 113.70 121.80 1qni s SER 25 Ca 0.40 1.75 0.09 0.00 0.48 0.00 0.00 55.95 58.68 1qni s SER 25 Cb -0.20 -2.51 0.08 0.00 0.10 0.00 0.00 66.02 63.48 1qni s SER 25 CO 0.23 -1.73 0.80 0.61 0.98 0.00 0.00 173.24 174.13 1qni n GLY 26 N -1.48 -0.50 7.00 7.32 0.00 -0.61 -4.35 105.19 112.57 1qni n GLY 26 Ca 0.08 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.83 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 0.53 2.69 0.01 -0.02 0.00 0.82 -1.64 105.19 107.58 1qni n GLY 27 Ca 0.06 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.73 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 13.57 0.00 0.11 1.61 1.44 -1.26 -0.34 115.22 130.35 1qni n HIS 28 Ca 0.00 0.00 0.02 0.00 -2.01 0.00 0.00 57.72 55.73 1qni n HIS 28 Cb 0.00 -0.00 -0.01 0.00 0.12 0.00 0.00 29.99 30.10 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 -1.44 -3.41 115.11 108.86 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 0.01 0.00 0.00 0.00 0.00 0.00 0.00 27.48 27.49 1qni h GLN 29 CO 0.00 0.43 0.00 0.41 0.00 0.00 0.00 178.83 179.67 1qni n GLY 30 N 1.28 2.91 3.60 2.39 0.00 -1.03 -4.55 105.19 109.78 1qni n GLY 30 Ca -0.02 -0.05 -0.21 0.00 0.00 0.00 0.00 46.02 45.75 1qni n GLY 30 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1qni n GLU 31 N 0.00 0.10 -4.94 1.61 0.28 -1.26 -2.30 120.64 114.12 1qni n GLU 31 Ca 0.00 -2.60 -0.29 0.00 -0.16 0.00 0.00 57.16 54.11 1qni n GLU 31 Cb 0.00 -0.53 -0.17 0.00 1.43 0.00 0.00 31.44 32.17 1qni n GLU 31 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 177.13 177.05 1qni s VAL 32 N -2.73 1.64 -0.12 3.84 1.01 -0.52 -1.57 120.40 121.96 1qni s VAL 32 Ca 0.60 -0.78 -0.03 0.00 0.00 0.00 0.00 61.98 61.78 1qni s VAL 32 Cb -0.04 -1.44 -0.03 0.00 0.00 0.00 0.00 36.38 34.87 1qni s VAL 32 CO 0.40 0.47 -0.02 -0.13 0.00 0.00 0.00 175.10 175.82 1qni s ARG 33 N 0.47 3.27 -0.42 2.72 0.52 0.11 0.02 118.95 125.65 1qni s ARG 33 Ca -0.17 -0.46 -0.11 0.00 -0.52 0.00 0.00 55.73 54.47 1qni s ARG 33 Cb -0.17 -2.84 0.06 0.00 0.52 0.00 0.00 34.95 32.52 1qni s ARG 33 CO 0.07 0.50 0.28 0.08 0.02 0.00 0.00 175.30 176.24 1qni s VAL 34 N -0.33 4.61 0.21 3.52 1.01 0.10 0.18 120.40 129.71 1qni s VAL 34 Ca 0.06 -1.13 0.05 0.00 0.00 0.00 0.00 61.98 60.97 1qni s VAL 34 Cb -0.12 -3.72 -0.03 0.00 0.00 0.00 0.00 36.38 32.50 1qni s VAL 34 CO 0.02 -0.44 0.24 -0.76 0.00 0.00 0.00 175.10 174.17 1qni s LEU 35 N 1.53 4.03 -0.19 3.92 1.43 0.30 0.47 118.68 130.17 1qni s LEU 35 Ca 0.03 -0.07 -0.09 0.00 -1.03 0.00 0.00 54.13 52.97 1qni s LEU 35 Cb -0.22 -2.59 -0.05 0.00 0.03 0.00 0.00 46.19 43.37 1qni s LEU 35 CO 0.05 -0.01 0.11 -0.83 0.23 0.00 0.00 176.35 175.90 1qni s GLY 36 N -3.61 2.01 -0.04 -3.19 0.00 0.14 0.14 107.32 102.76 1qni s GLY 36 Ca 0.33 -0.70 0.01 0.00 0.00 0.00 0.00 44.72 44.36 1qni s GLY 36 CO 0.26 0.08 -0.04 0.14 0.00 0.00 0.00 173.10 173.54 1qni s VAL 37 N 0.26 3.89 -2.05 1.40 1.01 -0.18 0.17 120.40 124.91 1qni s VAL 37 Ca 0.07 -0.52 0.15 0.00 0.00 0.00 0.00 61.98 61.68 1qni s VAL 37 Cb -0.11 -2.65 0.40 0.00 0.00 0.00 0.00 36.38 34.02 1qni s VAL 37 CO -0.01 0.51 1.36 -0.81 0.00 0.00 0.00 175.10 176.15 1qni n PRO 38 N 1.90 2.00 0.16 2.72 -0.04 -1.26 -1.10 135.00 139.38 1qni n PRO 38 Ca -0.17 -1.55 0.04 0.00 -0.04 0.00 0.00 63.50 61.78 1qni n PRO 38 Cb 0.53 -1.36 0.47 0.00 -0.04 0.00 0.00 33.50 33.10 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 2.61 0.15 -0.78 3.54 4.64 -1.75 -3.46 113.55 118.50 1qni h SER 39 Ca 0.00 -0.02 -0.28 0.00 -0.47 0.00 0.00 61.79 61.02 1qni h SER 39 Cb 0.59 -0.04 -0.10 0.00 -0.31 0.00 0.00 62.40 62.54 1qni h SER 39 CO 0.00 0.25 -0.27 0.23 -0.87 0.00 0.00 176.83 176.18 1qni n MET 40 N -4.36 -0.98 -3.24 4.77 2.81 0.46 -4.99 117.12 111.60 1qni n MET 40 Ca -0.01 0.96 -0.33 0.00 -1.81 0.00 0.00 57.70 56.51 1qni n MET 40 Cb 0.20 -5.06 -0.06 0.00 -0.71 0.00 0.00 33.22 27.59 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 -3.31 3.98 -0.31 0.03 0.52 -1.16 -4.81 118.95 113.89 1qni s ARG 41 Ca 0.00 0.56 -0.25 0.00 -0.52 0.00 0.00 55.73 55.52 1qni s ARG 41 Cb 0.00 -2.62 0.01 0.00 0.52 0.00 0.00 34.95 32.86 1qni s ARG 41 CO 0.00 0.28 0.88 -2.00 0.02 0.00 0.00 175.30 174.47 1qni s GLU 42 N -2.66 4.01 -0.14 3.54 2.12 -1.26 -0.68 118.70 123.62 1qni s GLU 42 Ca 0.49 0.76 0.07 0.00 0.36 0.00 0.00 54.97 56.64 1qni s GLU 42 Cb -0.12 -3.73 -0.23 0.00 0.26 0.00 0.00 34.13 30.31 1qni s GLU 42 CO 0.19 -0.74 0.28 1.28 -0.54 0.00 0.00 175.26 175.74 1qni n LEU 43 N 6.39 1.55 -3.51 2.70 4.77 0.18 -4.96 117.00 124.11 1qni n LEU 43 Ca 0.06 0.16 -0.16 0.00 -0.03 0.00 0.00 56.01 56.05 1qni n LEU 43 Cb 0.48 -0.31 -0.05 0.00 -2.33 0.00 0.00 43.42 41.21 1qni n LEU 43 CO 0.53 0.64 0.47 -0.32 -1.33 0.00 0.00 177.39 177.38 1qni s MET 44 N -2.55 1.04 -0.14 3.23 0.00 -0.94 -5.00 119.30 114.94 1qni s MET 44 Ca -0.16 0.13 0.00 0.00 0.00 0.00 0.00 55.69 55.66 1qni s MET 44 Cb 0.07 0.49 -0.01 0.00 0.00 0.00 0.00 34.83 35.38 1qni s MET 44 CO 0.77 -0.35 -0.15 1.03 0.00 0.00 0.00 175.02 176.32 1qni s ARG 45 N -1.60 3.29 -0.39 4.11 0.52 -1.26 0.01 118.95 123.62 1qni s ARG 45 Ca -0.08 -0.73 -0.08 0.00 -0.52 0.00 0.00 55.73 54.32 1qni s ARG 45 Cb -0.00 -2.61 0.07 0.00 0.52 0.00 0.00 34.95 32.92 1qni s ARG 45 CO 0.05 0.12 0.21 0.42 0.02 0.00 0.00 175.30 176.12 1qni s ILE 46 N 0.58 4.08 0.50 1.52 1.01 0.10 -4.97 121.20 124.02 1qni s ILE 46 Ca -0.09 -1.34 -0.23 0.00 0.00 0.00 0.00 60.65 59.00 1qni s ILE 46 Cb -0.16 -3.45 -0.06 0.00 0.01 0.00 0.00 42.46 38.80 1qni s ILE 46 CO 0.03 -0.42 1.31 -2.16 0.00 0.00 0.00 174.94 173.71 1qni s PRO 47 N 1.41 3.42 0.00 2.79 0.04 -1.26 -1.44 135.00 139.96 1qni s PRO 47 Ca 0.02 2.13 0.00 0.00 0.04 0.00 0.00 61.00 63.19 1qni s PRO 47 Cb -0.22 -2.37 0.00 0.00 0.04 0.00 0.00 34.50 31.95 1qni s PRO 47 CO 0.02 -0.94 0.00 0.28 0.04 0.00 0.00 177.00 176.40 1qni n VAL 48 N -0.72 0.00 0.70 -0.36 0.31 -1.25 -4.26 118.33 112.75 1qni n VAL 48 Ca 0.09 0.00 0.08 0.00 -0.01 0.00 0.00 64.34 64.49 1qni n VAL 48 Cb 0.45 -0.06 0.00 0.00 -0.91 0.00 0.00 33.84 33.33 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 -1.95 0.00 -2.81 3.52 3.72 -0.97 -4.97 117.46 114.00 1qni n PHE 49 Ca 0.00 0.00 -0.21 0.00 -0.05 0.00 0.00 57.45 57.19 1qni n PHE 49 Cb 0.00 0.00 0.06 0.00 -0.94 0.00 0.00 39.48 38.60 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 -1.82 5.02 -0.32 4.37 2.20 -1.25 -3.61 114.94 119.53 1qni s ASN 50 Ca 0.14 -0.43 -0.02 0.00 -0.94 0.00 0.00 52.86 51.60 1qni s ASN 50 Cb 0.13 -0.24 0.06 0.00 -2.00 0.00 0.00 41.25 39.19 1qni s ASN 50 CO 0.38 -1.34 0.03 -0.69 -2.94 0.00 0.00 177.10 172.54 1qni s VAL 51 N -2.77 3.09 -0.33 3.54 1.01 -1.26 -4.75 120.40 118.93 1qni s VAL 51 Ca 0.61 -1.44 -0.26 0.00 0.00 0.00 0.00 61.98 60.88 1qni s VAL 51 Cb -0.07 -2.82 0.01 0.00 0.00 0.00 0.00 36.38 33.50 1qni s VAL 51 CO 0.39 -0.18 0.95 -0.62 0.00 0.00 0.00 175.10 175.64 1qni s ASP 52 N 1.32 6.78 0.52 3.32 2.15 -0.77 -4.91 116.67 125.09 1qni s ASP 52 Ca -0.03 0.80 0.34 0.00 0.43 0.00 0.00 52.55 54.08 1qni s ASP 52 Cb -0.20 -2.48 1.52 0.00 -0.30 0.00 0.00 42.92 41.46 1qni s ASP 52 CO -0.01 -0.80 2.01 -1.28 -0.17 0.00 0.00 175.17 174.91 1qni h SER 53 N 8.22 0.00 0.00 -0.34 0.87 -1.95 -0.79 113.55 119.56 1qni h SER 53 Ca -0.22 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.34 1qni h SER 53 Cb 1.08 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.04 1qni h SER 53 CO 0.98 0.00 0.00 0.00 -0.53 0.00 0.00 176.83 177.28 1qni n ALA 54 N -2.02 0.00 0.30 6.23 0.00 -1.26 -4.32 120.51 119.44 1qni n ALA 54 Ca -0.00 -0.03 0.17 0.00 0.00 0.00 0.00 53.44 53.58 1qni n ALA 54 Cb 0.23 0.00 0.75 0.00 0.00 0.00 0.00 19.45 20.42 1qni n ALA 54 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1qni h THR 55 N 0.00 0.00 0.00 0.00 1.35 -1.91 -3.35 112.91 109.00 1qni h THR 55 Ca 0.00 -0.38 0.00 0.00 -0.55 0.00 0.00 66.41 65.48 1qni h THR 55 Cb 0.00 1.33 0.00 0.00 -1.73 0.00 0.00 68.15 67.75 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 -0.19 0.57 3.63 5.82 0.00 -0.32 -1.41 105.19 113.28 1qni n GLY 56 Ca 0.00 -0.63 -0.43 0.00 0.00 0.00 0.00 46.02 44.96 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 1.73 0.00 1.61 -0.11 -1.11 -0.02 118.94 119.04 1qni s TRP 57 Ca 0.00 0.34 0.00 0.00 1.22 0.00 0.00 56.10 57.66 1qni s TRP 57 Cb 0.00 -4.03 0.00 0.00 -1.50 0.00 0.00 33.47 27.94 1qni s TRP 57 CO 0.00 -3.71 0.00 0.41 -4.62 0.00 0.00 176.95 169.03 1qni n GLY 58 N 4.90 0.70 0.34 5.86 0.00 -1.26 -1.84 105.19 113.88 1qni n GLY 58 Ca 0.21 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.13 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 -1.07 0.66 -0.65 -0.61 5.41 0.97 -4.83 119.36 119.24 1qni n ILE 59 Ca 0.00 -0.21 -0.30 0.00 1.00 0.00 0.00 62.75 63.25 1qni n ILE 59 Cb 0.00 -1.28 0.21 0.00 -0.71 0.00 0.00 39.64 37.86 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 -2.22 2.09 0.14 1.39 -4.23 -0.30 -4.68 115.64 107.83 1qni s THR 60 Ca -0.16 0.03 0.10 0.00 -1.18 0.00 0.00 61.69 60.48 1qni s THR 60 Cb 0.05 -2.09 -0.08 0.00 1.34 0.00 0.00 72.50 71.72 1qni s THR 60 CO 0.24 -0.04 1.46 0.78 -0.54 0.00 0.00 174.62 176.52 1qni h ASN 61 N -2.24 0.00 0.24 3.99 -0.26 -1.61 -2.86 115.58 112.85 1qni h ASN 61 Ca -0.53 0.00 -0.01 0.00 -0.56 0.00 0.00 56.30 55.20 1qni h ASN 61 Cb 1.30 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.56 1qni h ASN 61 CO 0.47 0.75 -0.12 -0.33 -1.06 0.00 0.00 177.43 177.14 1qni h GLU 62 N 0.00 -0.31 -0.74 0.81 3.07 -1.92 -1.88 114.58 113.61 1qni h GLU 62 Ca -0.01 0.02 -0.01 0.00 -0.50 0.00 0.00 59.36 58.87 1qni h GLU 62 Cb 1.41 0.07 -0.04 0.00 -0.84 0.00 0.00 28.75 29.35 1qni h GLU 62 CO 0.10 0.02 0.44 0.66 -1.40 0.00 0.00 179.01 178.83 1qni h SER 63 N -0.69 0.88 -0.05 1.42 4.64 -1.91 -2.28 113.55 115.55 1qni h SER 63 Ca -0.03 -0.05 -0.12 0.00 -0.47 0.00 0.00 61.79 61.12 1qni h SER 63 Cb 0.48 -0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 62.33 1qni h SER 63 CO 0.05 0.68 -0.34 0.11 -0.87 0.00 0.00 176.83 176.47 1qni h LYS 64 N 1.02 0.54 -0.13 4.77 1.57 -1.51 0.16 116.57 122.99 1qni h LYS 64 Ca 0.26 -0.24 -0.06 0.00 -1.87 0.00 0.00 60.65 58.74 1qni h LYS 64 Cb -0.03 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.26 1qni h LYS 64 CO -0.05 0.81 -0.18 1.49 -0.57 0.00 0.00 179.45 180.94 1qni h GLU 65 N 0.46 0.21 0.13 3.15 4.81 -0.80 0.96 114.58 123.51 1qni h GLU 65 Ca 0.05 -0.06 -0.25 0.00 -0.13 0.00 0.00 59.36 58.98 1qni h GLU 65 Cb 0.81 -0.03 0.03 0.00 0.63 0.00 0.00 28.75 30.19 1qni h GLU 65 CO 0.07 0.40 -1.05 0.82 -0.73 0.00 0.00 179.01 178.51 1qni h ILE 66 N 0.20 1.38 -0.80 2.32 2.04 -0.91 -3.28 117.51 118.45 1qni h ILE 66 Ca 0.04 -2.47 -0.02 0.00 1.00 0.00 0.00 64.86 63.41 1qni h ILE 66 Cb 0.45 2.91 -0.04 0.00 -0.74 0.00 0.00 36.82 39.39 1qni h ILE 66 CO 0.03 0.73 0.42 -0.07 0.00 0.00 0.00 178.15 179.25 1qni h LEU 67 N -0.01 1.02 0.00 1.44 3.38 -0.46 -3.33 115.31 117.34 1qni h LEU 67 Ca -0.17 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.69 1qni h LEU 67 Cb 1.78 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 42.27 1qni h LEU 67 CO 0.20 0.84 0.00 0.61 0.09 0.00 0.00 178.44 180.18 1qni n GLY 68 N -1.06 2.32 0.81 0.83 0.00 0.31 -4.93 105.19 103.48 1qni n GLY 68 Ca 0.08 -0.34 0.10 0.00 0.00 0.00 0.00 46.02 45.85 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 -2.79 2.07 -0.02 0.00 -1.26 -4.54 105.19 98.65 1qni n GLY 69 Ca 0.00 -1.24 -0.09 0.00 0.00 0.00 0.00 46.02 44.69 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 -3.40 4.71 -3.59 1.61 5.68 -1.26 -4.90 116.55 115.40 1qni n ASP 70 Ca -0.04 -3.28 -0.16 0.00 -0.50 0.00 0.00 54.79 50.81 1qni n ASP 70 Cb 0.38 -0.77 -0.07 0.00 -1.14 0.00 0.00 41.12 39.53 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 -3.03 0.93 -0.09 0.11 0.74 -1.26 -5.15 119.66 111.91 1qni s GLN 71 Ca 0.56 0.40 -0.20 0.00 0.05 0.00 0.00 55.36 56.17 1qni s GLN 71 Cb 0.45 0.44 -0.04 0.00 1.10 0.00 0.00 33.01 34.96 1qni s GLN 71 CO 0.13 -0.24 0.55 -1.14 -0.55 0.00 0.00 175.29 174.04 1qni s GLN 72 N -0.75 4.35 -0.20 1.67 0.74 -1.26 -5.01 119.66 119.20 1qni s GLN 72 Ca -0.08 0.60 -0.01 0.00 0.05 0.00 0.00 55.36 55.92 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 0.07 0.17 -0.12 0.71 -0.55 0.00 0.00 175.29 175.56 1qni s TYR 73 N 0.53 2.89 -2.21 1.67 2.02 -1.26 -4.97 117.35 116.02 1qni s TYR 73 Ca 0.30 -1.40 0.19 0.00 -0.37 0.00 0.00 57.07 55.78 1qni s TYR 73 Cb -0.16 -2.00 0.74 0.00 -0.40 0.00 0.00 41.96 40.13 1qni s TYR 73 CO 0.13 -0.71 1.53 1.28 -1.57 0.00 0.00 175.55 176.21 1qni n LEU 74 N 4.68 1.44 -4.20 -1.29 4.77 -1.26 -4.90 117.00 116.25 1qni n LEU 74 Ca -0.19 -0.62 -0.12 0.00 -0.03 0.00 0.00 56.01 55.05 1qni n LEU 74 Cb 0.50 -0.10 -0.10 0.00 -2.33 0.00 0.00 43.42 41.38 1qni n LEU 74 CO 0.27 0.31 -0.26 0.54 -1.33 0.00 0.00 177.39 176.91 1qni s ASN 75 N -1.50 0.36 0.22 -1.43 6.03 -1.24 -4.35 114.94 113.03 1qni s ASN 75 Ca 0.30 -1.32 -0.22 0.00 -1.03 0.00 0.00 52.86 50.59 1qni s ASN 75 Cb 0.16 0.32 0.04 0.00 -3.03 0.00 0.00 41.25 38.74 1qni s ASN 75 CO 0.24 -0.78 0.74 -0.83 -2.03 0.00 0.00 177.10 174.45 1qni s GLY 76 N -3.14 -0.24 -0.39 0.45 0.00 -1.24 -4.75 107.32 98.01 1qni s GLY 76 Ca 0.33 -0.00 0.03 0.00 0.00 0.00 0.00 44.72 45.08 1qni s GLY 76 CO 0.08 0.00 0.38 -0.35 0.00 0.00 0.00 173.10 173.21 1qni s ASP 77 N -2.86 1.21 -0.22 1.64 2.15 -1.24 -3.71 116.67 113.63 1qni s ASP 77 Ca 0.09 -1.86 -0.11 0.00 0.43 0.00 0.00 52.55 51.10 1qni s ASP 77 Cb -0.04 0.42 -0.05 0.00 -0.30 0.00 0.00 42.92 42.95 1qni s ASP 77 CO 0.01 -0.24 0.17 0.00 -0.17 0.00 0.00 175.17 174.95 1qni n HIS 79 N 3.92 0.00 -4.00 0.00 8.25 -1.26 -0.13 115.22 122.01 1qni n HIS 79 Ca -0.15 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 57.00 1qni n HIS 79 Cb 0.52 -0.39 -0.15 0.00 1.12 0.00 0.00 29.99 31.09 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 -2.20 3.58 -0.05 4.41 3.76 -1.26 -1.83 115.29 121.70 1qni s HIS 80 Ca -0.12 -2.88 -0.18 0.00 -0.15 0.00 0.00 55.06 51.73 1qni s HIS 80 Cb 0.03 -2.79 -0.05 0.00 1.11 0.00 0.00 32.58 30.88 1qni s HIS 80 CO 0.25 -0.94 0.51 -1.25 -0.85 0.00 0.00 174.74 172.46 1qni s PRO 81 N 0.97 4.25 -0.01 8.40 0.04 -1.26 -4.03 135.00 143.35 1qni s PRO 81 Ca 0.10 0.55 -0.01 0.00 0.04 0.00 0.00 61.00 61.68 1qni s PRO 81 Cb -0.19 -3.36 0.00 0.00 0.04 0.00 0.00 34.50 31.00 1qni s PRO 81 CO -0.09 0.35 0.04 -1.01 0.04 0.00 0.00 177.00 176.32 1qni s HIS 82 N -0.03 -0.04 -0.07 0.56 3.76 -0.55 -4.53 115.29 114.39 1qni s HIS 82 Ca 0.27 0.10 -0.12 0.00 -0.15 0.00 0.00 55.06 55.17 1qni s HIS 82 Cb -0.17 0.01 -0.05 0.00 1.11 0.00 0.00 32.58 33.49 1qni s HIS 82 CO 0.14 -0.02 0.30 -1.50 -0.85 0.00 0.00 174.74 172.80 1qni s ILE 83 N 0.02 5.24 0.81 0.60 2.07 -1.26 -0.60 121.20 128.08 1qni s ILE 83 Ca -0.00 0.58 -0.14 0.00 -1.41 0.00 0.00 60.65 59.68 1qni s ILE 83 Cb -0.00 -3.60 0.04 0.00 0.13 0.00 0.00 42.46 39.04 1qni s ILE 83 CO 0.00 0.55 0.90 -1.54 -1.91 0.00 0.00 174.94 172.94 1qni n SER 84 N 2.23 -0.04 -4.04 4.50 3.41 -0.49 -4.86 113.62 114.32 1qni n SER 84 Ca -0.15 0.55 -0.09 0.00 -0.26 0.00 0.00 58.87 58.91 1qni n SER 84 Cb 0.53 -1.39 -0.11 0.00 -0.26 0.00 0.00 64.21 62.99 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 -3.68 0.49 -0.24 4.33 1.00 -1.26 -1.95 119.30 117.99 1qni s MET 85 Ca 0.69 -0.91 0.01 0.00 0.00 0.00 0.00 55.69 55.48 1qni s MET 85 Cb -0.29 0.08 0.06 0.00 0.00 0.00 0.00 34.83 34.67 1qni s MET 85 CO 0.55 -0.06 -0.06 0.99 0.00 0.00 0.00 175.02 176.45 1qni s THR 86 N -2.52 1.59 -0.91 2.05 2.01 0.24 -0.24 115.64 117.86 1qni s THR 86 Ca -0.05 -1.27 -0.06 0.00 0.31 0.00 0.00 61.69 60.61 1qni s THR 86 Cb -0.02 -1.85 -0.02 0.00 0.01 0.00 0.00 72.50 70.62 1qni s THR 86 CO -0.04 -0.11 0.75 -0.67 -0.69 0.00 0.00 174.62 173.86 1qni n ASP 87 N 4.65 -6.48 -0.13 3.53 2.03 0.46 -2.46 116.55 118.15 1qni n ASP 87 Ca -0.12 -0.58 -0.02 0.00 0.52 0.00 0.00 54.79 54.60 1qni n ASP 87 Cb 0.44 -4.21 -0.01 0.00 -0.72 0.00 0.00 41.12 36.62 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 -1.63 0.15 3.17 0.27 0.00 -0.09 -4.91 105.19 102.14 1qni n GLY 88 Ca -0.09 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.69 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 -2.00 1.38 -0.15 1.61 0.52 -1.03 -1.27 118.95 118.01 1qni s ARG 89 Ca 0.00 -0.64 -0.32 0.00 -0.52 0.00 0.00 55.73 54.25 1qni s ARG 89 Cb 0.00 -1.34 -0.09 0.00 0.52 0.00 0.00 34.95 34.04 1qni s ARG 89 CO 0.00 0.37 2.05 0.66 0.02 0.00 0.00 175.30 178.40 1qni n TYR 90 N 2.58 2.13 0.66 -0.53 4.01 -1.26 -0.59 117.16 124.16 1qni n TYR 90 Ca -0.15 -0.06 0.12 0.00 -0.16 0.00 0.00 57.90 57.65 1qni n TYR 90 Cb 0.54 -2.69 0.12 0.00 -0.31 0.00 0.00 39.34 37.00 1qni n TYR 90 CO 0.00 0.00 0.00 -0.40 -0.46 0.00 0.00 176.86 176.00 1qni n ASP 91 N 8.82 0.63 -0.77 7.72 5.68 -0.82 -4.86 116.55 132.95 1qni n ASP 91 Ca 0.28 -0.11 -0.10 0.00 -0.50 0.00 0.00 54.79 54.35 1qni n ASP 91 Cb 0.35 0.46 -0.04 0.00 -1.14 0.00 0.00 41.12 40.74 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 1.38 1.15 0.06 6.12 0.00 -1.25 -4.91 105.19 107.75 1qni n GLY 92 Ca 0.03 -0.55 -0.02 0.00 0.00 0.00 0.00 46.02 45.48 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 0.01 0.00 -5.62 1.61 3.64 -1.87 -3.43 116.57 110.90 1qni h LYS 93 Ca -0.21 0.00 -0.58 0.00 -1.27 0.00 0.00 60.65 58.59 1qni h LYS 93 Cb 0.67 0.00 -0.13 0.00 -0.41 0.00 0.00 32.23 32.35 1qni h LYS 93 CO 0.30 0.03 -0.63 0.71 -2.27 0.00 0.00 179.45 177.60 1qni s TYR 94 N -1.84 2.32 -0.08 1.91 2.02 -1.26 -2.64 117.35 117.78 1qni s TYR 94 Ca -0.06 -0.69 -0.03 0.00 -0.37 0.00 0.00 57.07 55.92 1qni s TYR 94 Cb 0.01 -1.52 0.04 0.00 -0.40 0.00 0.00 41.96 40.10 1qni s TYR 94 CO 0.10 0.38 0.11 -1.17 -1.57 0.00 0.00 175.55 173.40 1qni s LEU 95 N -3.61 0.07 -0.04 -1.29 0.20 -0.73 -1.40 118.68 111.88 1qni s LEU 95 Ca 0.34 0.08 0.01 0.00 0.69 0.00 0.00 54.13 55.25 1qni s LEU 95 Cb 0.07 0.04 -0.03 0.00 -0.43 0.00 0.00 46.19 45.84 1qni s LEU 95 CO 0.16 -0.26 -0.03 -0.36 -0.29 0.00 0.00 176.35 175.57 1qni s PHE 96 N 2.22 3.01 0.10 5.38 0.40 0.23 -0.16 117.98 129.16 1qni s PHE 96 Ca 0.04 0.06 -0.05 0.00 -0.60 0.00 0.00 56.93 56.38 1qni s PHE 96 Cb -0.13 -1.69 -0.02 0.00 0.51 0.00 0.00 43.02 41.69 1qni s PHE 96 CO -0.05 0.41 0.12 -1.50 0.70 0.00 0.00 175.22 174.89 1qni s ILE 97 N -0.95 0.14 0.43 0.64 2.07 -0.77 -1.48 121.20 121.28 1qni s ILE 97 Ca 0.16 -1.55 0.08 0.00 -1.41 0.00 0.00 60.65 57.93 1qni s ILE 97 Cb -0.11 -1.63 0.01 0.00 0.13 0.00 0.00 42.46 40.86 1qni s ILE 97 CO 0.06 -0.65 0.55 0.54 -1.91 0.00 0.00 174.94 173.53 1qni s ASN 98 N -2.94 5.51 -0.23 4.50 2.20 -1.26 -0.78 114.94 121.95 1qni s ASN 98 Ca 0.12 -0.51 -0.04 0.00 -0.94 0.00 0.00 52.86 51.48 1qni s ASN 98 Cb 0.06 -0.58 0.08 0.00 -2.00 0.00 0.00 41.25 38.81 1qni s ASN 98 CO -0.06 -0.78 0.10 -0.62 -2.94 0.00 0.00 177.10 172.81 1qni s ASP 99 N -4.33 2.92 0.26 3.54 2.15 -0.24 -3.55 116.67 117.43 1qni s ASP 99 Ca 0.54 -0.94 0.15 0.00 0.43 0.00 0.00 52.55 52.73 1qni s ASP 99 Cb -0.08 -0.32 0.05 0.00 -0.30 0.00 0.00 42.92 42.26 1qni s ASP 99 CO 0.32 -0.39 1.40 0.50 -0.17 0.00 0.00 175.17 176.84 1qni h LYS 100 N 8.40 0.00 -0.17 4.34 3.64 -0.36 -2.81 116.57 129.61 1qni h LYS 100 Ca -0.17 0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.15 1qni h LYS 100 Cb 1.09 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.90 1qni h LYS 100 CO 0.36 0.49 -0.12 0.00 -2.27 0.00 0.00 179.45 177.92 1qni h ALA 101 N 1.49 0.24 -0.17 5.00 0.00 -1.87 -3.37 119.26 120.58 1qni h ALA 101 Ca -0.01 -0.30 -0.17 0.00 0.00 0.00 0.00 54.91 54.43 1qni h ALA 101 Cb 1.40 -0.05 -0.23 0.00 0.00 0.00 0.00 17.79 18.91 1qni h ALA 101 CO 0.06 0.09 -0.78 0.09 0.00 0.00 0.00 179.25 178.72 1qni n ASN 102 N -4.57 2.00 -3.46 0.00 3.02 -1.26 -4.93 115.26 106.06 1qni n ASN 102 Ca -0.06 -3.11 -0.31 0.00 -0.03 0.00 0.00 54.58 51.08 1qni n ASN 102 Cb 0.34 -0.43 0.03 0.00 -0.61 0.00 0.00 39.78 39.11 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 -0.52 -5.05 -3.88 3.41 -1.04 -1.09 -4.94 114.28 101.18 1qni n THR 103 Ca 0.18 0.16 -0.09 0.00 -2.04 0.00 0.00 64.05 62.25 1qni n THR 103 Cb 0.88 -4.08 -0.06 0.00 -1.82 0.00 0.00 70.33 65.25 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 -3.00 1.15 -0.02 -2.82 0.52 -1.08 -3.11 118.95 110.59 1qni s ARG 104 Ca 0.27 -1.05 0.02 0.00 -0.52 0.00 0.00 55.73 54.45 1qni s ARG 104 Cb -0.03 0.41 0.01 0.00 0.52 0.00 0.00 34.95 35.85 1qni s ARG 104 CO 0.86 -0.43 -0.05 0.08 0.02 0.00 0.00 175.30 175.77 1qni s VAL 105 N -3.92 0.51 0.14 3.52 1.01 -0.35 -1.07 120.40 120.24 1qni s VAL 105 Ca 0.13 -0.19 0.09 0.00 0.00 0.00 0.00 61.98 62.01 1qni s VAL 105 Cb 0.03 -0.49 -0.04 0.00 0.00 0.00 0.00 36.38 35.87 1qni s VAL 105 CO -0.03 0.19 -0.15 0.00 0.00 0.00 0.00 175.10 175.10 1qni s ALA 106 N 0.41 2.77 -0.05 5.51 0.00 0.04 -1.04 121.76 129.39 1qni s ALA 106 Ca -0.05 -1.40 0.06 0.00 0.00 0.00 0.00 51.96 50.56 1qni s ALA 106 Cb -0.09 -0.67 -0.01 0.00 0.00 0.00 0.00 23.12 22.36 1qni s ALA 106 CO -0.00 0.55 -0.22 0.50 0.00 0.00 0.00 175.76 176.58 1qni s ARG 107 N -2.40 2.28 -0.06 0.00 3.52 0.68 -1.85 118.95 121.13 1qni s ARG 107 Ca 0.20 -0.81 0.06 0.00 -0.13 0.00 0.00 55.73 55.06 1qni s ARG 107 Cb -0.10 -1.95 -0.01 0.00 -1.56 0.00 0.00 34.95 31.33 1qni s ARG 107 CO 0.12 0.34 -0.24 0.42 -0.81 0.00 0.00 175.30 175.13 1qni s ILE 108 N -0.12 1.99 -0.33 4.11 1.01 0.77 0.11 121.20 128.75 1qni s ILE 108 Ca -0.03 -1.03 -0.26 0.00 0.00 0.00 0.00 60.65 59.33 1qni s ILE 108 Cb -0.13 -1.68 0.01 0.00 0.01 0.00 0.00 42.46 40.67 1qni s ILE 108 CO 0.03 0.55 0.92 -0.13 0.00 0.00 0.00 174.94 176.32 1qni s ARG 109 N -0.15 3.96 0.08 2.79 0.52 -0.28 -1.77 118.95 124.10 1qni s ARG 109 Ca -0.04 0.74 0.24 0.00 -0.52 0.00 0.00 55.73 56.16 1qni s ARG 109 Cb -0.13 -3.75 0.96 0.00 0.52 0.00 0.00 34.95 32.54 1qni s ARG 109 CO 0.04 -0.83 1.76 1.28 0.02 0.00 0.00 175.30 177.56 1qni n LEU 110 N 6.59 0.28 0.13 2.53 4.77 -1.08 0.35 117.00 130.56 1qni n LEU 110 Ca 0.07 0.54 -0.01 0.00 -0.03 0.00 0.00 56.01 56.59 1qni n LEU 110 Cb 0.48 -0.47 0.13 0.00 -2.33 0.00 0.00 43.42 41.23 1qni n LEU 110 CO 0.55 -0.18 0.45 -2.24 -1.33 0.00 0.00 177.39 174.65 1qni h ASP 111 N 0.00 0.00 0.00 -1.43 2.03 -1.79 -3.34 116.42 111.89 1qni h ASP 111 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1qni h ASP 111 Cb 0.48 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.98 1qni h ASP 111 CO 0.00 0.64 0.00 2.30 -1.03 0.00 0.00 179.24 181.15 1qni n ILE 112 N -3.60 0.00 -3.28 4.15 -5.35 -1.19 -1.15 119.36 108.93 1qni n ILE 112 Ca -0.00 -0.34 -0.15 0.00 -0.27 0.00 0.00 62.75 61.99 1qni n ILE 112 Cb 0.67 1.16 0.06 0.00 -1.74 0.00 0.00 39.64 39.79 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 -0.35 -2.00 -3.80 6.28 2.81 0.15 -5.04 117.12 115.18 1qni n MET 113 Ca 0.00 0.90 -0.12 0.00 -1.81 0.00 0.00 57.70 56.67 1qni n MET 113 Cb 0.04 -5.60 -0.11 0.00 -0.71 0.00 0.00 33.22 26.85 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 -4.40 0.42 0.16 0.03 -0.14 -1.08 -4.83 119.74 109.91 1qni s LYS 114 Ca 0.40 0.04 -0.32 0.00 -1.36 0.00 0.00 55.97 54.74 1qni s LYS 114 Cb -0.06 0.19 -0.10 0.00 -1.68 0.00 0.00 37.83 36.18 1qni s LYS 114 CO 0.76 -0.09 1.57 0.99 -0.76 0.00 0.00 175.35 177.82 1qni s THR 115 N -0.56 2.63 -0.27 2.17 2.01 -1.26 -1.13 115.64 119.24 1qni s THR 115 Ca -0.07 0.45 -0.05 0.00 0.31 0.00 0.00 61.69 62.34 1qni s THR 115 Cb -0.04 -3.29 -0.15 0.00 0.01 0.00 0.00 72.50 69.03 1qni s THR 115 CO 0.01 0.03 -0.27 -0.67 -0.69 0.00 0.00 174.62 173.03 1qni n ASP 116 N 3.99 1.97 -3.91 3.53 2.03 0.12 -4.85 116.55 119.43 1qni n ASP 116 Ca 0.14 0.06 -0.10 0.00 0.52 0.00 0.00 54.79 55.40 1qni n ASP 116 Cb 0.39 -0.58 -0.11 0.00 -0.72 0.00 0.00 41.12 40.10 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 -2.52 0.38 -0.05 -0.67 -0.14 -1.01 -4.96 119.74 110.77 1qni s LYS 117 Ca -0.36 -0.43 -0.00 0.00 -1.36 0.00 0.00 55.97 53.81 1qni s LYS 117 Cb 0.11 0.15 0.03 0.00 -1.68 0.00 0.00 37.83 36.44 1qni s LYS 117 CO 0.56 -0.08 0.00 0.42 -0.76 0.00 0.00 175.35 175.49 1qni s ILE 118 N -1.28 0.24 -0.01 2.17 1.01 -1.25 -0.23 121.20 121.84 1qni s ILE 118 Ca -0.14 0.12 0.07 0.00 0.00 0.00 0.00 60.65 60.71 1qni s ILE 118 Cb -0.08 -0.37 -0.02 0.00 0.01 0.00 0.00 42.46 42.01 1qni s ILE 118 CO 0.00 0.19 -0.23 -0.89 0.00 0.00 0.00 174.94 174.01 1qni s THR 119 N 1.46 1.85 -0.20 2.92 2.01 -0.21 -4.89 115.64 118.58 1qni s THR 119 Ca -0.03 -1.01 -0.15 0.00 0.31 0.00 0.00 61.69 60.80 1qni s THR 119 Cb -0.13 -1.54 -0.04 0.00 0.01 0.00 0.00 72.50 70.80 1qni s THR 119 CO -0.03 0.51 0.36 -1.00 -0.69 0.00 0.00 174.62 173.77 1qni s HIS 120 N -0.56 3.37 -0.07 4.92 3.76 -1.26 -1.21 115.29 124.24 1qni s HIS 120 Ca 0.09 0.56 -0.25 0.00 -0.15 0.00 0.00 55.06 55.31 1qni s HIS 120 Cb -0.09 -2.48 -0.03 0.00 1.11 0.00 0.00 32.58 31.09 1qni s HIS 120 CO -0.01 0.02 0.76 0.42 -0.85 0.00 0.00 174.74 175.09 1qni s ILE 121 N 1.20 5.00 0.46 0.60 -1.09 -1.18 -5.02 121.20 121.17 1qni s ILE 121 Ca 0.17 1.57 -0.16 0.00 -2.23 0.00 0.00 60.65 60.00 1qni s ILE 121 Cb -0.14 -4.10 -0.08 0.00 -1.58 0.00 0.00 42.46 36.55 1qni s ILE 121 CO 0.07 0.20 0.92 -2.16 -1.23 0.00 0.00 174.94 172.75 1qni s PRO 122 N 1.03 3.98 -1.56 2.79 0.04 -1.26 -4.40 135.00 135.62 1qni s PRO 122 Ca 0.40 0.88 -0.04 0.00 0.04 0.00 0.00 61.00 62.28 1qni s PRO 122 Cb -0.18 -2.21 0.04 0.00 0.04 0.00 0.00 34.50 32.18 1qni s PRO 122 CO 0.19 -0.15 0.23 0.09 0.04 0.00 0.00 177.00 177.40 1qni n ASN 123 N -1.25 0.04 -3.45 6.66 3.02 -1.26 -4.93 115.26 114.09 1qni n ASN 123 Ca 0.06 -1.19 -0.11 0.00 -0.03 0.00 0.00 54.58 53.31 1qni n ASN 123 Cb 0.54 -2.05 -0.02 0.00 -0.61 0.00 0.00 39.78 37.64 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 -4.08 0.00 0.00 2.41 0.11 -1.26 -4.82 120.40 112.76 1qni s VAL 124 Ca 0.15 0.00 0.01 0.00 -2.93 0.00 0.00 61.98 59.21 1qni s VAL 124 Cb -0.08 -1.00 -0.01 0.00 -1.53 0.00 0.00 36.38 33.76 1qni s VAL 124 CO 0.97 0.00 -0.05 -1.10 -3.33 0.00 0.00 175.10 171.59 1qni s GLN 125 N -3.47 0.37 -0.28 1.54 -0.21 -1.26 -4.97 119.66 111.38 1qni s GLN 125 Ca 0.02 -0.25 -0.04 0.00 0.02 0.00 0.00 55.36 55.11 1qni s GLN 125 Cb -0.01 -0.32 0.01 0.00 1.00 0.00 0.00 33.01 33.69 1qni s GLN 125 CO -0.11 0.08 0.16 0.00 -2.12 0.00 0.00 175.29 173.30 1qni n ALA 126 N 2.72 -3.28 -2.58 6.09 0.00 -1.26 -3.00 120.51 119.20 1qni n ALA 126 Ca -0.14 0.59 -0.43 0.00 0.00 0.00 0.00 53.44 53.45 1qni n ALA 126 Cb 0.58 -1.55 -0.02 0.00 0.00 0.00 0.00 19.45 18.46 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 -1.65 4.51 0.00 0.00 -1.09 -1.23 -0.69 121.20 121.05 1qni s ILE 127 Ca 0.07 1.80 0.00 0.00 -2.23 0.00 0.00 60.65 60.29 1qni s ILE 127 Cb -0.02 -4.23 0.00 0.00 -1.58 0.00 0.00 42.46 36.63 1qni s ILE 127 CO 0.64 -0.24 0.00 1.57 -1.23 0.00 0.00 174.94 175.68 1qni n HIS 128 N 6.58 0.00 -1.75 3.97 -0.00 -0.42 -2.62 115.22 120.98 1qni n HIS 128 Ca 0.13 0.00 -0.42 0.00 0.46 0.00 0.00 57.72 57.89 1qni n HIS 128 Cb 0.46 0.00 -0.01 0.00 -0.12 0.00 0.00 29.99 30.32 1qni n HIS 128 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1qni n GLY 129 N 3.94 1.13 3.64 1.57 0.00 -0.56 -4.71 105.19 110.20 1qni n GLY 129 Ca 0.00 0.35 -0.08 0.00 0.00 0.00 0.00 46.02 46.29 1qni n GLY 129 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1qni s LEU 130 N -1.48 -0.74 0.30 0.99 0.20 -1.26 0.38 118.68 117.08 1qni s LEU 130 Ca 0.56 1.26 -0.12 0.00 0.69 0.00 0.00 54.13 56.52 1qni s LEU 130 Cb -0.50 2.19 0.01 0.00 -0.43 0.00 0.00 46.19 47.46 1qni s LEU 130 CO 0.60 -0.20 0.56 -0.13 -0.29 0.00 0.00 176.35 176.88 1qni s ARG 131 N 1.10 1.78 0.22 1.98 0.52 -0.45 -4.88 118.95 119.23 1qni s ARG 131 Ca -0.06 -1.38 0.10 0.00 -0.52 0.00 0.00 55.73 53.87 1qni s ARG 131 Cb -0.05 0.51 -0.04 0.00 0.52 0.00 0.00 34.95 35.89 1qni s ARG 131 CO -0.12 -0.77 -0.08 -0.51 0.02 0.00 0.00 175.30 173.83 1qni s LEU 132 N -3.07 2.97 0.41 2.53 1.43 -1.26 -1.06 118.68 120.63 1qni s LEU 132 Ca 0.22 -0.68 -0.25 0.00 -1.03 0.00 0.00 54.13 52.39 1qni s LEU 132 Cb -0.02 -1.58 -0.08 0.00 0.03 0.00 0.00 46.19 44.54 1qni s LEU 132 CO 0.12 0.06 1.25 -1.58 0.23 0.00 0.00 176.35 176.43 1qni s GLN 133 N -3.20 3.95 -0.15 1.70 0.74 -0.92 -4.56 119.66 117.22 1qni s GLN 133 Ca 0.28 2.04 0.10 0.00 0.05 0.00 0.00 55.36 57.82 1qni s GLN 133 Cb -0.07 -2.69 -0.16 0.00 1.10 0.00 0.00 33.01 31.18 1qni s GLN 133 CO 0.17 -0.47 0.00 1.63 -0.55 0.00 0.00 175.29 176.07 1qni n LYS 134 N 0.03 1.43 -4.29 1.67 5.02 -1.26 -3.57 118.16 117.19 1qni n LYS 134 Ca 0.04 0.02 -0.18 0.00 -2.02 0.00 0.00 58.31 56.17 1qni n LYS 134 Cb 0.45 -1.36 -0.15 0.00 -0.02 0.00 0.00 35.03 33.95 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 -2.34 0.61 0.42 -0.18 1.01 -1.26 -0.91 120.40 117.75 1qni s VAL 135 Ca -0.11 -0.32 0.14 0.00 0.00 0.00 0.00 61.98 61.69 1qni s VAL 135 Cb 0.05 -0.52 0.15 0.00 0.00 0.00 0.00 36.38 36.05 1qni s VAL 135 CO 0.54 0.18 1.93 -0.65 0.00 0.00 0.00 175.10 177.10 1qni h PRO 136 N 6.05 0.01 0.00 2.72 0.11 -1.95 -3.22 132.00 135.73 1qni h PRO 136 Ca -0.30 -0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.81 1qni h PRO 136 Cb 1.18 -0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.29 1qni h PRO 136 CO 0.50 0.26 0.12 0.36 -0.21 0.00 0.00 178.00 179.02 1qni n LYS 137 N -4.25 0.29 -2.70 1.05 2.85 -1.24 0.17 118.16 114.35 1qni n LYS 137 Ca -0.02 -0.60 -0.42 0.00 -1.05 0.00 0.00 58.31 56.22 1qni n LYS 137 Cb 0.30 0.76 -0.03 0.00 -0.65 0.00 0.00 35.03 35.41 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 -2.61 4.17 -0.17 0.58 2.01 0.67 -4.22 115.64 116.06 1qni s THR 138 Ca 0.06 -0.77 0.16 0.00 0.31 0.00 0.00 61.69 61.45 1qni s THR 138 Cb -0.01 -4.91 -0.22 0.00 0.01 0.00 0.00 72.50 67.36 1qni s THR 138 CO 0.03 -1.75 0.07 0.59 -0.69 0.00 0.00 174.62 172.87 1qni n ASN 139 N 8.16 0.65 -4.45 3.53 5.03 -1.26 -4.70 115.26 122.22 1qni n ASN 139 Ca 0.22 0.00 -0.30 0.00 0.87 0.00 0.00 54.58 55.37 1qni n ASN 139 Cb 0.49 0.95 -0.12 0.00 -1.02 0.00 0.00 39.78 40.08 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 -2.44 2.50 -0.22 3.10 2.02 -1.26 -1.76 117.35 119.28 1qni s TYR 140 Ca -0.09 -0.29 0.02 0.00 -0.37 0.00 0.00 57.07 56.35 1qni s TYR 140 Cb 0.05 -1.38 0.04 0.00 -0.40 0.00 0.00 41.96 40.27 1qni s TYR 140 CO 0.72 0.31 -0.15 0.08 -1.57 0.00 0.00 175.55 174.94 1qni s VAL 141 N -1.02 2.16 -0.20 0.71 1.01 0.16 -2.16 120.40 121.07 1qni s VAL 141 Ca 0.16 -1.27 -0.13 0.00 0.00 0.00 0.00 61.98 60.74 1qni s VAL 141 Cb -0.10 -2.09 -0.05 0.00 0.00 0.00 0.00 36.38 34.13 1qni s VAL 141 CO 0.07 0.25 0.24 -0.36 0.00 0.00 0.00 175.10 175.31 1qni s PHE 142 N 1.20 3.40 0.01 5.22 0.08 -0.23 -1.15 117.98 126.51 1qni s PHE 142 Ca -0.02 0.45 0.01 0.00 0.12 0.00 0.00 56.93 57.49 1qni s PHE 142 Cb -0.16 -2.32 -0.01 0.00 -0.57 0.00 0.00 43.02 39.96 1qni s PHE 142 CO -0.09 0.16 -0.05 0.00 -0.10 0.00 0.00 175.22 175.15 1qni s ASN 144 N -0.67 6.04 -0.25 0.00 0.02 0.16 -1.95 114.94 118.29 1qni s ASN 144 Ca -0.04 0.12 -0.00 0.00 -1.02 0.00 0.00 52.86 51.92 1qni s ASN 144 Cb -0.05 -1.76 0.04 0.00 0.02 0.00 0.00 41.25 39.50 1qni s ASN 144 CO -0.00 0.12 -0.08 0.00 0.02 0.00 0.00 177.10 177.16 1qni s ALA 145 N -1.59 2.64 0.13 0.60 0.00 -1.24 -1.30 121.76 121.01 1qni s ALA 145 Ca 0.33 -1.55 -0.12 0.00 0.00 0.00 0.00 51.96 50.61 1qni s ALA 145 Cb -0.12 -1.65 -0.05 0.00 0.00 0.00 0.00 23.12 21.31 1qni s ALA 145 CO 0.26 -0.92 1.47 1.49 0.00 0.00 0.00 175.76 178.06 1qni h GLU 146 N 7.94 0.87 -5.41 0.00 4.81 -0.90 -3.30 114.58 118.58 1qni h GLU 146 Ca -0.29 -0.43 -0.63 0.00 -0.13 0.00 0.00 59.36 57.88 1qni h GLU 146 Cb 1.09 0.00 -0.10 0.00 0.63 0.00 0.00 28.75 30.37 1qni h GLU 146 CO 0.55 1.08 -0.49 -0.06 -0.73 0.00 0.00 179.01 179.35 1qni s PHE 147 N -4.46 3.46 0.33 0.92 0.08 -1.16 -4.30 117.98 112.85 1qni s PHE 147 Ca -0.12 0.38 -0.23 0.00 0.12 0.00 0.00 56.93 57.08 1qni s PHE 147 Cb 0.10 -2.07 -0.10 0.00 -0.57 0.00 0.00 43.02 40.39 1qni s PHE 147 CO 0.86 0.44 0.90 0.14 -0.10 0.00 0.00 175.22 177.47 1qni s VAL 148 N -0.15 4.32 0.08 -0.44 -7.23 -1.26 -4.22 120.40 111.50 1qni s VAL 148 Ca 0.10 1.63 -0.10 0.00 -1.81 0.00 0.00 61.98 61.80 1qni s VAL 148 Cb -0.11 -3.88 0.01 0.00 0.56 0.00 0.00 36.38 32.95 1qni s VAL 148 CO 0.00 0.03 0.23 0.27 -0.31 0.00 0.00 175.10 175.33 1qni s ILE 149 N -1.74 0.12 0.97 -0.62 -4.36 -0.07 -4.71 121.20 110.79 1qni s ILE 149 Ca 0.52 -1.01 -0.11 0.00 -0.26 0.00 0.00 60.65 59.79 1qni s ILE 149 Cb -0.16 -1.22 0.18 0.00 1.25 0.00 0.00 42.46 42.51 1qni s ILE 149 CO 0.21 -0.56 1.12 -2.16 0.24 0.00 0.00 174.94 173.79 1qni s PRO 150 N -3.57 0.56 -0.24 0.37 0.04 -1.26 -0.01 135.00 130.88 1qni s PRO 150 Ca 0.02 1.42 -0.02 0.00 0.04 0.00 0.00 61.00 62.47 1qni s PRO 150 Cb 0.03 -1.68 0.07 0.00 0.04 0.00 0.00 34.50 32.96 1qni s PRO 150 CO -0.10 -2.90 0.05 -0.65 0.04 0.00 0.00 177.00 173.44 1qni s GLN 151 N -4.60 0.77 0.62 4.56 -0.21 -1.25 -2.26 119.66 117.29 1qni s GLN 151 Ca 0.67 -0.71 -0.13 0.00 0.02 0.00 0.00 55.36 55.22 1qni s GLN 151 Cb -0.23 -2.09 -0.03 0.00 1.00 0.00 0.00 33.01 31.65 1qni s GLN 151 CO 0.59 -0.77 1.03 -1.25 -2.12 0.00 0.00 175.29 172.78 1qni s PRO 152 N 1.73 3.43 -1.33 2.91 0.04 -1.26 -5.03 135.00 135.50 1qni s PRO 152 Ca 0.02 0.91 -0.12 0.00 0.04 0.00 0.00 61.00 61.85 1qni s PRO 152 Cb -0.17 -2.06 0.12 0.00 0.04 0.00 0.00 34.50 32.43 1qni s PRO 152 CO -0.15 -0.70 1.90 -1.71 0.04 0.00 0.00 177.00 176.38 1qni n ASN 153 N -2.56 4.73 -0.88 6.66 5.15 -0.96 -4.65 115.26 122.75 1qni n ASN 153 Ca 0.07 -2.99 0.09 0.00 -0.60 0.00 0.00 54.58 51.15 1qni n ASN 153 Cb 0.54 -1.58 0.18 0.00 -0.53 0.00 0.00 39.78 38.39 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 5.33 3.08 -0.33 1.20 5.68 -1.26 -4.98 116.55 125.27 1qni n ASP 154 Ca 0.44 -1.90 -0.03 0.00 -0.50 0.00 0.00 54.79 52.80 1qni n ASP 154 Cb 0.39 -0.23 -0.01 0.00 -1.14 0.00 0.00 41.12 40.13 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 1.03 0.43 0.70 6.12 0.00 -1.26 -4.90 105.19 107.31 1qni n GLY 155 Ca 0.15 -0.83 0.09 0.00 0.00 0.00 0.00 46.02 45.42 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 -3.46 0.07 -3.12 2.61 -2.24 -1.26 -4.83 114.28 102.04 1qni n THR 156 Ca -0.04 -0.53 0.05 0.00 -2.27 0.00 0.00 64.05 61.26 1qni n THR 156 Cb 0.32 1.30 -0.00 0.00 -2.10 0.00 0.00 70.33 69.85 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 -1.39 -0.83 0.00 3.42 2.15 -1.26 -5.03 116.67 113.73 1qni s ASP 157 Ca 0.21 0.03 0.29 0.00 0.43 0.00 0.00 52.55 53.51 1qni s ASP 157 Cb 0.14 1.46 1.21 0.00 -0.30 0.00 0.00 42.92 45.43 1qni s ASP 157 CO 0.21 -0.14 1.84 0.49 -0.17 0.00 0.00 175.17 177.40 1qni n PHE 158 N 5.05 0.00 -1.67 -5.34 3.72 -1.26 -4.69 117.46 113.28 1qni n PHE 158 Ca 0.08 0.00 -0.45 0.00 -0.05 0.00 0.00 57.45 57.03 1qni n PHE 158 Cb 0.57 -0.15 -0.03 0.00 -0.94 0.00 0.00 39.48 38.93 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 -0.82 2.76 0.23 4.37 3.41 -1.26 -4.86 113.62 117.44 1qni n SER 159 Ca 0.15 1.13 0.16 0.00 -0.26 0.00 0.00 58.87 60.05 1qni n SER 159 Cb 0.28 -1.42 0.65 0.00 -0.26 0.00 0.00 64.21 63.46 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 4.45 0.00 -1.16 1.04 3.38 -1.92 -2.75 115.31 118.36 1qni h LEU 160 Ca -0.45 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.52 1qni h LEU 160 Cb 1.27 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.99 1qni h LEU 160 CO 0.78 0.00 0.46 0.44 0.09 0.00 0.00 178.44 180.20 1qni h ASP 161 N 0.00 0.91 -0.35 -0.43 5.19 -1.89 -2.70 116.42 117.14 1qni h ASP 161 Ca 0.00 -0.05 0.00 0.00 -0.62 0.00 0.00 57.03 56.36 1qni h ASP 161 Cb 0.41 -0.23 0.00 0.00 0.18 0.00 0.00 39.33 39.69 1qni h ASP 161 CO 0.00 0.70 0.00 0.59 -3.12 0.00 0.00 179.24 177.41 1qni n ASN 162 N -4.38 4.27 -4.72 6.45 3.02 -1.04 -4.96 115.26 113.89 1qni n ASN 162 Ca 0.08 -2.90 -0.36 0.00 -0.03 0.00 0.00 54.58 51.37 1qni n ASN 162 Cb 0.07 -0.56 -0.07 0.00 -0.61 0.00 0.00 39.78 38.61 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 -1.57 6.38 0.24 6.41 0.01 -1.02 -3.95 113.70 120.20 1qni s SER 163 Ca 0.44 0.44 0.01 0.00 1.31 0.00 0.00 55.95 58.15 1qni s SER 163 Cb 0.34 -2.17 -0.04 0.00 0.21 0.00 0.00 66.02 64.36 1qni s SER 163 CO 0.12 0.09 0.14 -0.31 0.41 0.00 0.00 173.24 173.68 1qni s TYR 164 N 0.58 1.37 0.37 2.43 1.51 0.98 -4.52 117.35 120.07 1qni s TYR 164 Ca 0.15 -1.35 0.03 0.00 -1.01 0.00 0.00 57.07 54.89 1qni s TYR 164 Cb -0.13 -0.70 -0.04 0.00 -0.11 0.00 0.00 41.96 40.98 1qni s TYR 164 CO 0.03 -0.57 0.10 -0.08 -1.11 0.00 0.00 175.55 173.93 1qni s THR 165 N -3.92 0.81 0.08 -0.71 -1.32 -1.26 -0.89 115.64 108.43 1qni s THR 165 Ca 0.38 -2.00 -0.02 0.00 -1.21 0.00 0.00 61.69 58.84 1qni s THR 165 Cb 0.07 -2.53 -0.03 0.00 -1.51 0.00 0.00 72.50 68.49 1qni s THR 165 CO 0.15 0.00 0.03 -0.04 -2.21 0.00 0.00 174.62 172.55 1qni s MET 166 N -3.81 0.75 -0.19 7.08 -1.94 -1.26 -2.99 119.30 116.93 1qni s MET 166 Ca 0.29 -1.25 -0.11 0.00 -1.71 0.00 0.00 55.69 52.91 1qni s MET 166 Cb 0.05 0.24 -0.05 0.00 2.01 0.00 0.00 34.83 37.08 1qni s MET 166 CO 0.15 -0.18 0.15 0.12 -0.01 0.00 0.00 175.02 175.24 1qni s PHE 167 N -3.95 3.42 -0.06 -0.03 5.36 0.12 -3.70 117.98 119.13 1qni s PHE 167 Ca 0.12 0.37 0.05 0.00 -0.96 0.00 0.00 56.93 56.51 1qni s PHE 167 Cb 0.07 -2.19 -0.02 0.00 -0.34 0.00 0.00 43.02 40.55 1qni s PHE 167 CO -0.06 0.28 -0.22 0.99 -1.46 0.00 0.00 175.22 174.75 1qni s THR 168 N 0.38 2.35 -0.17 0.12 2.01 -0.82 0.41 115.64 119.92 1qni s THR 168 Ca 0.09 -0.96 -0.01 0.00 0.31 0.00 0.00 61.69 61.12 1qni s THR 168 Cb -0.11 -1.88 -0.00 0.00 0.01 0.00 0.00 72.50 70.52 1qni s THR 168 CO -0.01 0.57 -0.13 0.00 -0.69 0.00 0.00 174.62 174.36 1qni s ALA 169 N -0.28 2.56 -0.01 7.40 0.00 -0.17 -1.75 121.76 129.52 1qni s ALA 169 Ca 0.00 -1.06 0.03 0.00 0.00 0.00 0.00 51.96 50.93 1qni s ALA 169 Cb -0.13 -1.31 -0.03 0.00 0.00 0.00 0.00 23.12 21.64 1qni s ALA 169 CO 0.03 -0.10 -0.06 0.42 0.00 0.00 0.00 175.76 176.05 1qni s ILE 170 N 0.92 3.70 -0.32 0.00 1.01 -0.30 0.43 121.20 126.63 1qni s ILE 170 Ca -0.03 -0.71 -0.29 0.00 0.00 0.00 0.00 60.65 59.62 1qni s ILE 170 Cb -0.15 -2.59 0.02 0.00 0.01 0.00 0.00 42.46 39.74 1qni s ILE 170 CO -0.01 0.43 1.11 -0.62 0.00 0.00 0.00 174.94 175.84 1qni s ASP 171 N -1.32 6.90 0.36 3.58 2.15 -0.11 -0.66 116.67 127.57 1qni s ASP 171 Ca 0.16 1.06 0.09 0.00 0.43 0.00 0.00 52.55 54.30 1qni s ASP 171 Cb -0.11 -2.54 0.82 0.00 -0.30 0.00 0.00 42.92 40.79 1qni s ASP 171 CO 0.07 -0.91 1.89 0.00 -0.17 0.00 0.00 175.17 176.04 1qni h ALA 172 N 8.25 1.83 0.00 3.66 0.00 -1.62 1.02 119.26 132.40 1qni h ALA 172 Ca -0.21 0.01 -0.18 0.00 0.00 0.00 0.00 54.91 54.52 1qni h ALA 172 Cb 1.07 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.70 1qni h ALA 172 CO 1.04 -0.05 -0.88 0.93 0.00 0.00 0.00 179.25 180.29 1qni h GLU 173 N 0.68 0.00 0.00 0.00 4.39 -1.86 -3.34 114.58 114.46 1qni h GLU 173 Ca 0.42 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.12 1qni h GLU 173 Cb 0.65 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.30 1qni h GLU 173 CO -0.18 0.88 -1.55 2.41 -1.16 0.00 0.00 179.01 179.40 1qni n THR 174 N -3.48 0.00 -1.76 1.13 -1.04 -1.04 -4.98 114.28 103.10 1qni n THR 174 Ca -0.00 -0.31 -0.17 0.00 -2.04 0.00 0.00 64.05 61.53 1qni n THR 174 Cb 0.84 0.26 -0.05 0.00 -1.82 0.00 0.00 70.33 69.56 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 -1.93 -1.23 -4.14 -2.82 2.81 0.35 -4.98 117.12 105.18 1qni n MET 175 Ca -0.02 1.01 -0.36 0.00 -1.81 0.00 0.00 57.70 56.52 1qni n MET 175 Cb 0.36 -5.29 -0.08 0.00 -0.71 0.00 0.00 33.22 27.49 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 -2.63 5.75 0.22 7.83 1.01 -1.23 -4.75 116.67 122.86 1qni s ASP 176 Ca 0.00 0.28 -0.31 0.00 0.71 0.00 0.00 52.55 53.23 1qni s ASP 176 Cb 0.00 -1.76 -0.10 0.00 1.01 0.00 0.00 42.92 42.07 1qni s ASP 176 CO 0.00 0.38 1.55 -0.69 0.21 0.00 0.00 175.17 176.62 1qni s VAL 177 N -0.86 2.46 -0.14 -1.27 1.01 -1.26 -0.93 120.40 119.41 1qni s VAL 177 Ca 0.13 0.36 -0.11 0.00 0.00 0.00 0.00 61.98 62.36 1qni s VAL 177 Cb -0.12 -3.23 -0.07 0.00 0.00 0.00 0.00 36.38 32.96 1qni s VAL 177 CO 0.03 0.04 0.04 0.00 0.00 0.00 0.00 175.10 175.21 1qni h ALA 178 N 5.95 0.04 -2.92 5.51 0.00 -0.34 -3.46 119.26 124.05 1qni h ALA 178 Ca -0.44 -0.47 0.07 0.00 0.00 0.00 0.00 54.91 54.07 1qni h ALA 178 Cb 1.21 0.33 -0.07 0.00 0.00 0.00 0.00 17.79 19.27 1qni h ALA 178 CO 0.86 0.33 0.26 1.67 0.00 0.00 0.00 179.25 182.36 1qni s TRP 179 N -2.05 -0.25 0.02 0.00 1.48 -1.10 -4.14 118.94 112.90 1qni s TRP 179 Ca -0.13 -0.14 0.03 0.00 -1.06 0.00 0.00 56.10 54.80 1qni s TRP 179 Cb 0.01 0.67 -0.01 0.00 -1.16 0.00 0.00 33.47 32.98 1qni s TRP 179 CO 0.26 -1.11 -0.09 -0.65 -4.06 0.00 0.00 176.95 171.31 1qni s GLN 180 N -3.81 0.63 -0.17 3.25 -0.21 -0.34 -1.00 119.66 118.02 1qni s GLN 180 Ca 0.09 -0.49 0.00 0.00 0.02 0.00 0.00 55.36 54.98 1qni s GLN 180 Cb -0.05 -0.56 0.00 0.00 1.00 0.00 0.00 33.01 33.41 1qni s GLN 180 CO 0.03 0.14 -0.16 0.08 -2.12 0.00 0.00 175.29 173.26 1qni s VAL 181 N -0.63 2.52 0.22 1.09 1.01 0.17 -1.25 120.40 123.52 1qni s VAL 181 Ca -0.01 -0.81 -0.30 0.00 0.00 0.00 0.00 61.98 60.87 1qni s VAL 181 Cb -0.06 -2.07 -0.08 0.00 0.00 0.00 0.00 36.38 34.17 1qni s VAL 181 CO 0.00 0.51 1.08 -0.63 0.00 0.00 0.00 175.10 176.06 1qni s ILE 182 N 1.03 3.76 0.29 2.22 1.01 -0.28 0.13 121.20 129.36 1qni s ILE 182 Ca -0.01 1.63 0.02 0.00 0.00 0.00 0.00 60.65 62.29 1qni s ILE 182 Cb -0.15 -4.04 -0.04 0.00 0.01 0.00 0.00 42.46 38.24 1qni s ILE 182 CO -0.04 0.33 0.12 0.68 0.00 0.00 0.00 174.94 176.04 1qni s VAL 183 N -0.69 0.49 0.53 2.92 -7.23 -1.16 0.01 120.40 115.26 1qni s VAL 183 Ca 0.46 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.64 1qni s VAL 183 Cb -0.30 -2.57 0.02 0.00 0.56 0.00 0.00 36.38 34.09 1qni s VAL 183 CO 0.37 0.00 0.76 -1.81 -0.31 0.00 0.00 175.10 174.10 1qni s ASP 184 N -3.37 5.41 0.77 4.85 1.01 -1.26 -4.44 116.67 119.64 1qni s ASP 184 Ca 0.36 0.09 0.00 0.00 0.71 0.00 0.00 52.55 53.71 1qni s ASP 184 Cb 0.06 -1.06 0.00 0.00 1.01 0.00 0.00 42.92 42.93 1qni s ASP 184 CO 0.15 -1.04 0.00 0.61 0.21 0.00 0.00 175.17 175.10 1qni n GLY 185 N -2.30 2.58 0.00 0.21 0.00 -1.26 -4.84 105.19 99.58 1qni n GLY 185 Ca 0.06 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.76 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 0.41 0.12 -4.03 1.61 2.04 -1.25 -4.52 115.26 109.64 1qni n ASN 186 Ca 0.00 -0.67 -0.20 0.00 -0.44 0.00 0.00 54.58 53.26 1qni n ASN 186 Cb 0.00 0.00 -0.15 0.00 -2.53 0.00 0.00 39.78 37.10 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 1.92 0.00 -4.53 1.43 -1.24 -4.47 118.68 111.78 1qni s LEU 187 Ca 0.00 -0.19 0.00 0.00 -1.03 0.00 0.00 54.13 52.91 1qni s LEU 187 Cb 0.00 -0.56 0.00 0.00 0.03 0.00 0.00 46.19 45.66 1qni s LEU 187 CO 0.00 0.10 0.00 -0.67 0.23 0.00 0.00 176.35 176.01 1qni n ASP 188 N 3.03 0.00 -4.79 2.29 -0.08 -0.77 -3.81 116.55 112.42 1qni n ASP 188 Ca -0.16 0.00 -0.27 0.00 -1.51 0.00 0.00 54.79 52.85 1qni n ASP 188 Cb 0.55 0.00 -0.05 0.00 2.34 0.00 0.00 41.12 43.96 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 -0.12 4.42 0.21 1.67 -0.87 -1.25 -1.50 114.94 117.51 1qni s ASN 189 Ca 0.00 -1.25 -0.18 0.00 -1.57 0.00 0.00 52.86 49.86 1qni s ASN 189 Cb 0.00 -0.01 0.02 0.00 -0.02 0.00 0.00 41.25 41.25 1qni s ASN 189 CO 0.00 -0.77 0.55 0.28 -2.57 0.00 0.00 177.10 174.59 1qni s THR 190 N -2.71 0.02 0.14 1.60 -1.32 -1.26 -1.56 115.64 110.55 1qni s THR 190 Ca 0.32 -0.85 -0.25 0.00 -1.21 0.00 0.00 61.69 59.69 1qni s THR 190 Cb 0.02 -1.70 0.06 0.00 -1.51 0.00 0.00 72.50 69.38 1qni s THR 190 CO 0.18 -0.08 0.91 -0.62 -2.21 0.00 0.00 174.62 172.80 1qni s ASP 191 N -2.89 -0.23 0.15 8.08 -1.08 -0.30 -4.52 116.67 115.88 1qni s ASP 191 Ca 0.11 -0.35 0.06 0.00 -0.52 0.00 0.00 52.55 51.85 1qni s ASP 191 Cb -0.02 0.50 -0.04 0.00 -1.46 0.00 0.00 42.92 41.90 1qni s ASP 191 CO -0.00 -0.91 -0.13 0.00 0.52 0.00 0.00 175.17 174.65 1qni s ALA 192 N -3.35 1.63 1.00 3.66 0.00 -1.26 -0.84 121.76 122.60 1qni s ALA 192 Ca 0.10 -1.47 0.00 0.00 0.00 0.00 0.00 51.96 50.59 1qni s ALA 192 Cb -0.02 -0.03 0.00 0.00 0.00 0.00 0.00 23.12 23.07 1qni s ALA 192 CO 0.00 0.02 0.00 -0.40 0.00 0.00 0.00 175.76 175.38 1qni n ASP 193 N 0.00 -0.15 -1.65 0.00 5.68 -1.01 -4.83 116.55 114.59 1qni n ASP 193 Ca -0.11 -0.67 -0.16 0.00 -0.50 0.00 0.00 54.79 53.34 1qni n ASP 193 Cb 0.59 0.00 0.13 0.00 -1.14 0.00 0.00 41.12 40.70 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 -1.59 2.00 0.00 2.11 4.02 -1.26 -4.22 117.16 118.21 1qni n TYR 194 Ca 0.00 -2.04 0.00 0.00 -0.01 0.00 0.00 57.90 55.85 1qni n TYR 194 Cb 0.00 -0.65 0.00 0.00 -0.02 0.00 0.00 39.34 38.67 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 -0.98 0.00 0.00 -0.72 -2.24 -1.26 -4.71 114.28 104.36 1qni n THR 195 Ca 0.43 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.21 1qni n THR 195 Cb 0.98 -0.41 0.00 0.00 -2.10 0.00 0.00 70.33 68.80 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 2.81 0.76 0.09 3.38 0.00 -1.22 -4.33 105.19 106.69 1qni n GLY 196 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.95 1qni n GLY 196 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1qni n LYS 197 N -1.88 0.65 -4.46 1.61 4.81 -1.26 -4.65 118.16 112.98 1qni n LYS 197 Ca 0.00 0.14 -0.26 0.00 -0.87 0.00 0.00 58.31 57.32 1qni n LYS 197 Cb 0.00 -1.67 -0.13 0.00 0.02 0.00 0.00 35.03 33.24 1qni n LYS 197 CO 0.00 0.00 0.00 0.71 1.17 0.00 0.00 177.40 179.28 1qni s TYR 198 N -2.65 2.00 -0.08 5.64 2.02 -1.26 -1.05 117.35 121.97 1qni s TYR 198 Ca -0.07 -0.40 -0.06 0.00 -0.37 0.00 0.00 57.07 56.17 1qni s TYR 198 Cb 0.08 -1.12 0.02 0.00 -0.40 0.00 0.00 41.96 40.54 1qni s TYR 198 CO 0.83 0.21 0.20 0.00 -1.57 0.00 0.00 175.55 175.21 1qni s ALA 199 N -1.01 -0.48 0.06 3.71 0.00 -0.93 -2.40 121.76 120.72 1qni s ALA 199 Ca 0.09 0.61 0.03 0.00 0.00 0.00 0.00 51.96 52.70 1qni s ALA 199 Cb -0.10 -0.37 -0.03 0.00 0.00 0.00 0.00 23.12 22.63 1qni s ALA 199 CO 0.04 -0.11 -0.10 0.95 0.00 0.00 0.00 175.76 176.54 1qni s THR 200 N 0.32 0.80 0.02 0.00 -4.23 -0.02 0.66 115.64 113.19 1qni s THR 200 Ca -0.02 -1.29 0.02 0.00 -1.18 0.00 0.00 61.69 59.22 1qni s THR 200 Cb -0.03 -0.94 -0.02 0.00 1.34 0.00 0.00 72.50 72.85 1qni s THR 200 CO -0.01 -0.39 -0.06 -0.44 -0.54 0.00 0.00 174.62 173.18 1qni s SER 201 N -1.85 0.67 0.77 3.99 0.01 -0.19 -1.15 113.70 115.95 1qni s SER 201 Ca -0.04 -0.37 -0.10 0.00 1.31 0.00 0.00 55.95 56.75 1qni s SER 201 Cb -0.08 0.01 0.07 0.00 0.21 0.00 0.00 66.02 66.23 1qni s SER 201 CO 0.01 -0.12 1.13 0.42 0.41 0.00 0.00 173.24 175.09 1qni s THR 202 N -0.91 2.19 -0.10 1.44 -4.23 -0.60 -0.40 115.64 113.03 1qni s THR 202 Ca -0.06 -0.04 -0.06 0.00 -1.18 0.00 0.00 61.69 60.35 1qni s THR 202 Cb -0.07 -3.04 0.04 0.00 1.34 0.00 0.00 72.50 70.77 1qni s THR 202 CO 0.00 -0.05 0.25 0.00 -0.54 0.00 0.00 174.62 174.28 1qni n TYR 204 N 3.89 0.00 -2.46 0.00 0.18 -1.26 -3.83 117.16 113.68 1qni n TYR 204 Ca -0.22 0.00 -0.27 0.00 1.88 0.00 0.00 57.90 59.30 1qni n TYR 204 Cb 0.54 0.00 0.00 0.00 -0.38 0.00 0.00 39.34 39.51 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 -1.09 4.66 0.23 9.48 2.85 -1.26 -4.57 115.26 125.55 1qni n ASN 205 Ca 0.00 -3.70 0.18 0.00 -0.11 0.00 0.00 54.58 50.94 1qni n ASN 205 Cb 0.00 -0.46 0.87 0.00 1.24 0.00 0.00 39.78 41.43 1qni n ASN 205 CO 0.00 0.00 0.00 0.77 -2.11 0.00 0.00 177.26 175.92 1qni h SER 206 N 2.57 0.00 1.21 1.20 4.64 -1.89 0.44 113.55 121.72 1qni h SER 206 Ca 0.30 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.62 1qni h SER 206 Cb 0.96 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.05 1qni h SER 206 CO 0.84 0.00 0.00 -0.62 -0.87 0.00 0.00 176.83 176.18 1qni n GLU 207 N -3.62 0.22 -3.94 4.77 4.71 -1.26 -4.23 120.64 117.29 1qni n GLU 207 Ca 0.01 0.27 -0.27 0.00 -0.01 0.00 0.00 57.16 57.16 1qni n GLU 207 Cb 0.31 -1.80 -0.01 0.00 -1.01 0.00 0.00 31.44 28.93 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 -2.20 -3.87 -4.17 3.49 1.74 0.16 -4.98 116.66 106.82 1qni n ARG 208 Ca 0.05 0.47 -0.23 0.00 -0.77 0.00 0.00 57.85 57.36 1qni n ARG 208 Cb 0.36 -4.85 -0.07 0.00 -1.02 0.00 0.00 32.46 26.88 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 -3.73 3.39 -0.24 7.54 0.00 -1.26 -4.87 121.76 122.58 1qni s ALA 209 Ca 0.18 -1.77 0.02 0.00 0.00 0.00 0.00 51.96 50.39 1qni s ALA 209 Cb -0.10 -0.74 -0.16 0.00 0.00 0.00 0.00 23.12 22.12 1qni s ALA 209 CO 0.87 0.11 -0.21 1.55 0.00 0.00 0.00 175.76 178.08 1qni n VAL 210 N -1.07 1.39 -2.36 0.00 3.14 -1.26 -4.76 118.33 113.41 1qni n VAL 210 Ca -0.04 -0.54 -0.38 0.00 -2.96 0.00 0.00 64.34 60.42 1qni n VAL 210 Cb 0.61 -1.34 -0.03 0.00 -1.06 0.00 0.00 33.84 32.02 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 -6.33 6.59 0.18 6.55 -4.77 -1.26 -4.95 116.67 112.68 1qni s ASP 211 Ca -0.32 2.26 -0.22 0.00 -3.30 0.00 0.00 52.55 50.97 1qni s ASP 211 Cb 0.08 -2.61 0.10 0.00 -1.09 0.00 0.00 42.92 39.41 1qni s ASP 211 CO 0.56 -0.62 1.59 0.25 0.70 0.00 0.00 175.17 177.65 1qni h LEU 212 N 2.62 -1.19 -0.24 2.11 6.46 -2.00 -2.45 115.31 120.61 1qni h LEU 212 Ca -0.49 0.22 0.06 0.00 -0.12 0.00 0.00 57.88 57.56 1qni h LEU 212 Cb 1.23 0.58 -0.07 0.00 -0.73 0.00 0.00 40.66 41.67 1qni h LEU 212 CO 0.62 -0.31 -0.21 0.00 -0.62 0.00 0.00 178.44 177.92 1qni h ALA 213 N 0.91 -0.08 -0.45 1.25 0.00 -1.99 -2.03 119.26 116.88 1qni h ALA 213 Ca 0.22 0.08 0.13 0.00 0.00 0.00 0.00 54.91 55.34 1qni h ALA 213 Cb 0.55 0.45 -0.02 0.00 0.00 0.00 0.00 17.79 18.78 1qni h ALA 213 CO -0.66 -0.63 0.34 0.78 0.00 0.00 0.00 179.25 179.08 1qni h GLY 214 N -0.21 0.00 2.00 0.00 0.00 -1.83 -0.07 103.07 102.95 1qni h GLY 214 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.47 1qni h GLY 214 CO -0.37 0.00 0.00 -1.30 0.00 0.00 0.00 176.54 174.87 1qni n THR 215 N -4.27 0.45 0.17 4.70 -2.24 -0.77 -3.09 114.28 109.23 1qni n THR 215 Ca 0.08 -0.10 0.04 0.00 -2.27 0.00 0.00 64.05 61.80 1qni n THR 215 Cb 0.54 -0.65 0.06 0.00 -2.10 0.00 0.00 70.33 68.19 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 -1.95 1.03 0.00 -0.78 2.00 -0.11 -4.72 117.12 112.59 1qni n MET 216 Ca 0.06 -1.27 0.00 0.00 0.00 0.00 0.00 57.70 56.48 1qni n MET 216 Cb 0.36 -1.16 0.00 0.00 0.00 0.00 0.00 33.22 32.42 1qni n MET 216 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 175.97 173.84 1qni n ARG 217 N 0.36 0.00 -1.76 0.03 0.63 -0.77 -4.64 116.66 110.51 1qni n ARG 217 Ca 0.06 0.63 -0.41 0.00 -0.92 0.00 0.00 57.85 57.20 1qni n ARG 217 Cb 0.25 -1.38 -0.01 0.00 0.45 0.00 0.00 32.46 31.78 1qni n ARG 217 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 1qni n ASN 218 N -2.08 3.83 0.24 6.15 3.02 -1.26 -4.88 115.26 120.28 1qni n ASN 218 Ca 0.00 1.20 0.10 0.00 -0.03 0.00 0.00 54.58 55.84 1qni n ASN 218 Cb 0.00 -1.61 0.60 0.00 -0.61 0.00 0.00 39.78 38.16 1qni n ASN 218 CO 0.00 0.00 0.00 0.44 -2.62 0.00 0.00 177.26 175.08 1qni h ASP 219 N 3.70 0.00 -4.45 6.41 3.32 -1.99 -3.44 116.42 119.98 1qni h ASP 219 Ca -0.49 0.00 -0.32 0.00 0.02 0.00 0.00 57.03 56.23 1qni h ASP 219 Cb 1.23 0.00 -0.24 0.00 0.22 0.00 0.00 39.33 40.55 1qni h ASP 219 CO 0.70 0.19 -0.75 -0.13 -1.72 0.00 0.00 179.24 177.53 1qni s ARG 220 N -4.14 0.59 0.00 3.56 0.52 -1.26 -2.03 118.95 116.19 1qni s ARG 220 Ca -0.02 -0.62 0.00 0.00 -0.52 0.00 0.00 55.73 54.56 1qni s ARG 220 Cb 0.13 -0.47 0.00 0.00 0.52 0.00 0.00 34.95 35.13 1qni s ARG 220 CO 0.63 0.11 0.00 -0.25 0.02 0.00 0.00 175.30 175.80 1qni n ASP 221 N 1.91 0.00 -1.83 0.23 8.00 -0.08 -4.86 116.55 119.91 1qni n ASP 221 Ca -0.19 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.31 1qni n ASP 221 Cb 0.55 0.00 0.01 0.00 -0.02 0.00 0.00 41.12 41.66 1qni n ASP 221 CO 0.00 0.00 0.00 -2.67 -0.39 0.00 0.00 177.20 174.14 1qni n TRP 222 N 0.00 -0.46 -3.66 1.24 2.14 -1.25 -2.70 117.44 112.75 1qni n TRP 222 Ca 0.00 -0.29 -0.27 0.00 2.07 0.00 0.00 57.50 59.01 1qni n TRP 222 Cb 0.00 0.14 -0.17 0.00 -0.81 0.00 0.00 31.31 30.47 1qni n TRP 222 CO 0.00 0.00 0.00 0.08 2.07 0.00 0.00 177.69 179.84 1qni s VAL 223 N -2.23 0.17 0.13 -1.67 1.01 -0.59 -2.08 120.40 115.14 1qni s VAL 223 Ca 0.09 -0.39 -0.30 0.00 0.00 0.00 0.00 61.98 61.37 1qni s VAL 223 Cb -0.00 -0.81 -0.07 0.00 0.00 0.00 0.00 36.38 35.50 1qni s VAL 223 CO 0.01 -0.30 1.10 -0.69 0.00 0.00 0.00 175.10 175.22 1qni s VAL 224 N 2.01 4.05 -0.18 2.92 1.01 0.46 -2.50 120.40 128.17 1qni s VAL 224 Ca 0.02 1.65 -0.03 0.00 0.00 0.00 0.00 61.98 63.62 1qni s VAL 224 Cb -0.16 -4.06 -0.01 0.00 0.00 0.00 0.00 36.38 32.15 1qni s VAL 224 CO -0.11 0.23 -0.07 -0.69 0.00 0.00 0.00 175.10 174.45 1qni s VAL 225 N 0.22 3.33 -0.18 2.92 1.01 -0.40 -1.02 120.40 126.28 1qni s VAL 225 Ca 0.52 -0.53 -0.07 0.00 0.00 0.00 0.00 61.98 61.89 1qni s VAL 225 Cb -0.28 -2.47 -0.04 0.00 0.00 0.00 0.00 36.38 33.59 1qni s VAL 225 CO 0.32 0.47 0.07 -0.36 0.00 0.00 0.00 175.10 175.61 1qni s PHE 226 N 0.92 3.29 -0.94 5.22 0.40 0.21 -2.10 117.98 124.99 1qni s PHE 226 Ca -0.01 0.15 -0.15 0.00 -0.60 0.00 0.00 56.93 56.31 1qni s PHE 226 Cb -0.15 -2.07 0.19 0.00 0.51 0.00 0.00 43.02 41.50 1qni s PHE 226 CO 0.00 0.23 1.01 1.21 0.70 0.00 0.00 175.22 178.38 1qni s ASN 227 N 0.20 6.80 0.24 1.36 3.84 -0.20 -2.18 114.94 125.00 1qni s ASN 227 Ca 0.05 -2.57 -0.05 0.00 0.21 0.00 0.00 52.86 50.51 1qni s ASN 227 Cb -0.12 -2.30 0.40 0.00 -0.55 0.00 0.00 41.25 38.67 1qni s ASN 227 CO 0.00 -0.75 1.80 0.58 -2.79 0.00 0.00 177.10 175.94 1qni h VAL 228 N 5.06 0.88 -0.67 -5.21 2.07 -1.40 -1.19 116.25 115.79 1qni h VAL 228 Ca 0.16 -0.25 0.10 0.00 0.82 0.00 0.00 66.70 67.52 1qni h VAL 228 Cb 1.00 0.08 -0.08 0.00 -1.52 0.00 0.00 31.29 30.77 1qni h VAL 228 CO 0.97 0.13 0.28 -0.08 0.02 0.00 0.00 177.57 178.89 1qni h GLU 229 N 0.74 0.46 -0.01 1.57 4.81 -1.82 0.19 114.58 120.51 1qni h GLU 229 Ca 0.39 -0.03 -0.21 0.00 -0.13 0.00 0.00 59.36 59.39 1qni h GLU 229 Cb 0.39 -0.10 -0.00 0.00 0.63 0.00 0.00 28.75 29.66 1qni h GLU 229 CO -0.26 0.31 -0.88 0.00 -0.73 0.00 0.00 179.01 177.44 1qni h ARG 230 N 0.48 0.35 0.02 1.92 3.08 -1.73 -2.71 114.38 115.79 1qni h ARG 230 Ca 0.34 -0.36 -0.00 0.00 0.07 0.00 0.00 59.98 60.03 1qni h ARG 230 Cb 0.42 0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.56 1qni h ARG 230 CO -0.31 1.04 -0.01 0.82 -1.07 0.00 0.00 179.97 180.43 1qni h ILE 231 N 0.20 1.18 -0.20 2.04 2.04 -0.53 -1.60 117.51 120.64 1qni h ILE 231 Ca -0.06 -0.63 0.01 0.00 1.00 0.00 0.00 64.86 65.19 1qni h ILE 231 Cb 1.50 1.60 -0.02 0.00 -0.74 0.00 0.00 36.82 39.16 1qni h ILE 231 CO 0.15 0.16 0.10 0.00 0.00 0.00 0.00 178.15 178.55 1qni h ALA 232 N 0.66 0.23 -0.91 1.87 0.00 -0.73 -1.05 119.26 119.34 1qni h ALA 232 Ca -0.00 0.01 0.05 0.00 0.00 0.00 0.00 54.91 54.96 1qni h ALA 232 Cb 0.29 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 17.99 1qni h ALA 232 CO 0.01 -0.32 0.59 0.00 0.00 0.00 0.00 179.25 179.53 1qni h ALA 233 N 1.10 1.47 -0.33 0.00 0.00 -1.47 0.13 119.26 120.16 1qni h ALA 233 Ca 0.08 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 1qni h ALA 233 Cb 0.02 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 1qni h ALA 233 CO -0.06 0.42 0.01 0.00 0.00 0.00 0.00 179.25 179.62 1qni h ALA 234 N 1.49 0.44 -0.52 0.00 0.00 -0.73 -0.82 119.26 119.13 1qni h ALA 234 Ca 0.38 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 1qni h ALA 234 Cb 0.12 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1qni h ALA 234 CO -0.13 0.19 0.23 0.28 0.00 0.00 0.00 179.25 179.82 1qni h VAL 235 N 0.38 1.21 -0.53 0.00 2.07 -0.49 -1.28 116.25 117.60 1qni h VAL 235 Ca 0.09 -0.62 -0.01 0.00 0.82 0.00 0.00 66.70 66.99 1qni h VAL 235 Cb 0.44 0.65 -0.03 0.00 -1.52 0.00 0.00 31.29 30.83 1qni h VAL 235 CO 0.02 0.24 0.30 0.50 0.02 0.00 0.00 177.57 178.65 1qni h LYS 236 N 0.69 0.72 0.00 1.57 3.64 -0.60 -0.76 116.57 121.83 1qni h LYS 236 Ca 0.18 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.49 1qni h LYS 236 Cb 0.16 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 31.83 1qni h LYS 236 CO -0.02 0.52 0.00 0.00 -2.27 0.00 0.00 179.45 177.68 1qni n ALA 237 N -2.46 1.97 -0.62 5.00 0.00 -0.33 -4.88 120.51 119.19 1qni n ALA 237 Ca 0.05 -0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1qni n ALA 237 Cb 0.09 -1.36 0.00 0.00 0.00 0.00 0.00 19.45 18.17 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 0.67 0.68 3.47 0.00 0.00 -0.29 -4.99 105.19 104.73 1qni n GLY 238 Ca 0.05 -0.04 -0.44 0.00 0.00 0.00 0.00 46.02 45.59 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 -2.04 7.04 0.22 1.61 0.01 -0.54 -4.90 114.94 116.33 1qni s ASN 239 Ca 0.00 -2.91 -0.23 0.00 -0.71 0.00 0.00 52.86 49.01 1qni s ASN 239 Cb 0.00 -2.41 0.04 0.00 0.41 0.00 0.00 41.25 39.29 1qni s ASN 239 CO 0.00 -0.78 0.84 0.72 -1.51 0.00 0.00 177.10 176.37 1qni s PHE 240 N 1.75 -0.16 0.40 2.20 -0.12 -1.26 -4.50 117.98 116.29 1qni s PHE 240 Ca 0.42 -0.23 0.02 0.00 -0.05 0.00 0.00 56.93 57.10 1qni s PHE 240 Cb -0.03 0.68 -0.01 0.00 -0.63 0.00 0.00 43.02 43.03 1qni s PHE 240 CO -0.00 -1.04 0.07 1.63 -0.05 0.00 0.00 175.22 175.83 1qni n LYS 241 N -0.47 0.77 -4.23 1.99 5.02 -0.25 -4.89 118.16 116.11 1qni n LYS 241 Ca -0.05 -3.14 -0.17 0.00 -2.02 0.00 0.00 58.31 52.93 1qni n LYS 241 Cb 0.60 1.27 -0.14 0.00 -0.02 0.00 0.00 35.03 36.74 1qni n LYS 241 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1qni s THR 242 N -2.75 0.66 -0.10 -0.18 -4.23 -1.26 -0.90 115.64 106.88 1qni s THR 242 Ca 0.09 -0.63 0.00 0.00 -1.18 0.00 0.00 61.69 59.98 1qni s THR 242 Cb 0.00 -0.61 -0.02 0.00 1.34 0.00 0.00 72.50 73.21 1qni s THR 242 CO 0.07 -0.01 -0.10 -0.63 -0.54 0.00 0.00 174.62 173.41 1qni s ILE 243 N -0.60 3.39 0.00 2.99 1.01 -1.26 -5.03 121.20 121.70 1qni s ILE 243 Ca -0.01 -0.57 0.00 0.00 0.00 0.00 0.00 60.65 60.07 1qni s ILE 243 Cb -0.06 -2.40 0.00 0.00 0.01 0.00 0.00 42.46 40.01 1qni s ILE 243 CO 0.00 0.56 0.00 0.61 0.00 0.00 0.00 174.94 176.11 1qni n GLY 244 N 2.86 3.35 0.69 6.18 0.00 -1.26 -2.22 105.19 114.78 1qni n GLY 244 Ca -0.18 -0.11 0.13 0.00 0.00 0.00 0.00 46.02 45.86 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 3.82 2.14 -4.83 1.61 8.00 -1.26 -4.94 116.55 121.09 1qni n ASP 245 Ca 0.00 -1.72 -0.34 0.00 0.71 0.00 0.00 54.79 53.44 1qni n ASP 245 Cb 0.00 -0.03 -0.06 0.00 -0.02 0.00 0.00 41.12 41.01 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 -1.93 6.91 0.00 -2.24 0.15 -0.94 -4.97 113.70 110.68 1qni s SER 246 Ca 0.34 1.36 0.20 0.00 0.70 0.00 0.00 55.95 58.55 1qni s SER 246 Cb 0.20 -2.40 0.35 0.00 -1.71 0.00 0.00 66.02 62.46 1qni s SER 246 CO 0.32 -0.11 1.30 0.29 1.20 0.00 0.00 173.24 176.24 1qni n LYS 247 N 0.10 2.27 -1.88 5.44 4.76 -1.26 -4.21 118.16 123.38 1qni n LYS 247 Ca 0.01 -2.09 -0.42 0.00 -2.87 0.00 0.00 58.31 52.94 1qni n LYS 247 Cb 0.52 -1.44 -0.03 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 -1.39 2.43 0.11 -0.18 1.01 -1.26 -4.93 120.40 116.19 1qni s VAL 248 Ca 0.33 0.32 -0.31 0.00 0.00 0.00 0.00 61.98 62.32 1qni s VAL 248 Cb 0.19 -3.21 -0.09 0.00 0.00 0.00 0.00 36.38 33.28 1qni s VAL 248 CO 0.27 0.03 1.52 -2.84 0.00 0.00 0.00 175.10 174.08 1qni s PRO 249 N 0.73 4.25 -0.07 2.72 0.02 -1.26 -4.61 135.00 136.78 1qni s PRO 249 Ca 0.69 2.23 0.04 0.00 0.02 0.00 0.00 61.00 63.98 1qni s PRO 249 Cb -0.45 -3.33 0.00 0.00 0.02 0.00 0.00 34.50 30.74 1qni s PRO 249 CO 0.35 -0.58 -0.19 0.08 -0.33 0.00 0.00 177.00 176.32 1qni s VAL 250 N 1.60 1.65 0.16 3.83 1.01 -0.08 -1.19 120.40 127.39 1qni s VAL 250 Ca 0.69 -0.81 0.10 0.00 0.00 0.00 0.00 61.98 61.96 1qni s VAL 250 Cb -0.40 -1.44 -0.04 0.00 0.00 0.00 0.00 36.38 34.51 1qni s VAL 250 CO 0.31 0.47 -0.20 0.68 0.00 0.00 0.00 175.10 176.35 1qni s VAL 251 N 0.25 2.62 -0.26 2.92 -7.23 -0.38 -1.09 120.40 117.23 1qni s VAL 251 Ca -0.11 -1.79 -0.16 0.00 -1.81 0.00 0.00 61.98 58.11 1qni s VAL 251 Cb -0.15 -2.24 -0.04 0.00 0.56 0.00 0.00 36.38 34.52 1qni s VAL 251 CO 0.05 -0.03 0.40 -0.62 -0.31 0.00 0.00 175.10 174.58 1qni s ASP 252 N -2.49 6.31 -0.16 4.85 -1.08 -1.26 -1.12 116.67 121.72 1qni s ASP 252 Ca 0.20 0.36 0.17 0.00 -0.52 0.00 0.00 52.55 52.76 1qni s ASP 252 Cb -0.09 -2.22 0.45 0.00 -1.46 0.00 0.00 42.92 39.59 1qni s ASP 252 CO 0.10 -0.19 1.33 0.61 0.52 0.00 0.00 175.17 177.54 1qni n GLY 253 N 4.53 4.33 3.76 2.66 0.00 0.10 -4.83 105.19 115.74 1qni n GLY 253 Ca -0.08 -1.07 -0.40 0.00 0.00 0.00 0.00 46.02 44.47 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 -2.84 4.55 6.99 1.61 0.52 -1.17 -4.65 118.95 123.95 1qni s ARG 254 Ca 0.39 1.14 0.00 0.00 -0.52 0.00 0.00 55.73 56.73 1qni s ARG 254 Cb 0.32 -3.30 0.00 0.00 0.52 0.00 0.00 34.95 32.49 1qni s ARG 254 CO 0.07 0.45 0.00 0.41 0.02 0.00 0.00 175.30 176.25 1qni n GLY 255 N 1.91 2.21 3.49 -3.53 0.00 -1.26 -4.34 105.19 103.67 1qni n GLY 255 Ca -0.04 -0.37 -0.42 0.00 0.00 0.00 0.00 46.02 45.19 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 3.14 0.03 1.61 2.02 -1.26 -4.93 118.70 119.31 1qni s GLU 256 Ca 0.00 -0.59 0.03 0.00 0.02 0.00 0.00 54.97 54.43 1qni s GLU 256 Cb 0.00 -4.21 -0.02 0.00 0.10 0.00 0.00 34.13 30.01 1qni s GLU 256 CO 0.00 -1.94 -0.10 0.45 0.02 0.00 0.00 175.26 173.69 1qni s SER 257 N 3.69 1.14 0.26 -0.19 0.15 -1.26 -5.01 113.70 112.47 1qni s SER 257 Ca 0.27 -0.38 0.25 0.00 0.70 0.00 0.00 55.95 56.79 1qni s SER 257 Cb -0.13 -0.05 0.93 0.00 -1.71 0.00 0.00 66.02 65.06 1qni s SER 257 CO 0.12 -0.03 1.74 -1.84 1.20 0.00 0.00 173.24 174.44 1qni n GLU 258 N 2.07 0.23 0.03 5.44 0.28 -1.26 -3.12 120.64 124.31 1qni n GLU 258 Ca -0.18 0.36 -0.08 0.00 -0.16 0.00 0.00 57.16 57.10 1qni n GLU 258 Cb 0.56 -1.87 -0.13 0.00 1.43 0.00 0.00 31.44 31.43 1qni n GLU 258 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 177.13 177.71 1qni h PHE 259 N 0.00 0.04 -2.90 -1.84 0.04 -1.91 -3.46 116.94 106.91 1qni h PHE 259 Ca 0.00 -0.03 -0.45 0.00 2.80 0.00 0.00 57.97 60.29 1qni h PHE 259 Cb 0.50 -0.00 -0.14 0.00 2.20 0.00 0.00 35.95 38.51 1qni h PHE 259 CO 0.00 1.04 -0.65 0.95 -0.60 0.00 0.00 178.31 179.04 1qni s THR 260 N -2.66 1.35 -0.10 -1.55 -4.23 -1.18 -1.04 115.64 106.23 1qni s THR 260 Ca -0.02 -2.07 -0.04 0.00 -1.18 0.00 0.00 61.69 58.38 1qni s THR 260 Cb 0.09 -2.49 0.05 0.00 1.34 0.00 0.00 72.50 71.50 1qni s THR 260 CO 0.82 -0.25 0.21 -0.13 -0.54 0.00 0.00 174.62 174.74 1qni s ARG 261 N -3.80 0.11 -0.47 3.99 3.00 -0.89 -4.49 118.95 116.39 1qni s ARG 261 Ca 0.30 0.61 -0.16 0.00 0.00 0.00 0.00 55.73 56.49 1qni s ARG 261 Cb 0.05 -0.15 0.07 0.00 0.00 0.00 0.00 34.95 34.93 1qni s ARG 261 CO 0.12 -0.26 0.41 0.71 0.00 0.00 0.00 175.30 176.27 1qni s TYR 262 N 2.07 3.23 -0.50 -0.53 1.51 -1.26 -1.28 117.35 120.59 1qni s TYR 262 Ca -0.01 -0.88 -0.19 0.00 -1.01 0.00 0.00 57.07 54.98 1qni s TYR 262 Cb -0.12 -3.17 0.06 0.00 -0.11 0.00 0.00 41.96 38.62 1qni s TYR 262 CO -0.07 -0.80 0.61 0.42 -1.11 0.00 0.00 175.55 174.60 1qni s ILE 263 N 1.72 4.90 0.12 2.71 1.01 -1.04 -4.88 121.20 125.73 1qni s ILE 263 Ca 0.05 -0.53 -0.35 0.00 0.00 0.00 0.00 60.65 59.82 1qni s ILE 263 Cb -0.24 -4.29 -0.16 0.00 0.01 0.00 0.00 42.46 37.79 1qni s ILE 263 CO 0.07 -0.79 1.40 -2.65 0.00 0.00 0.00 174.94 172.97 1qni n PRO 264 N 6.11 1.48 -4.20 2.79 -0.02 -1.26 -1.54 135.00 138.36 1qni n PRO 264 Ca -0.07 0.53 -0.16 0.00 -2.02 0.00 0.00 63.50 61.78 1qni n PRO 264 Cb 0.45 -2.20 -0.14 0.00 -0.02 0.00 0.00 33.50 31.59 1qni n PRO 264 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1qni s VAL 265 N 0.53 0.53 -0.18 -1.45 1.01 -1.10 -4.87 120.40 114.87 1qni s VAL 265 Ca 0.81 -0.41 -0.36 0.00 0.00 0.00 0.00 61.98 62.02 1qni s VAL 265 Cb -0.85 -0.47 -0.13 0.00 0.00 0.00 0.00 36.38 34.93 1qni s VAL 265 CO 0.45 0.06 1.90 -0.81 0.00 0.00 0.00 175.10 176.70 1qni n PRO 266 N 2.68 1.74 -0.22 2.72 -0.04 -1.26 -0.90 135.00 139.72 1qni n PRO 266 Ca -0.15 0.62 0.00 0.00 -0.04 0.00 0.00 63.50 63.93 1qni n PRO 266 Cb 0.57 -2.49 0.00 0.00 -0.04 0.00 0.00 33.50 31.55 1qni n PRO 266 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1qni n LYS 267 N 6.57 0.00 -3.75 0.54 5.02 -0.86 -3.99 118.16 121.70 1qni n LYS 267 Ca 0.26 0.00 -0.22 0.00 -2.02 0.00 0.00 58.31 56.34 1qni n LYS 267 Cb 0.24 -0.07 -0.01 0.00 -0.02 0.00 0.00 35.03 35.17 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 0.72 -1.18 -4.63 4.39 4.13 -1.26 -3.60 115.26 113.82 1qni n ASN 268 Ca 0.00 -0.67 -0.41 0.00 1.68 0.00 0.00 54.58 55.18 1qni n ASN 268 Cb 0.00 -0.81 0.02 0.00 -1.54 0.00 0.00 39.78 37.45 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 -2.99 1.37 0.00 3.52 -0.04 -1.25 -4.53 135.00 131.07 1qni n PRO 269 Ca -0.10 0.49 0.00 0.00 -0.04 0.00 0.00 63.50 63.86 1qni n PRO 269 Cb 0.31 -2.12 0.00 0.00 -0.04 0.00 0.00 33.50 31.65 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 -0.66 0.00 -0.95 0.54 -0.00 -0.48 -4.31 115.22 109.36 1qni n HIS 270 Ca 0.10 0.00 -0.29 0.00 0.46 0.00 0.00 57.72 57.98 1qni n HIS 270 Cb 0.41 0.00 0.18 0.00 -0.12 0.00 0.00 29.99 30.46 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 -0.60 1.59 -0.27 1.57 0.00 -0.44 -3.86 107.32 105.31 1qni s GLY 271 Ca 0.00 -0.07 -0.01 0.00 0.00 0.00 0.00 44.72 44.63 1qni s GLY 271 CO 0.00 0.50 0.47 -2.27 0.00 0.00 0.00 173.10 171.80 1qni s LEU 272 N -6.61 -0.96 0.05 0.66 0.20 -1.25 -2.15 118.68 108.63 1qni s LEU 272 Ca 0.66 0.39 0.09 0.00 0.69 0.00 0.00 54.13 55.95 1qni s LEU 272 Cb -0.21 1.52 -0.03 0.00 -0.43 0.00 0.00 46.19 47.05 1qni s LEU 272 CO 0.59 -0.29 -0.24 0.20 -0.29 0.00 0.00 176.35 176.32 1qni s ASN 273 N 2.67 2.91 -0.19 3.68 -0.87 -0.33 -4.38 114.94 118.43 1qni s ASN 273 Ca 0.15 -0.59 -0.09 0.00 -1.57 0.00 0.00 52.86 50.76 1qni s ASN 273 Cb -0.15 -0.25 -0.05 0.00 -0.02 0.00 0.00 41.25 40.79 1qni s ASN 273 CO -0.19 0.21 0.11 -0.89 -2.57 0.00 0.00 177.10 173.77 1qni s THR 274 N -0.84 5.24 0.40 1.60 2.01 -1.26 0.06 115.64 122.84 1qni s THR 274 Ca 0.10 0.13 -0.25 0.00 0.31 0.00 0.00 61.69 61.98 1qni s THR 274 Cb -0.10 -3.38 -0.08 0.00 0.01 0.00 0.00 72.50 68.95 1qni s THR 274 CO 0.02 0.46 1.17 -0.94 -0.69 0.00 0.00 174.62 174.64 1qni s SER 275 N 0.29 6.50 0.44 3.53 1.04 -0.67 -4.86 113.70 119.97 1qni s SER 275 Ca 0.07 2.35 0.19 0.00 0.48 0.00 0.00 55.95 59.04 1qni s SER 275 Cb -0.11 -2.61 1.15 0.00 0.10 0.00 0.00 66.02 64.54 1qni s SER 275 CO -0.01 -0.69 1.89 -0.65 0.98 0.00 0.00 173.24 174.76 1qni h PRO 276 N 2.61 0.32 0.00 4.02 0.11 -1.83 0.45 132.00 137.67 1qni h PRO 276 Ca -0.49 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1qni h PRO 276 Cb 1.24 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1qni h PRO 276 CO 0.62 0.21 0.00 0.38 -0.21 0.00 0.00 178.00 179.00 1qni h ASP 277 N 0.33 0.00 -0.83 -2.05 3.04 -1.91 -3.41 116.42 111.59 1qni h ASP 277 Ca 0.41 0.00 -0.13 0.00 -3.24 0.00 0.00 57.03 54.07 1qni h ASP 277 Cb 1.11 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 39.38 1qni h ASP 277 CO -0.12 0.00 -0.16 0.61 -2.04 0.00 0.00 179.24 177.53 1qni n GLY 278 N -0.05 0.24 0.00 7.15 0.00 0.16 -4.93 105.19 107.75 1qni n GLY 278 Ca 0.01 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.40 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 -1.84 1.41 -4.36 1.61 2.85 -1.26 -4.55 118.16 112.02 1qni n LYS 279 Ca -0.08 -0.31 -0.22 0.00 -1.05 0.00 0.00 58.31 56.65 1qni n LYS 279 Cb 0.50 -0.80 -0.16 0.00 -0.65 0.00 0.00 35.03 33.91 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 -0.29 1.05 -0.39 5.58 2.02 -1.26 -0.18 117.35 123.88 1qni s TYR 280 Ca 0.00 -0.35 -0.12 0.00 -0.37 0.00 0.00 57.07 56.24 1qni s TYR 280 Cb 0.00 -0.83 0.03 0.00 -0.40 0.00 0.00 41.96 40.76 1qni s TYR 280 CO 0.00 -0.22 0.24 -0.06 -1.57 0.00 0.00 175.55 173.94 1qni s PHE 281 N 0.76 3.25 -0.35 2.71 0.08 0.62 -1.68 117.98 123.38 1qni s PHE 281 Ca -0.13 -0.95 -0.13 0.00 0.12 0.00 0.00 56.93 55.85 1qni s PHE 281 Cb -0.15 -2.56 -0.01 0.00 -0.57 0.00 0.00 43.02 39.74 1qni s PHE 281 CO 0.02 -0.67 0.25 0.42 -0.10 0.00 0.00 175.22 175.14 1qni s ILE 282 N 1.57 5.21 -0.11 0.64 1.01 0.11 -1.03 121.20 128.61 1qni s ILE 282 Ca 0.03 -0.34 -0.14 0.00 0.00 0.00 0.00 60.65 60.20 1qni s ILE 282 Cb -0.20 -3.73 -0.05 0.00 0.01 0.00 0.00 42.46 38.50 1qni s ILE 282 CO 0.07 -0.07 0.34 0.00 0.00 0.00 0.00 174.94 175.28 1qni s ALA 283 N 1.70 3.62 -0.15 9.38 0.00 0.03 -1.18 121.76 135.16 1qni s ALA 283 Ca 0.06 -0.36 -0.20 0.00 0.00 0.00 0.00 51.96 51.46 1qni s ALA 283 Cb -0.18 -2.40 -0.03 0.00 0.00 0.00 0.00 23.12 20.51 1qni s ALA 283 CO 0.10 0.22 0.56 -0.80 0.00 0.00 0.00 175.76 175.84 1qni s ASN 284 N -0.03 6.71 0.52 0.00 0.01 -0.91 -0.55 114.94 120.69 1qni s ASN 284 Ca 0.20 0.85 0.29 0.00 -0.71 0.00 0.00 52.86 53.49 1qni s ASN 284 Cb -0.14 -2.32 1.40 0.00 0.41 0.00 0.00 41.25 40.59 1qni s ASN 284 CO 0.07 -0.12 2.02 1.23 -1.51 0.00 0.00 177.10 178.80 1qni h GLY 285 N 7.34 0.00 0.00 0.66 0.00 -1.28 -1.28 103.07 108.50 1qni h GLY 285 Ca -0.37 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.96 1qni h GLY 285 CO 0.76 0.00 0.00 1.17 0.00 0.00 0.00 176.54 178.47 1qni n LYS 286 N -3.42 0.00 0.20 4.80 4.81 0.89 -0.96 118.16 124.48 1qni n LYS 286 Ca -0.01 0.00 0.14 0.00 -0.87 0.00 0.00 58.31 57.57 1qni n LYS 286 Cb 0.28 0.00 0.65 0.00 0.02 0.00 0.00 35.03 35.99 1qni n LYS 286 CO 0.00 0.00 0.00 -0.07 1.17 0.00 0.00 177.40 178.50 1qni h LEU 287 N 0.00 0.00 -8.70 3.14 3.38 -1.79 -3.13 115.31 108.20 1qni h LEU 287 Ca 0.00 0.00 -0.64 0.00 0.09 0.00 0.00 57.88 57.33 1qni h LEU 287 Cb 0.00 0.00 -0.22 0.00 0.09 0.00 0.00 40.66 40.53 1qni h LEU 287 CO 0.00 0.00 -0.63 -0.55 0.09 0.00 0.00 178.44 177.35 1qni s SER 288 N -4.60 5.11 0.00 -0.43 0.15 -0.14 -4.94 113.70 108.85 1qni s SER 288 Ca 0.01 -0.18 0.00 0.00 0.70 0.00 0.00 55.95 56.48 1qni s SER 288 Cb 0.09 -1.90 0.00 0.00 -1.71 0.00 0.00 66.02 62.49 1qni s SER 288 CO 0.37 0.01 0.18 -0.81 1.20 0.00 0.00 173.24 174.19 1qni n PRO 289 N 4.62 0.27 -1.85 5.44 -0.04 -1.26 -4.13 135.00 138.06 1qni n PRO 289 Ca -0.16 0.00 -0.05 0.00 -0.04 0.00 0.00 63.50 63.25 1qni n PRO 289 Cb 0.52 -1.09 0.00 0.00 -0.04 0.00 0.00 33.50 32.89 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 0.08 0.00 -3.67 0.52 -2.24 -1.26 -0.52 114.28 107.19 1qni n THR 290 Ca 0.00 -0.39 -0.09 0.00 -2.27 0.00 0.00 64.05 61.30 1qni n THR 290 Cb 0.05 -0.48 -0.10 0.00 -2.10 0.00 0.00 70.33 67.70 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 -0.38 -0.46 -0.20 2.28 1.01 -1.12 -1.30 120.40 120.24 1qni s VAL 291 Ca 0.06 0.14 -0.16 0.00 0.00 0.00 0.00 61.98 62.03 1qni s VAL 291 Cb -0.00 -0.66 -0.04 0.00 0.00 0.00 0.00 36.38 35.68 1qni s VAL 291 CO 0.04 0.06 0.39 -0.44 0.00 0.00 0.00 175.10 175.15 1qni s SER 292 N 2.25 6.43 -0.33 3.32 0.01 0.29 -3.35 113.70 122.33 1qni s SER 292 Ca -0.04 0.51 -0.11 0.00 1.31 0.00 0.00 55.95 57.62 1qni s SER 292 Cb -0.11 -2.23 -0.00 0.00 0.21 0.00 0.00 66.02 63.89 1qni s SER 292 CO -0.13 -0.06 0.18 -0.69 0.41 0.00 0.00 173.24 172.95 1qni s VAL 293 N 1.26 4.76 -0.16 3.43 1.01 -0.45 -0.79 120.40 129.45 1qni s VAL 293 Ca 0.19 -0.44 -0.07 0.00 0.00 0.00 0.00 61.98 61.65 1qni s VAL 293 Cb -0.15 -3.47 -0.04 0.00 0.00 0.00 0.00 36.38 32.73 1qni s VAL 293 CO 0.08 0.00 0.09 -0.63 0.00 0.00 0.00 175.10 174.64 1qni s ILE 294 N 1.63 5.04 -0.32 2.22 1.01 -0.20 -1.04 121.20 129.54 1qni s ILE 294 Ca 0.05 0.05 -0.22 0.00 0.00 0.00 0.00 60.65 60.52 1qni s ILE 294 Cb -0.17 -3.25 -0.00 0.00 0.01 0.00 0.00 42.46 39.05 1qni s ILE 294 CO 0.07 0.51 0.73 0.00 0.00 0.00 0.00 174.94 176.25 1qni s ALA 295 N -0.07 3.51 0.47 9.38 0.00 -0.75 -0.27 121.76 134.03 1qni s ALA 295 Ca 0.08 -0.56 0.20 0.00 0.00 0.00 0.00 51.96 51.68 1qni s ALA 295 Cb -0.12 -3.24 1.27 0.00 0.00 0.00 0.00 23.12 21.04 1qni s ALA 295 CO 0.01 -1.22 2.07 0.82 0.00 0.00 0.00 175.76 177.44 1qni h ILE 296 N 5.61 0.87 -0.91 0.00 2.04 -0.90 -2.69 117.51 121.54 1qni h ILE 296 Ca -0.25 -0.45 0.04 0.00 1.00 0.00 0.00 64.86 65.20 1qni h ILE 296 Cb 1.10 1.26 -0.05 0.00 -0.74 0.00 0.00 36.82 38.39 1qni h ILE 296 CO 0.86 0.12 0.59 -0.78 0.00 0.00 0.00 178.15 178.94 1qni h ASP 297 N 0.00 0.96 0.86 1.72 1.82 -1.91 -2.12 116.42 117.75 1qni h ASP 297 Ca -0.00 -0.01 0.00 0.00 -0.39 0.00 0.00 57.03 56.63 1qni h ASP 297 Cb 0.25 -0.22 0.00 0.00 0.68 0.00 0.00 39.33 40.04 1qni h ASP 297 CO 0.02 0.65 -0.05 0.29 -1.61 0.00 0.00 179.24 178.54 1qni n LYS 298 N -4.45 0.10 -0.34 0.28 5.02 -1.01 -4.05 118.16 113.71 1qni n LYS 298 Ca 0.12 -0.01 0.03 0.00 -2.02 0.00 0.00 58.31 56.44 1qni n LYS 298 Cb 0.13 -1.50 0.21 0.00 -0.02 0.00 0.00 35.03 33.84 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 0.02 0.98 -0.50 -0.35 3.38 -1.45 -1.35 115.31 116.04 1qni h LEU 299 Ca 0.00 0.01 0.05 0.00 0.09 0.00 0.00 57.88 58.02 1qni h LEU 299 Cb 0.46 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.96 1qni h LEU 299 CO 0.00 0.63 0.25 0.44 0.09 0.00 0.00 178.44 179.84 1qni h ASP 300 N 1.11 0.35 -0.25 -0.43 3.32 -1.75 -1.68 116.42 117.09 1qni h ASP 300 Ca 0.42 0.03 -0.14 0.00 0.02 0.00 0.00 57.03 57.35 1qni h ASP 300 Cb 0.19 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.69 1qni h ASP 300 CO -0.16 0.24 -0.36 0.44 -1.72 0.00 0.00 179.24 177.68 1qni h ASP 301 N 0.49 0.82 -0.26 6.45 3.32 -1.70 -3.04 116.42 122.49 1qni h ASP 301 Ca 0.22 -0.36 -0.00 0.00 0.02 0.00 0.00 57.03 56.92 1qni h ASP 301 Cb 0.14 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.45 1qni h ASP 301 CO -0.16 1.10 0.16 0.25 -1.72 0.00 0.00 179.24 178.87 1qni h LEU 302 N 0.65 0.32 -1.00 1.55 5.85 -0.62 0.24 115.31 122.29 1qni h LEU 302 Ca 0.06 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.77 1qni h LEU 302 Cb 0.91 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.86 1qni h LEU 302 CO 0.08 0.25 0.00 0.49 -0.34 0.00 0.00 178.44 178.92 1qni n PHE 303 N -4.48 0.26 0.34 1.25 3.01 -0.69 -2.91 117.46 114.24 1qni n PHE 303 Ca 0.01 -0.13 0.04 0.00 1.01 0.00 0.00 57.45 58.38 1qni n PHE 303 Cb 0.08 0.00 -0.01 0.00 -0.01 0.00 0.00 39.48 39.54 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 0.23 2.63 -1.56 -1.08 4.07 0.71 -4.98 120.64 120.66 1qni n GLU 304 Ca 0.14 -0.44 -0.13 0.00 -0.06 0.00 0.00 57.16 56.67 1qni n GLU 304 Cb 0.27 -0.98 -0.04 0.00 -0.06 0.00 0.00 31.44 30.63 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 -0.45 -4.44 0.08 4.31 8.00 -0.45 -4.90 116.55 118.72 1qni n ASP 305 Ca 0.03 0.25 -0.10 0.00 0.71 0.00 0.00 54.79 55.67 1qni n ASP 305 Cb 0.15 -3.19 -0.03 0.00 -0.02 0.00 0.00 41.12 38.04 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 0.24 0.00 -1.24 1.57 -1.63 -3.47 116.57 112.03 1qni h LYS 306 Ca -0.27 -0.27 -0.57 0.00 -1.87 0.00 0.00 60.65 57.67 1qni h LYS 306 Cb 0.92 0.08 -0.11 0.00 0.08 0.00 0.00 32.23 33.20 1qni h LYS 306 CO 0.38 1.00 -0.43 0.44 -0.57 0.00 0.00 179.45 180.27 1qni n ILE 307 N -3.66 0.00 -3.24 1.86 -5.35 -1.26 -5.04 119.36 102.67 1qni n ILE 307 Ca -0.04 -2.14 -0.26 0.00 -0.27 0.00 0.00 62.75 60.04 1qni n ILE 307 Cb 0.83 0.51 -0.01 0.00 -1.74 0.00 0.00 39.64 39.23 1qni n ILE 307 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 1qni s GLU 308 N -3.57 3.53 0.14 6.28 2.56 -1.26 -4.84 118.70 121.53 1qni s GLU 308 Ca 0.05 -0.17 -0.18 0.00 0.00 0.00 0.00 54.97 54.67 1qni s GLU 308 Cb 0.00 -2.61 0.01 0.00 2.00 0.00 0.00 34.13 33.53 1qni s GLU 308 CO 0.03 0.10 1.73 -0.07 -0.56 0.00 0.00 175.26 176.50 1qni h LEU 309 N 0.88 -0.02 -0.22 2.70 3.38 -1.95 -1.63 115.31 118.45 1qni h LEU 309 Ca -0.49 0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.53 1qni h LEU 309 Cb 1.21 0.07 0.00 0.00 0.09 0.00 0.00 40.66 42.03 1qni h LEU 309 CO 0.63 0.03 0.00 0.54 0.09 0.00 0.00 178.44 179.72 1qni n ARG 310 N -5.10 0.10 0.23 1.13 5.12 -1.26 -3.04 116.66 113.83 1qni n ARG 310 Ca -0.01 0.26 0.16 0.00 -1.93 0.00 0.00 57.85 56.33 1qni n ARG 310 Cb 0.12 -1.66 0.79 0.00 -1.16 0.00 0.00 32.46 30.55 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 1.85 0.55 3.32 -1.68 -0.87 116.42 119.59 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 0.40 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.95 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 -2.83 0.35 1.35 -1.66 -3.44 112.91 106.68 1qni h THR 312 Ca 0.00 -0.93 -0.57 0.00 -0.55 0.00 0.00 66.41 64.37 1qni h THR 312 Cb 0.15 1.93 -0.03 0.00 -1.73 0.00 0.00 68.15 68.46 1qni h THR 312 CO 0.00 0.00 1.12 -0.63 -0.25 0.00 0.00 175.52 175.76 1qni s ILE 313 N -3.28 3.73 -0.53 6.82 -1.09 -0.33 -1.80 121.20 124.72 1qni s ILE 313 Ca 0.06 0.82 0.23 0.00 -2.23 0.00 0.00 60.65 59.52 1qni s ILE 313 Cb 0.06 -3.78 -0.13 0.00 -1.58 0.00 0.00 42.46 37.02 1qni s ILE 313 CO 0.65 -0.35 0.97 0.52 -1.23 0.00 0.00 174.94 175.49 1qni n VAL 314 N 6.53 0.18 -3.60 2.92 0.31 -0.21 -4.98 118.33 119.49 1qni n VAL 314 Ca 0.19 -0.29 -0.06 0.00 -0.01 0.00 0.00 64.34 64.17 1qni n VAL 314 Cb 0.46 0.17 -0.02 0.00 -0.91 0.00 0.00 33.84 33.54 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 -3.24 -1.80 -0.41 3.52 0.00 -1.23 -4.52 121.76 114.08 1qni s ALA 315 Ca 0.02 0.74 0.06 0.00 0.00 0.00 0.00 51.96 52.78 1qni s ALA 315 Cb 0.14 0.46 0.32 0.00 0.00 0.00 0.00 23.12 24.04 1qni s ALA 315 CO 0.81 -0.82 1.22 -1.91 0.00 0.00 0.00 175.76 175.07 1qni n GLU 316 N -0.32 0.85 -2.05 0.00 2.13 -1.25 -1.34 120.64 118.65 1qni n GLU 316 Ca -0.07 -1.59 -0.41 0.00 0.66 0.00 0.00 57.16 55.74 1qni n GLU 316 Cb 0.61 -0.53 -0.02 0.00 0.27 0.00 0.00 31.44 31.77 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 0.19 4.29 -0.01 5.31 0.04 -1.21 -4.58 135.00 139.03 1qni s PRO 317 Ca 0.20 2.26 -0.30 0.00 0.04 0.00 0.00 61.00 63.20 1qni s PRO 317 Cb 0.30 -3.12 -0.03 0.00 0.04 0.00 0.00 34.50 31.69 1qni s PRO 317 CO -0.08 -0.37 1.05 -2.00 0.04 0.00 0.00 177.00 175.64 1qni s GLU 318 N -0.52 4.49 0.00 4.56 2.12 -1.26 -2.77 118.70 125.32 1qni s GLU 318 Ca 0.58 1.52 0.00 0.00 0.36 0.00 0.00 54.97 57.43 1qni s GLU 318 Cb -0.41 -3.46 0.00 0.00 0.26 0.00 0.00 34.13 30.53 1qni s GLU 318 CO 0.44 -0.17 0.00 1.28 -0.54 0.00 0.00 175.26 176.26 1qni n LEU 319 N 4.20 0.35 0.00 2.70 4.77 0.32 -4.97 117.00 124.36 1qni n LEU 319 Ca 0.08 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.06 1qni n LEU 319 Cb 0.49 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.58 1qni n LEU 319 CO 0.53 0.06 0.00 0.61 -1.33 0.00 0.00 177.39 177.26 1qni n GLY 320 N 2.99 -2.04 3.71 -0.72 0.00 -1.01 -5.05 105.19 103.07 1qni n GLY 320 Ca 0.00 -1.33 -0.42 0.00 0.00 0.00 0.00 46.02 44.27 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 4.37 -0.57 0.99 1.43 -1.26 -4.13 118.68 119.51 1qni s LEU 321 Ca 0.00 1.62 -0.01 0.00 -1.03 0.00 0.00 54.13 54.71 1qni s LEU 321 Cb 0.00 -3.52 -0.01 0.00 0.03 0.00 0.00 46.19 42.69 1qni s LEU 321 CO 0.00 -0.23 0.48 0.61 0.23 0.00 0.00 176.35 177.44 1qni n GLY 322 N 2.87 0.01 3.66 -3.19 0.00 -1.18 -2.98 105.19 104.39 1qni n GLY 322 Ca 0.05 -0.12 -0.43 0.00 0.00 0.00 0.00 46.02 45.53 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 -4.44 4.24 -0.10 1.61 0.04 -1.24 0.12 135.00 135.23 1qni s PRO 323 Ca 0.05 1.67 -0.10 0.00 0.04 0.00 0.00 61.00 62.66 1qni s PRO 323 Cb -0.01 -3.75 -0.05 0.00 0.04 0.00 0.00 34.50 30.74 1qni s PRO 323 CO 0.36 -0.69 -0.21 1.28 0.04 0.00 0.00 177.00 177.78 1qni n LEU 324 N 6.49 1.44 -4.27 -3.56 4.77 -0.79 -0.08 117.00 121.01 1qni n LEU 324 Ca 0.14 0.23 -0.17 0.00 -0.03 0.00 0.00 56.01 56.18 1qni n LEU 324 Cb 0.45 -0.54 -0.10 0.00 -2.33 0.00 0.00 43.42 40.89 1qni n LEU 324 CO 0.56 -0.17 -0.43 -1.00 -1.33 0.00 0.00 177.39 175.01 1qni s HIS 325 N -2.45 1.41 0.00 -1.77 3.76 -1.26 -1.33 115.29 113.66 1qni s HIS 325 Ca -0.19 -0.64 0.02 0.00 -0.15 0.00 0.00 55.06 54.10 1qni s HIS 325 Cb 0.05 -0.71 -0.01 0.00 1.11 0.00 0.00 32.58 33.02 1qni s HIS 325 CO 0.27 0.17 -0.06 0.99 -0.85 0.00 0.00 174.74 175.26 1qni s THR 326 N -2.77 0.43 0.37 1.30 2.01 -1.26 -1.33 115.64 114.39 1qni s THR 326 Ca 0.15 -0.38 0.04 0.00 0.31 0.00 0.00 61.69 61.80 1qni s THR 326 Cb -0.01 -0.39 -0.03 0.00 0.01 0.00 0.00 72.50 72.07 1qni s THR 326 CO 0.03 0.02 0.16 0.28 -0.69 0.00 0.00 174.62 174.41 1qni s THR 327 N -0.36 0.47 0.04 -0.82 -1.32 0.18 -4.72 115.64 109.11 1qni s THR 327 Ca -0.00 -2.00 0.01 0.00 -1.21 0.00 0.00 61.69 58.49 1qni s THR 327 Cb -0.04 -2.42 -0.03 0.00 -1.51 0.00 0.00 72.50 68.50 1qni s THR 327 CO -0.00 0.00 -0.06 -0.36 -2.21 0.00 0.00 174.62 171.99 1qni s PHE 328 N -3.33 0.56 -0.71 9.09 0.40 -1.26 -1.36 117.98 121.37 1qni s PHE 328 Ca 0.29 -0.63 0.22 0.00 -0.60 0.00 0.00 56.93 56.21 1qni s PHE 328 Cb 0.03 -0.35 -0.10 0.00 0.51 0.00 0.00 43.02 43.11 1qni s PHE 328 CO 0.17 -0.16 0.91 -0.40 0.70 0.00 0.00 175.22 176.45 1qni n ASP 329 N 1.13 0.66 0.00 1.36 5.68 -1.14 -4.61 116.55 119.63 1qni n ASP 329 Ca -0.21 -0.51 0.00 0.00 -0.50 0.00 0.00 54.79 53.58 1qni n ASP 329 Cb 0.56 1.04 0.00 0.00 -1.14 0.00 0.00 41.12 41.58 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 1.42 0.53 0.12 6.12 0.00 -1.26 -2.07 105.19 110.04 1qni n GLY 330 Ca 0.02 -0.30 0.03 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.88 2.63 0.00 1.61 1.74 -1.26 -4.96 116.66 113.53 1qni n ARG 331 Ca 0.00 -1.84 0.00 0.00 -0.77 0.00 0.00 57.85 55.24 1qni n ARG 331 Cb 0.00 -1.17 0.00 0.00 -1.02 0.00 0.00 32.46 30.27 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 -0.58 0.25 3.90 -0.13 0.00 -1.26 -5.08 105.19 102.30 1qni n GLY 332 Ca 0.06 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.73 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 -1.97 6.38 0.11 1.61 0.01 -1.26 -1.92 114.94 117.91 1qni s ASN 333 Ca 0.00 0.39 0.09 0.00 -0.71 0.00 0.00 52.86 52.63 1qni s ASN 333 Cb 0.00 -2.02 -0.04 0.00 0.41 0.00 0.00 41.25 39.60 1qni s ASN 333 CO 0.00 0.29 -0.20 0.00 -1.51 0.00 0.00 177.10 175.67 1qni s ALA 334 N -1.27 2.59 -0.15 0.60 0.00 0.77 -2.87 121.76 121.44 1qni s ALA 334 Ca 0.25 -1.36 0.01 0.00 0.00 0.00 0.00 51.96 50.86 1qni s ALA 334 Cb -0.13 -0.60 0.02 0.00 0.00 0.00 0.00 23.12 22.42 1qni s ALA 334 CO 0.16 0.58 -0.15 0.71 0.00 0.00 0.00 175.76 177.05 1qni s TYR 335 N -1.09 2.24 0.03 0.00 1.51 -0.47 -0.80 117.35 118.77 1qni s TYR 335 Ca 0.17 -1.23 0.09 0.00 -1.01 0.00 0.00 57.07 55.08 1qni s TYR 335 Cb -0.10 -1.62 -0.03 0.00 -0.11 0.00 0.00 41.96 40.10 1qni s TYR 335 CO 0.08 -0.65 -0.26 0.99 -1.11 0.00 0.00 175.55 174.60 1qni s THR 336 N 1.35 2.08 0.08 -0.71 2.01 -0.22 -0.65 115.64 119.58 1qni s THR 336 Ca 0.02 -1.30 -0.19 0.00 0.31 0.00 0.00 61.69 60.54 1qni s THR 336 Cb -0.13 -1.76 -0.07 0.00 0.01 0.00 0.00 72.50 70.55 1qni s THR 336 CO -0.09 0.41 0.57 0.42 -0.69 0.00 0.00 174.62 175.24 1qni s THR 337 N -0.75 4.75 -0.35 -0.82 -4.23 -0.44 0.22 115.64 114.02 1qni s THR 337 Ca 0.11 1.17 0.02 0.00 -1.18 0.00 0.00 61.69 61.82 1qni s THR 337 Cb -0.10 -3.88 0.10 0.00 1.34 0.00 0.00 72.50 69.96 1qni s THR 337 CO 0.01 0.51 0.07 -0.76 -0.54 0.00 0.00 174.62 173.92 1qni s LEU 338 N -1.22 4.75 0.10 4.79 1.43 0.67 -1.88 118.68 127.32 1qni s LEU 338 Ca 0.30 -2.04 -0.33 0.00 -1.03 0.00 0.00 54.13 51.04 1qni s LEU 338 Cb -0.19 -1.67 -0.13 0.00 0.03 0.00 0.00 46.19 44.23 1qni s LEU 338 CO 0.19 -0.40 1.59 0.15 0.23 0.00 0.00 176.35 178.11 1qni h PHE 339 N 7.74 -1.20 0.23 0.29 3.57 0.91 0.14 116.94 128.61 1qni h PHE 339 Ca -0.08 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.43 1qni h PHE 339 Cb 1.03 0.49 0.00 0.00 2.79 0.00 0.00 35.95 40.26 1qni h PHE 339 CO 0.50 -0.56 -0.11 0.82 -2.23 0.00 0.00 178.31 176.73 1qni h ILE 340 N -0.78 0.84 0.00 1.41 2.04 -1.72 -2.78 117.51 116.52 1qni h ILE 340 Ca -0.02 -0.37 0.00 0.00 1.00 0.00 0.00 64.86 65.48 1qni h ILE 340 Cb 0.74 1.05 0.00 0.00 -0.74 0.00 0.00 36.82 37.87 1qni h ILE 340 CO -0.15 0.08 0.00 0.47 0.00 0.00 0.00 178.15 178.56 1qni n ASP 341 N -5.14 0.00 -3.56 1.72 8.00 -1.20 -4.92 116.55 111.45 1qni n ASP 341 Ca -0.09 -0.09 -0.22 0.00 0.71 0.00 0.00 54.79 55.10 1qni n ASP 341 Cb 0.20 -0.25 0.02 0.00 -0.02 0.00 0.00 41.12 41.08 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 -1.25 -5.82 -3.57 -2.24 2.88 0.43 -4.87 113.62 99.19 1qni n SER 342 Ca 0.10 -0.78 -0.07 0.00 -1.33 0.00 0.00 58.87 56.79 1qni n SER 342 Cb 0.15 -3.42 -0.02 0.00 -0.75 0.00 0.00 64.21 60.17 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 -5.01 0.87 -0.15 -1.46 -2.07 -0.90 -1.20 119.66 109.74 1qni s GLN 343 Ca 0.25 -0.37 -0.07 0.00 -1.82 0.00 0.00 55.36 53.34 1qni s GLN 343 Cb -0.09 0.37 -0.04 0.00 -1.09 0.00 0.00 33.01 32.16 1qni s GLN 343 CO 0.84 -0.39 0.10 0.08 -1.32 0.00 0.00 175.29 174.60 1qni s VAL 344 N -3.11 5.11 -0.25 3.63 1.01 -0.11 -0.24 120.40 126.44 1qni s VAL 344 Ca 0.07 0.07 -0.01 0.00 0.00 0.00 0.00 61.98 62.11 1qni s VAL 344 Cb -0.01 -3.26 0.03 0.00 0.00 0.00 0.00 36.38 33.14 1qni s VAL 344 CO -0.06 0.53 -0.06 0.00 0.00 0.00 0.00 175.10 175.51 1qni s LYS 346 N 1.30 4.22 -0.01 0.00 2.20 -0.07 -1.06 119.74 126.32 1qni s LYS 346 Ca -0.01 0.42 -0.07 0.00 -0.36 0.00 0.00 55.97 55.95 1qni s LYS 346 Cb -0.17 -3.54 0.00 0.00 -1.51 0.00 0.00 37.83 32.61 1qni s LYS 346 CO -0.04 -0.09 0.13 1.67 -0.36 0.00 0.00 175.35 176.66 1qni s TRP 347 N 1.44 0.02 -0.06 4.03 1.48 0.02 -0.75 118.94 125.11 1qni s TRP 347 Ca 0.24 -0.06 -0.24 0.00 -1.06 0.00 0.00 56.10 54.98 1qni s TRP 347 Cb -0.15 -0.04 -0.04 0.00 -1.16 0.00 0.00 33.47 32.08 1qni s TRP 347 CO 0.10 -0.25 0.73 1.21 -4.06 0.00 0.00 176.95 174.68 1qni s ASN 348 N -1.16 7.03 0.17 -2.66 3.84 -0.56 -0.16 114.94 121.44 1qni s ASN 348 Ca -0.13 1.24 -0.08 0.00 0.21 0.00 0.00 52.86 54.10 1qni s ASN 348 Cb -0.07 -2.43 0.04 0.00 -0.55 0.00 0.00 41.25 38.25 1qni s ASN 348 CO 0.01 -0.14 1.54 0.40 -2.79 0.00 0.00 177.10 176.12 1qni h ILE 349 N 4.77 1.27 0.32 -5.21 2.04 -1.73 -2.53 117.51 116.44 1qni h ILE 349 Ca -0.41 -1.48 -0.02 0.00 1.00 0.00 0.00 64.86 63.96 1qni h ILE 349 Cb 1.20 1.30 0.00 0.00 -0.74 0.00 0.00 36.82 38.58 1qni h ILE 349 CO 0.75 0.50 -0.15 0.00 0.00 0.00 0.00 178.15 179.25 1qni h ALA 350 N 0.89 -0.43 -0.83 1.87 0.00 -1.94 -0.05 119.26 118.78 1qni h ALA 350 Ca 0.08 -0.10 0.07 0.00 0.00 0.00 0.00 54.91 54.96 1qni h ALA 350 Cb 0.88 0.17 -0.05 0.00 0.00 0.00 0.00 17.79 18.78 1qni h ALA 350 CO 0.08 -0.73 0.54 -0.44 0.00 0.00 0.00 179.25 178.70 1qni h ASP 351 N -0.45 0.79 -0.42 0.00 3.32 -1.94 0.19 116.42 117.92 1qni h ASP 351 Ca -0.04 0.01 -0.06 0.00 0.02 0.00 0.00 57.03 56.96 1qni h ASP 351 Cb 0.34 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.71 1qni h ASP 351 CO 0.07 0.50 0.07 0.00 -1.72 0.00 0.00 179.24 178.16 1qni h ALA 352 N 1.55 1.19 0.22 3.45 0.00 -1.03 0.71 119.26 125.35 1qni h ALA 352 Ca 0.36 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 1qni h ALA 352 Cb 0.26 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1qni h ALA 352 CO -0.13 0.54 -0.10 0.82 0.00 0.00 0.00 179.25 180.37 1qni h ILE 353 N 0.74 0.85 0.07 0.00 2.04 0.12 -1.94 117.51 119.39 1qni h ILE 353 Ca 0.16 -0.37 0.02 0.00 1.00 0.00 0.00 64.86 65.67 1qni h ILE 353 Cb 0.36 1.07 -0.04 0.00 -0.74 0.00 0.00 36.82 37.47 1qni h ILE 353 CO 0.01 0.08 -0.25 0.11 0.00 0.00 0.00 178.15 178.10 1qni h LYS 354 N -0.47 -0.41 -0.47 2.37 1.57 -0.28 -1.99 116.57 116.88 1qni h LYS 354 Ca -0.03 0.03 0.14 0.00 -1.87 0.00 0.00 60.65 58.92 1qni h LYS 354 Cb 0.36 0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.74 1qni h LYS 354 CO 0.05 -0.28 0.35 1.25 -0.57 0.00 0.00 179.45 180.26 1qni h HIS 355 N -0.43 0.00 0.00 -1.35 2.76 0.45 0.20 115.15 116.78 1qni h HIS 355 Ca 0.04 0.00 -0.12 0.00 -2.20 0.00 0.00 60.37 58.09 1qni h HIS 355 Cb 0.48 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 29.42 1qni h HIS 355 CO -0.25 0.00 -0.57 -0.92 -1.30 0.00 0.00 177.93 174.89 1qni h TYR 356 N 0.00 0.00 0.00 5.26 3.20 -0.60 -3.10 116.97 121.73 1qni h TYR 356 Ca 0.22 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.09 1qni h TYR 356 Cb 0.93 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.20 1qni h TYR 356 CO 0.00 0.57 0.00 0.09 -1.64 0.00 0.00 178.16 177.18 1qni n ASN 357 N -3.43 0.17 0.00 -2.11 3.02 0.03 -4.87 115.26 108.07 1qni n ASN 357 Ca 0.00 0.52 0.00 0.00 -0.03 0.00 0.00 54.58 55.07 1qni n ASN 357 Cb 0.68 -0.56 0.00 0.00 -0.61 0.00 0.00 39.78 39.29 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 1.39 0.90 2.19 7.41 0.00 -1.13 -5.12 105.19 110.82 1qni n GLY 358 Ca 0.07 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.88 1qni n GLY 358 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1qni n ASP 359 N 0.00 -3.20 -0.04 1.61 -0.08 -1.03 -4.98 116.55 108.82 1qni n ASP 359 Ca 0.00 -0.66 0.01 0.00 -1.51 0.00 0.00 54.79 52.63 1qni n ASP 359 Cb 0.00 -0.68 0.01 0.00 2.34 0.00 0.00 41.12 42.79 1qni n ASP 359 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 1qni n ARG 360 N -4.46 1.27 -1.17 -0.67 1.74 -1.26 -4.70 116.66 107.41 1qni n ARG 360 Ca 0.10 -1.06 -0.33 0.00 -0.77 0.00 0.00 57.85 55.78 1qni n ARG 360 Cb 0.41 -0.76 0.12 0.00 -1.02 0.00 0.00 32.46 31.20 1qni n ARG 360 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1qni s VAL 361 N -0.58 2.37 -0.43 1.55 1.01 -1.26 -4.99 120.40 118.07 1qni s VAL 361 Ca 0.02 0.15 -0.17 0.00 0.00 0.00 0.00 61.98 61.98 1qni s VAL 361 Cb 0.02 -2.52 0.03 0.00 0.00 0.00 0.00 36.38 33.90 1qni s VAL 361 CO 0.00 -0.12 0.44 0.20 0.00 0.00 0.00 175.10 175.61 1qni s ASN 362 N -2.42 6.18 0.03 3.32 0.02 -1.26 -4.82 114.94 115.99 1qni s ASN 362 Ca 0.70 -0.80 -0.00 0.00 -1.02 0.00 0.00 52.86 51.73 1qni s ASN 362 Cb -0.25 -2.22 -0.26 0.00 0.02 0.00 0.00 41.25 38.53 1qni s ASN 362 CO 0.51 -0.61 0.95 0.10 0.02 0.00 0.00 177.10 178.07 1qni h TYR 363 N 8.75 0.36 -2.74 2.20 -0.00 -1.88 -3.45 116.97 120.20 1qni h TYR 363 Ca -0.27 -0.26 -0.55 0.00 0.00 0.00 0.00 58.73 57.65 1qni h TYR 363 Cb 1.11 -0.01 -0.01 0.00 0.00 0.00 0.00 36.73 37.81 1qni h TYR 363 CO 0.63 1.28 0.99 0.42 -0.00 0.00 0.00 178.16 181.47 1qni s ILE 364 N -2.64 3.74 -0.17 -0.90 1.01 -1.26 -1.49 121.20 119.48 1qni s ILE 364 Ca -0.06 0.96 0.18 0.00 0.00 0.00 0.00 60.65 61.74 1qni s ILE 364 Cb 0.07 -3.62 -0.26 0.00 0.01 0.00 0.00 42.46 38.66 1qni s ILE 364 CO 0.85 -0.06 0.14 0.54 0.00 0.00 0.00 174.94 176.41 1qni n ARG 365 N 6.56 0.68 -3.57 2.79 5.12 0.07 -4.98 116.66 123.33 1qni n ARG 365 Ca 0.16 -0.03 -0.07 0.00 -1.93 0.00 0.00 57.85 55.97 1qni n ARG 365 Cb 0.43 -1.53 -0.03 0.00 -1.16 0.00 0.00 32.46 30.17 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 -2.64 0.53 -0.06 5.56 0.74 -1.01 -5.00 119.66 117.77 1qni s GLN 366 Ca -0.10 -0.05 -0.01 0.00 0.05 0.00 0.00 55.36 55.25 1qni s GLN 366 Cb 0.07 0.24 0.03 0.00 1.10 0.00 0.00 33.01 34.45 1qni s GLN 366 CO 0.84 -0.20 -0.01 0.15 -0.55 0.00 0.00 175.29 175.52 1qni s LYS 367 N -1.97 0.64 -0.18 1.67 1.02 -1.26 -0.89 119.74 118.76 1qni s LYS 367 Ca 0.04 0.06 -0.02 0.00 0.02 0.00 0.00 55.97 56.07 1qni s LYS 367 Cb -0.01 -0.91 -0.01 0.00 -0.52 0.00 0.00 37.83 36.38 1qni s LYS 367 CO -0.04 -0.25 -0.10 -1.17 -0.92 0.00 0.00 175.35 172.88 1qni s LEU 368 N 1.69 2.73 -0.21 3.17 0.20 -0.07 -4.95 118.68 121.24 1qni s LEU 368 Ca 0.01 -0.40 -0.29 0.00 0.69 0.00 0.00 54.13 54.14 1qni s LEU 368 Cb -0.13 -1.66 -0.04 0.00 -0.43 0.00 0.00 46.19 43.93 1qni s LEU 368 CO -0.04 0.05 1.99 -1.81 -0.29 0.00 0.00 176.35 176.26 1qni s ASP 369 N 1.04 5.84 0.23 3.68 1.01 -1.26 -0.94 116.67 126.27 1qni s ASP 369 Ca -0.00 1.83 -0.14 0.00 0.71 0.00 0.00 52.55 54.95 1qni s ASP 369 Cb -0.15 -2.52 -0.08 0.00 1.01 0.00 0.00 42.92 41.19 1qni s ASP 369 CO -0.01 -1.66 0.63 -0.69 0.21 0.00 0.00 175.17 173.65 1qni s VAL 370 N 6.95 4.77 -1.13 -1.27 1.01 -0.34 -4.93 120.40 125.46 1qni s VAL 370 Ca 0.90 0.85 -0.21 0.00 0.00 0.00 0.00 61.98 63.51 1qni s VAL 370 Cb -0.31 -3.69 0.03 0.00 0.00 0.00 0.00 36.38 32.42 1qni s VAL 370 CO 0.35 0.03 1.66 -1.10 0.00 0.00 0.00 175.10 176.03 1qni s GLN 371 N -2.49 3.52 -0.07 2.72 1.11 -1.26 -4.52 119.66 118.67 1qni s GLN 371 Ca 0.46 -1.37 -0.05 0.00 0.01 0.00 0.00 55.36 54.41 1qni s GLN 371 Cb -0.13 -5.39 0.02 0.00 -1.01 0.00 0.00 33.01 26.50 1qni s GLN 371 CO 0.19 -2.53 0.09 0.66 0.01 0.00 0.00 175.29 173.72 1qni n TYR 372 N 9.78 -2.32 -2.97 0.91 4.01 -1.26 -4.67 117.16 120.64 1qni n TYR 372 Ca 0.41 1.36 -0.01 0.00 -0.16 0.00 0.00 57.90 59.50 1qni n TYR 372 Cb 0.48 -2.78 -0.01 0.00 -0.31 0.00 0.00 39.34 36.72 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 0.88 -1.90 -2.47 -0.72 3.00 -1.26 -2.77 117.38 112.13 1qni n GLN 373 Ca -0.16 1.75 -0.33 0.00 -0.01 0.00 0.00 57.00 58.25 1qni n GLN 373 Cb 0.24 -2.56 -0.03 0.00 0.00 0.00 0.00 30.24 27.89 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 -0.86 3.79 0.00 -1.09 0.02 -1.26 0.09 135.00 135.70 1qni s PRO 374 Ca -0.04 1.24 0.00 0.00 0.02 0.00 0.00 61.00 62.21 1qni s PRO 374 Cb 0.00 -2.10 0.00 0.00 0.02 0.00 0.00 34.50 32.42 1qni s PRO 374 CO 0.30 -0.42 0.00 0.41 -0.33 0.00 0.00 177.00 176.96 1qni n GLY 375 N -0.63 1.15 3.84 0.52 0.00 -0.04 -4.39 105.19 105.65 1qni n GLY 375 Ca 0.08 -0.03 -0.32 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 1.12 3.43 0.03 1.61 3.76 -1.24 -4.09 115.29 119.91 1qni s HIS 376 Ca 0.00 1.45 0.07 0.00 -0.15 0.00 0.00 55.06 56.43 1qni s HIS 376 Cb 0.00 -2.77 -0.02 0.00 1.11 0.00 0.00 32.58 30.90 1qni s HIS 376 CO 0.00 -0.31 -0.19 1.21 -0.85 0.00 0.00 174.74 174.60 1qni s ASN 377 N -2.95 2.27 -0.21 1.40 2.47 -1.26 -1.98 114.94 114.67 1qni s ASN 377 Ca 0.59 -0.47 -0.09 0.00 0.42 0.00 0.00 52.86 53.30 1qni s ASN 377 Cb -0.10 -0.20 0.08 0.00 -1.45 0.00 0.00 41.25 39.59 1qni s ASN 377 CO 0.29 0.15 0.49 -2.28 -3.72 0.00 0.00 177.10 172.03 1qni s HIS 378 N -0.73 -0.85 -0.12 0.43 2.46 -0.05 -4.73 115.29 111.69 1qni s HIS 378 Ca 0.06 1.65 -0.01 0.00 0.47 0.00 0.00 55.06 57.24 1qni s HIS 378 Cb -0.08 0.41 -0.02 0.00 -0.13 0.00 0.00 32.58 32.76 1qni s HIS 378 CO 0.01 -0.47 -0.10 0.00 -2.47 0.00 0.00 174.74 171.71 1qni s ALA 379 N 2.12 2.75 -0.44 1.58 0.00 -1.26 0.45 121.76 126.95 1qni s ALA 379 Ca -0.06 -0.88 -0.44 0.00 0.00 0.00 0.00 51.96 50.58 1qni s ALA 379 Cb -0.10 -1.28 -0.19 0.00 0.00 0.00 0.00 23.12 21.56 1qni s ALA 379 CO -0.15 0.30 1.49 -1.13 0.00 0.00 0.00 175.76 176.27 1qni n SER 380 N 3.30 1.06 -1.46 0.00 3.41 -0.52 -0.77 113.62 118.64 1qni n SER 380 Ca -0.18 1.13 -0.18 0.00 -0.26 0.00 0.00 58.87 59.39 1qni n SER 380 Cb 0.53 -0.84 -0.06 0.00 -0.26 0.00 0.00 64.21 63.57 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 3.63 -1.37 0.29 1.04 4.77 -1.25 -3.29 117.00 120.82 1qni n LEU 381 Ca 0.29 0.36 0.17 0.00 -0.03 0.00 0.00 56.01 56.80 1qni n LEU 381 Cb -0.05 -2.51 0.90 0.00 -2.33 0.00 0.00 43.42 39.44 1qni n LEU 381 CO 0.84 -0.80 1.07 0.00 -1.33 0.00 0.00 177.39 177.16 1qni h THR 382 N 0.00 0.31 -0.23 -5.08 1.03 -1.21 -2.41 112.91 105.32 1qni h THR 382 Ca -0.37 -0.29 0.00 0.00 -0.01 0.00 0.00 66.41 65.74 1qni h THR 382 Cb 1.18 1.21 0.00 0.00 -1.07 0.00 0.00 68.15 69.47 1qni h THR 382 CO 0.52 0.05 0.00 -0.62 -0.01 0.00 0.00 175.52 175.46 1qni n GLU 383 N -3.43 1.83 -4.47 0.00 1.02 -1.26 -4.31 120.64 110.01 1qni n GLU 383 Ca -0.02 -1.25 -0.22 0.00 -0.02 0.00 0.00 57.16 55.64 1qni n GLU 383 Cb 0.17 -1.38 -0.11 0.00 -0.02 0.00 0.00 31.44 30.10 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 -1.43 2.62 0.39 1.62 1.04 -0.92 -4.93 113.70 112.09 1qni s SER 384 Ca 0.31 -1.37 0.08 0.00 0.48 0.00 0.00 55.95 55.45 1qni s SER 384 Cb 0.17 -0.14 0.81 0.00 0.10 0.00 0.00 66.02 66.96 1qni s SER 384 CO 0.25 -0.57 1.98 0.03 0.98 0.00 0.00 173.24 175.91 1qni h ARG 385 N 2.07 0.41 -0.99 4.02 3.08 -1.42 -3.05 114.38 118.50 1qni h ARG 385 Ca -0.41 -0.06 -0.09 0.00 0.07 0.00 0.00 59.98 59.49 1qni h ARG 385 Cb 1.24 -0.08 -0.06 0.00 0.08 0.00 0.00 29.97 31.16 1qni h ARG 385 CO 0.71 0.38 0.12 -0.25 -1.07 0.00 0.00 179.97 179.86 1qni n ASP 386 N -4.38 3.02 -4.52 7.04 8.00 -1.26 -4.92 116.55 119.53 1qni n ASP 386 Ca 0.01 -2.31 -0.43 0.00 0.71 0.00 0.00 54.79 52.78 1qni n ASP 386 Cb 0.16 -0.56 -0.06 0.00 -0.02 0.00 0.00 41.12 40.64 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 0.17 1.06 0.99 2.24 0.00 -1.12 -4.81 120.51 119.04 1qni n ALA 387 Ca 0.11 -0.43 0.14 0.00 0.00 0.00 0.00 53.44 53.26 1qni n ALA 387 Cb 0.70 -2.83 0.53 0.00 0.00 0.00 0.00 19.45 17.85 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 12.44 0.14 -4.05 0.00 5.68 -1.21 -4.27 116.55 125.27 1qni n ASP 388 Ca 0.40 0.32 -0.29 0.00 -0.50 0.00 0.00 54.79 54.72 1qni n ASP 388 Cb 0.37 -0.32 -0.02 0.00 -1.14 0.00 0.00 41.12 40.00 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 1.50 -0.31 0.13 6.12 0.00 -0.88 -4.88 105.19 106.86 1qni n GLY 389 Ca 0.07 0.15 -0.19 0.00 0.00 0.00 0.00 46.02 46.04 1qni n GLY 389 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1qni n LYS 390 N -4.42 0.67 -4.25 1.61 3.00 -1.26 -3.56 118.16 109.94 1qni n LYS 390 Ca -0.16 0.18 -0.22 0.00 -0.00 0.00 0.00 58.31 58.12 1qni n LYS 390 Cb 0.61 -1.55 -0.12 0.00 0.00 0.00 0.00 35.03 33.96 1qni n LYS 390 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.40 175.82 1qni s TRP 391 N -2.52 1.60 -0.03 5.64 0.52 -1.26 -2.64 118.94 120.25 1qni s TRP 391 Ca -0.33 -0.44 0.02 0.00 0.02 0.00 0.00 56.10 55.36 1qni s TRP 391 Cb 0.09 -0.87 0.01 0.00 -1.15 0.00 0.00 33.47 31.54 1qni s TRP 391 CO 0.62 0.17 -0.07 -1.17 0.02 0.00 0.00 176.95 176.52 1qni s LEU 392 N -1.97 1.68 -0.09 2.99 2.96 0.66 -1.44 118.68 123.47 1qni s LEU 392 Ca 0.05 -0.16 0.03 0.00 -0.22 0.00 0.00 54.13 53.84 1qni s LEU 392 Cb -0.09 -0.48 0.00 0.00 0.50 0.00 0.00 46.19 46.12 1qni s LEU 392 CO 0.04 0.03 -0.21 -0.69 -1.32 0.00 0.00 176.35 174.20 1qni s VAL 393 N 0.37 1.83 -0.17 1.68 1.01 0.17 0.67 120.40 125.96 1qni s VAL 393 Ca -0.05 -0.88 0.01 0.00 0.00 0.00 0.00 61.98 61.06 1qni s VAL 393 Cb -0.10 -1.60 0.01 0.00 0.00 0.00 0.00 36.38 34.70 1qni s VAL 393 CO 0.00 0.51 -0.19 -0.69 0.00 0.00 0.00 175.10 174.73 1qni s VAL 394 N 0.46 2.19 -0.48 2.92 1.01 -0.52 -0.88 120.40 125.11 1qni s VAL 394 Ca -0.17 -0.91 -0.09 0.00 0.00 0.00 0.00 61.98 60.80 1qni s VAL 394 Cb -0.17 -1.91 0.12 0.00 0.00 0.00 0.00 36.38 34.42 1qni s VAL 394 CO 0.07 0.53 0.36 -0.76 0.00 0.00 0.00 175.10 175.30 1qni s LEU 395 N 1.10 5.74 0.52 3.92 1.02 -0.84 0.05 118.68 130.19 1qni s LEU 395 Ca 0.00 -1.94 -0.12 0.00 0.02 0.00 0.00 54.13 52.09 1qni s LEU 395 Cb -0.14 -2.02 -0.06 0.00 0.02 0.00 0.00 46.19 43.99 1qni s LEU 395 CO -0.08 -0.70 0.93 -0.44 0.02 0.00 0.00 176.35 176.09 1qni s SER 396 N 2.68 6.42 0.00 2.29 0.01 -0.41 -0.86 113.70 123.84 1qni s SER 396 Ca 0.06 1.35 0.24 0.00 1.31 0.00 0.00 55.95 58.91 1qni s SER 396 Cb -0.26 -2.42 0.21 0.00 0.21 0.00 0.00 66.02 63.75 1qni s SER 396 CO -0.01 -0.64 1.25 0.29 0.41 0.00 0.00 173.24 174.54 1qni n LYS 397 N -2.01 1.87 -4.02 12.44 4.76 0.11 -3.26 118.16 128.05 1qni n LYS 397 Ca 0.05 -1.51 -0.12 0.00 -2.87 0.00 0.00 58.31 53.86 1qni n LYS 397 Cb 0.54 -1.47 -0.13 0.00 -1.84 0.00 0.00 35.03 32.14 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 -2.17 0.37 0.00 2.13 0.08 -1.12 -4.89 117.98 112.38 1qni s PHE 398 Ca 0.25 -0.31 0.00 0.00 0.12 0.00 0.00 56.93 56.99 1qni s PHE 398 Cb 0.19 -0.24 0.00 0.00 -0.57 0.00 0.00 43.02 42.41 1qni s PHE 398 CO 0.40 -0.08 0.00 -1.13 -0.10 0.00 0.00 175.22 174.31 1qni n SER 399 N 2.18 4.40 0.00 1.36 3.41 -1.25 -4.39 113.62 119.32 1qni n SER 399 Ca -0.19 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.42 1qni n SER 399 Cb 0.57 0.86 0.00 0.00 -0.26 0.00 0.00 64.21 65.38 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 -1.34 0.00 -0.00 4.33 5.02 -1.26 0.76 118.16 125.67 1qni n LYS 400 Ca 0.00 0.00 0.13 0.00 -2.02 0.00 0.00 58.31 56.42 1qni n LYS 400 Cb 0.02 0.00 0.21 0.00 -0.02 0.00 0.00 35.03 35.24 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 3.06 2.61 0.17 4.39 5.75 -1.26 -4.52 116.55 126.75 1qni n ASP 401 Ca 0.00 -1.87 0.13 0.00 -0.01 0.00 0.00 54.79 53.04 1qni n ASP 401 Cb 0.00 -0.00 0.68 0.00 -1.03 0.00 0.00 41.12 40.77 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 4.08 0.00 -4.83 0.11 2.47 -0.06 -3.45 114.38 112.70 1qni h ARG 402 Ca 0.00 0.00 -0.36 0.00 -1.26 0.00 0.00 59.98 58.36 1qni h ARG 402 Cb 0.87 0.00 -0.14 0.00 -1.65 0.00 0.00 29.97 29.04 1qni h ARG 402 CO 0.00 0.00 -0.58 -0.06 0.56 0.00 0.00 179.97 179.89 1qni s PHE 403 N -5.00 1.50 0.36 3.04 0.08 -1.26 -5.11 117.98 111.59 1qni s PHE 403 Ca -0.05 -1.33 -0.28 0.00 0.12 0.00 0.00 56.93 55.39 1qni s PHE 403 Cb 0.18 -0.81 -0.12 0.00 -0.57 0.00 0.00 43.02 41.70 1qni s PHE 403 CO 0.67 -0.50 1.37 1.28 -0.10 0.00 0.00 175.22 177.94 1qni n LEU 404 N -0.49 4.03 -4.76 -0.37 4.77 -1.26 -4.90 117.00 114.02 1qni n LEU 404 Ca 0.01 1.22 -0.41 0.00 -0.03 0.00 0.00 56.01 56.80 1qni n LEU 404 Cb 0.65 -1.54 -0.01 0.00 -2.33 0.00 0.00 43.42 40.20 1qni n LEU 404 CO 0.35 -0.23 1.17 -2.16 -1.33 0.00 0.00 177.39 175.19 1qni s PRO 405 N -1.96 4.15 -0.04 3.23 0.04 -1.26 -4.91 135.00 134.24 1qni s PRO 405 Ca 0.55 2.53 0.13 0.00 0.04 0.00 0.00 61.00 64.24 1qni s PRO 405 Cb -0.53 -3.01 0.25 0.00 0.04 0.00 0.00 34.50 31.24 1qni s PRO 405 CO 0.63 -0.54 1.11 1.33 0.04 0.00 0.00 177.00 179.57 1qni n VAL 406 N 1.36 0.52 0.00 -0.36 0.24 -1.26 -5.13 118.33 113.69 1qni n VAL 406 Ca 0.04 -1.06 0.00 0.00 -2.04 0.00 0.00 64.34 61.28 1qni n VAL 406 Cb 0.39 0.50 0.00 0.00 -1.47 0.00 0.00 33.84 33.25 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 -0.14 1.69 0.50 7.63 0.00 -1.26 -4.66 105.19 108.94 1qni n GLY 407 Ca 0.07 -2.06 0.36 0.00 0.00 0.00 0.00 46.02 44.38 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 0.13 -5.99 1.61 0.11 -2.04 -3.36 132.00 122.46 1qni h PRO 408 Ca 0.00 -0.01 -0.57 0.00 0.11 0.00 0.00 66.00 65.53 1qni h PRO 408 Cb 0.00 -0.03 -0.06 0.00 0.11 0.00 0.00 31.00 31.02 1qni h PRO 408 CO 0.00 0.08 0.28 -1.17 -0.21 0.00 0.00 178.00 176.98 1qni s LEU 409 N -9.11 4.23 0.11 2.35 0.20 -1.26 -5.05 118.68 110.15 1qni s LEU 409 Ca -0.07 1.19 0.06 0.00 0.69 0.00 0.00 54.13 56.00 1qni s LEU 409 Cb 0.27 -3.19 -0.04 0.00 -0.43 0.00 0.00 46.19 42.80 1qni s LEU 409 CO 0.82 -0.29 -0.03 -1.00 -0.29 0.00 0.00 176.35 175.56 1qni s HIS 410 N 1.63 2.89 0.67 5.38 3.76 -1.26 -4.65 115.29 123.70 1qni s HIS 410 Ca 0.38 -0.09 -0.11 0.00 -0.15 0.00 0.00 55.06 55.09 1qni s HIS 410 Cb -0.17 -1.47 -0.01 0.00 1.11 0.00 0.00 32.58 32.04 1qni s HIS 410 CO 0.15 0.47 1.06 -1.25 -0.85 0.00 0.00 174.74 174.33 1qni s PRO 411 N -2.44 3.19 0.73 8.40 0.04 -1.26 -4.93 135.00 138.73 1qni s PRO 411 Ca 0.25 0.59 -0.08 0.00 0.04 0.00 0.00 61.00 61.80 1qni s PRO 411 Cb -0.11 -2.05 0.07 0.00 0.04 0.00 0.00 34.50 32.45 1qni s PRO 411 CO 0.17 -0.82 1.05 -1.21 0.04 0.00 0.00 177.00 176.23 1qni s GLU 412 N -5.27 2.13 -0.25 4.56 0.41 0.21 -3.93 118.70 116.56 1qni s GLU 412 Ca 0.57 -0.18 -0.01 0.00 -0.41 0.00 0.00 54.97 54.94 1qni s GLU 412 Cb -0.11 -2.12 0.07 0.00 -1.78 0.00 0.00 34.13 30.19 1qni s GLU 412 CO 0.53 -1.33 0.02 1.21 -0.49 0.00 0.00 175.26 175.21 1qni s ASN 413 N -4.53 3.66 -0.43 -0.19 2.47 -1.20 -1.43 114.94 113.28 1qni s ASN 413 Ca 0.61 -1.25 -0.16 0.00 0.42 0.00 0.00 52.86 52.48 1qni s ASN 413 Cb -0.11 -0.93 0.04 0.00 -1.45 0.00 0.00 41.25 38.80 1qni s ASN 413 CO 0.46 -0.32 0.36 -1.81 -3.72 0.00 0.00 177.10 172.07 1qni s ASP 414 N 1.58 6.14 -0.09 -4.21 1.01 -0.30 -1.29 116.67 119.51 1qni s ASP 414 Ca 0.01 -0.97 -0.16 0.00 0.71 0.00 0.00 52.55 52.14 1qni s ASP 414 Cb -0.18 -2.18 -0.05 0.00 1.01 0.00 0.00 42.92 41.52 1qni s ASP 414 CO -0.12 -0.54 0.41 -1.10 0.21 0.00 0.00 175.17 174.03 1qni s GLN 415 N 1.78 4.18 -0.21 8.23 -0.21 0.11 -1.48 119.66 132.06 1qni s GLN 415 Ca 0.06 0.35 -0.20 0.00 0.02 0.00 0.00 55.36 55.60 1qni s GLN 415 Cb -0.20 -3.36 -0.03 0.00 1.00 0.00 0.00 33.01 30.42 1qni s GLN 415 CO 0.10 0.35 0.58 -1.17 -2.12 0.00 0.00 175.29 173.03 1qni s LEU 416 N 0.03 4.13 -0.05 2.90 2.96 0.65 -1.43 118.68 127.87 1qni s LEU 416 Ca 0.23 0.74 0.06 0.00 -0.22 0.00 0.00 54.13 54.94 1qni s LEU 416 Cb -0.15 -2.80 -0.01 0.00 0.50 0.00 0.00 46.19 43.73 1qni s LEU 416 CO 0.10 -0.24 -0.23 -0.63 -1.32 0.00 0.00 176.35 174.02 1qni s ILE 417 N 1.87 1.92 -0.20 6.68 1.01 0.21 -1.14 121.20 131.56 1qni s ILE 417 Ca 0.26 -1.00 -0.25 0.00 0.00 0.00 0.00 60.65 59.66 1qni s ILE 417 Cb -0.16 -1.63 -0.01 0.00 0.01 0.00 0.00 42.46 40.67 1qni s ILE 417 CO 0.10 0.54 0.83 -0.62 0.00 0.00 0.00 174.94 175.79 1qni s ASP 418 N -0.15 6.91 -0.06 3.58 -1.08 -0.08 -0.25 116.67 125.55 1qni s ASP 418 Ca -0.03 1.13 0.09 0.00 -0.52 0.00 0.00 52.55 53.22 1qni s ASP 418 Cb -0.13 -2.45 0.13 0.00 -1.46 0.00 0.00 42.92 39.01 1qni s ASP 418 CO 0.03 -0.45 1.03 2.30 0.52 0.00 0.00 175.17 178.61 1qni n ILE 419 N 4.94 1.25 0.51 4.11 -5.35 -1.08 -2.25 119.36 121.48 1qni n ILE 419 Ca 0.05 -1.42 0.07 0.00 -0.27 0.00 0.00 62.75 61.18 1qni n ILE 419 Cb 0.48 0.20 0.32 0.00 -1.74 0.00 0.00 39.64 38.90 1qni n ILE 419 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1qni n SER 420 N -0.85 0.00 -0.82 7.28 3.41 -1.19 -4.73 113.62 116.72 1qni n SER 420 Ca 0.07 0.50 0.00 0.00 -0.26 0.00 0.00 58.87 59.18 1qni n SER 420 Cb 0.48 -0.50 0.00 0.00 -0.26 0.00 0.00 64.21 63.94 1qni n SER 420 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1qni n GLY 421 N 0.03 4.08 0.13 5.00 0.00 -1.26 -5.02 105.19 108.15 1qni n GLY 421 Ca 0.04 -2.09 0.12 0.00 0.00 0.00 0.00 46.02 44.09 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 -5.46 1.61 4.81 -1.97 -3.45 114.58 110.12 1qni h GLU 422 Ca 0.00 0.00 -0.51 0.00 -0.13 0.00 0.00 59.36 58.72 1qni h GLU 422 Cb 0.00 0.00 -0.29 0.00 0.63 0.00 0.00 28.75 29.09 1qni h GLU 422 CO 0.00 0.00 -0.82 -1.21 -0.73 0.00 0.00 179.01 176.25 1qni s GLU 423 N -3.18 1.28 0.09 1.92 2.02 -1.26 -4.99 118.70 114.57 1qni s GLU 423 Ca 0.07 -0.56 -0.31 0.00 0.02 0.00 0.00 54.97 54.19 1qni s GLU 423 Cb 0.10 -1.23 -0.06 0.00 0.10 0.00 0.00 34.13 33.03 1qni s GLU 423 CO 0.67 0.34 1.24 -1.64 0.02 0.00 0.00 175.26 175.89 1qni s MET 424 N -0.36 4.42 -0.10 1.61 -1.94 -1.26 -4.76 119.30 116.91 1qni s MET 424 Ca 0.06 1.84 0.02 0.00 -1.71 0.00 0.00 55.69 55.90 1qni s MET 424 Cb -0.06 -3.31 0.02 0.00 2.01 0.00 0.00 34.83 33.48 1qni s MET 424 CO -0.01 -0.27 -0.13 0.15 -0.01 0.00 0.00 175.02 174.75 1qni s LYS 425 N 0.90 1.97 0.24 2.03 1.02 -0.96 -4.99 119.74 119.96 1qni s LYS 425 Ca 0.59 -0.48 -0.30 0.00 0.02 0.00 0.00 55.97 55.81 1qni s LYS 425 Cb -0.31 -1.70 -0.09 0.00 -0.52 0.00 0.00 37.83 35.20 1qni s LYS 425 CO 0.30 -0.06 1.31 -1.17 -0.92 0.00 0.00 175.35 174.82 1qni s LEU 426 N 0.97 4.42 0.00 3.17 2.96 -1.26 -0.90 118.68 128.05 1qni s LEU 426 Ca -0.08 2.48 0.00 0.00 -0.22 0.00 0.00 54.13 56.32 1qni s LEU 426 Cb -0.15 -3.62 0.00 0.00 0.50 0.00 0.00 46.19 42.92 1qni s LEU 426 CO -0.01 -0.52 0.00 0.52 -1.32 0.00 0.00 176.35 175.02 1qni n VAL 427 N 2.12 0.00 -3.67 1.68 0.31 -0.29 -4.89 118.33 113.59 1qni n VAL 427 Ca 0.04 0.00 -0.14 0.00 -0.01 0.00 0.00 64.34 64.24 1qni n VAL 427 Cb 0.42 -0.55 -0.08 0.00 -0.91 0.00 0.00 33.84 32.73 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 -1.74 -0.67 -0.30 3.52 5.65 -1.06 -4.99 115.29 115.70 1qni s HIS 428 Ca 0.00 1.64 -0.10 0.00 0.25 0.00 0.00 55.06 56.84 1qni s HIS 428 Cb 0.00 0.23 -0.02 0.00 -1.18 0.00 0.00 32.58 31.61 1qni s HIS 428 CO 0.00 -0.32 0.17 -0.51 -0.65 0.00 0.00 174.74 173.43 1qni s ASP 429 N 0.33 5.69 -0.32 9.88 1.01 -1.26 -0.25 116.67 131.75 1qni s ASP 429 Ca -0.00 -0.37 -0.07 0.00 0.71 0.00 0.00 52.55 52.82 1qni s ASP 429 Cb -0.04 -2.04 0.02 0.00 1.01 0.00 0.00 42.92 41.86 1qni s ASP 429 CO 0.01 -0.16 0.11 -0.83 0.21 0.00 0.00 175.17 174.51 1qni s GLY 430 N 1.66 1.82 0.14 0.21 0.00 -0.55 -4.98 107.32 105.64 1qni s GLY 430 Ca 0.06 -1.57 -0.30 0.00 0.00 0.00 0.00 44.72 42.90 1qni s GLY 430 CO 0.08 0.71 1.16 2.56 0.00 0.00 0.00 173.10 177.61 1qni s PRO 431 N 1.48 4.52 0.04 2.90 0.04 -1.26 -1.15 135.00 141.57 1qni s PRO 431 Ca 0.01 1.78 0.03 0.00 0.04 0.00 0.00 61.00 62.86 1qni s PRO 431 Cb -0.18 -3.29 -0.02 0.00 0.04 0.00 0.00 34.50 31.05 1qni s PRO 431 CO 0.03 -0.07 -0.09 0.99 0.04 0.00 0.00 177.00 177.90 1qni s THR 432 N 0.19 0.66 0.60 1.26 2.01 -0.51 -4.94 115.64 114.91 1qni s THR 432 Ca 0.53 -1.04 -0.00 0.00 0.31 0.00 0.00 61.69 61.49 1qni s THR 432 Cb -0.30 -0.69 0.05 0.00 0.01 0.00 0.00 72.50 71.57 1qni s THR 432 CO 0.34 -0.29 0.84 -0.47 -0.69 0.00 0.00 174.62 174.35 1qni s TYR 433 N -1.21 2.71 -0.09 4.92 5.04 -1.26 0.64 117.35 128.09 1qni s TYR 433 Ca -0.07 0.02 -0.02 0.00 -2.44 0.00 0.00 57.07 54.56 1qni s TYR 433 Cb -0.09 -2.85 0.00 0.00 0.35 0.00 0.00 41.96 39.37 1qni s TYR 433 CO 0.01 -1.07 0.08 0.00 -1.34 0.00 0.00 175.55 173.24 1qni n ALA 434 N -2.50 -1.22 -0.28 3.97 0.00 -1.26 -4.00 120.51 115.22 1qni n ALA 434 Ca 0.09 -0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.52 1qni n ALA 434 Cb 0.60 -0.18 0.00 0.00 0.00 0.00 0.00 19.45 19.87 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 -0.48 0.00 -1.93 0.00 2.13 -1.26 -4.24 120.64 114.86 1qni n GLU 435 Ca -0.03 0.00 -0.31 0.00 0.66 0.00 0.00 57.16 57.48 1qni n GLU 435 Cb 0.09 0.00 0.01 0.00 0.27 0.00 0.00 31.44 31.81 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 3.62 0.00 5.31 0.04 -1.26 -3.59 135.00 139.13 1qni s PRO 436 Ca 0.00 0.74 0.00 0.00 0.04 0.00 0.00 61.00 61.78 1qni s PRO 436 Cb 0.00 -2.09 0.00 0.00 0.04 0.00 0.00 34.50 32.45 1qni s PRO 436 CO 0.00 -0.54 0.00 0.72 0.04 0.00 0.00 177.00 177.22 1qni n HIS 437 N -2.67 0.00 -3.39 0.56 8.25 -1.26 -4.92 115.22 111.79 1qni n HIS 437 Ca 0.06 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.32 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 0.39 5.23 0.28 0.41 2.15 -0.76 -4.14 116.67 120.23 1qni s ASP 438 Ca 0.00 -0.66 -0.11 0.00 0.43 0.00 0.00 52.55 52.21 1qni s ASP 438 Cb 0.00 -0.56 0.00 0.00 -0.30 0.00 0.00 42.92 42.06 1qni s ASP 438 CO 0.00 -0.71 0.51 0.00 -0.17 0.00 0.00 175.17 174.80 1qni s ILE 440 N -3.64 -0.17 -0.10 0.00 2.07 -1.08 -4.92 121.20 113.36 1qni s ILE 440 Ca 0.23 0.20 -0.07 0.00 -1.41 0.00 0.00 60.65 59.60 1qni s ILE 440 Cb -0.01 -0.40 -0.04 0.00 0.13 0.00 0.00 42.46 42.14 1qni s ILE 440 CO 0.12 0.08 0.16 -0.76 -1.91 0.00 0.00 174.94 172.63 1qni s LEU 441 N 1.67 4.39 0.03 8.50 1.43 -1.26 -1.65 118.68 131.79 1qni s LEU 441 Ca -0.06 0.48 0.01 0.00 -1.03 0.00 0.00 54.13 53.54 1qni s LEU 441 Cb -0.11 -2.18 -0.02 0.00 0.03 0.00 0.00 46.19 43.91 1qni s LEU 441 CO -0.08 0.38 -0.05 0.68 0.23 0.00 0.00 176.35 177.51 1qni s VAL 442 N -1.08 0.33 0.63 -1.59 -7.23 -0.49 -3.91 120.40 107.06 1qni s VAL 442 Ca 0.17 -0.85 -0.17 0.00 -1.81 0.00 0.00 61.98 59.32 1qni s VAL 442 Cb -0.12 -0.41 -0.01 0.00 0.56 0.00 0.00 36.38 36.39 1qni s VAL 442 CO 0.07 -0.35 1.19 -0.13 -0.31 0.00 0.00 175.10 175.57 1qni s ARG 443 N -1.27 2.77 0.29 4.82 0.52 -1.26 0.34 118.95 125.16 1qni s ARG 443 Ca -0.10 1.73 0.04 0.00 -0.52 0.00 0.00 55.73 56.88 1qni s ARG 443 Cb -0.08 -1.91 0.66 0.00 0.52 0.00 0.00 34.95 34.14 1qni s ARG 443 CO -0.00 -1.34 1.80 -0.09 0.02 0.00 0.00 175.30 175.68 1qni h ARG 444 N 0.48 0.81 0.00 3.54 2.43 -1.13 -1.41 114.38 119.11 1qni h ARG 444 Ca -0.49 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 58.63 1qni h ARG 444 Cb 1.29 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 30.65 1qni h ARG 444 CO 0.54 0.54 0.00 -0.40 -1.51 0.00 0.00 179.97 179.13 1qni n ASP 445 N -4.72 0.00 -0.10 -3.80 5.68 -1.26 -3.25 116.55 109.10 1qni n ASP 445 Ca 0.22 0.13 0.14 0.00 -0.50 0.00 0.00 54.79 54.77 1qni n ASP 445 Cb 0.49 -0.36 0.53 0.00 -1.14 0.00 0.00 41.12 40.64 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 -1.36 0.50 -4.39 0.11 6.02 -0.53 -4.78 117.38 112.95 1qni n GLN 446 Ca 0.09 -0.19 -0.33 0.00 -0.01 0.00 0.00 57.00 56.56 1qni n GLN 446 Cb 0.22 -1.50 -0.16 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 -2.63 2.34 -0.46 5.09 -1.09 -1.20 -3.87 121.20 119.39 1qni s ILE 447 Ca 0.23 -0.87 -0.07 0.00 -2.23 0.00 0.00 60.65 57.72 1qni s ILE 447 Cb 0.19 -1.98 0.12 0.00 -1.58 0.00 0.00 42.46 39.21 1qni s ILE 447 CO 0.52 0.53 0.30 -0.54 -1.23 0.00 0.00 174.94 174.52 1qni s LYS 448 N 1.03 2.33 0.32 2.79 1.02 -1.26 -5.04 119.74 120.92 1qni s LYS 448 Ca -0.02 -1.80 -0.08 0.00 0.02 0.00 0.00 55.97 54.09 1qni s LYS 448 Cb -0.15 -3.82 -0.06 0.00 -0.52 0.00 0.00 37.83 33.29 1qni s LYS 448 CO -0.05 -1.16 0.64 0.99 -0.92 0.00 0.00 175.35 174.85 1qni s THR 449 N 1.26 4.91 0.08 2.17 2.01 -1.26 -4.41 115.64 120.40 1qni s THR 449 Ca 0.07 0.37 0.05 0.00 0.31 0.00 0.00 61.69 62.49 1qni s THR 449 Cb -0.25 -3.71 -0.04 0.00 0.01 0.00 0.00 72.50 68.51 1qni s THR 449 CO -0.02 -0.34 -0.04 -0.54 -0.69 0.00 0.00 174.62 172.99 1qni s LYS 450 N -3.50 2.43 -0.16 4.92 1.02 -0.30 -5.05 119.74 119.10 1qni s LYS 450 Ca 0.48 -0.87 0.18 0.00 0.02 0.00 0.00 55.97 55.77 1qni s LYS 450 Cb -0.11 -2.47 -0.26 0.00 -0.52 0.00 0.00 37.83 34.48 1qni s LYS 450 CO 0.28 0.54 0.15 1.63 -0.92 0.00 0.00 175.35 177.03 1qni n LYS 451 N 0.74 0.81 -4.02 1.68 4.01 -1.26 -4.86 118.16 115.26 1qni n LYS 451 Ca -0.12 -0.05 -0.10 0.00 -0.51 0.00 0.00 58.31 57.53 1qni n LYS 451 Cb 0.52 -1.49 -0.11 0.00 -0.51 0.00 0.00 35.03 33.44 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 -2.68 0.27 0.51 -0.18 -4.36 -1.26 -4.65 121.20 108.86 1qni s ILE 452 Ca -0.09 -1.06 -0.18 0.00 -0.26 0.00 0.00 60.65 59.07 1qni s ILE 452 Cb 0.07 -0.50 -0.08 0.00 1.25 0.00 0.00 42.46 43.21 1qni s ILE 452 CO 0.80 -0.51 1.00 -0.31 0.24 0.00 0.00 174.94 176.17 1qni s TYR 453 N -1.67 3.26 -0.16 1.37 1.51 -0.98 -5.05 117.35 115.63 1qni s TYR 453 Ca -0.12 1.52 -0.12 0.00 -1.01 0.00 0.00 57.07 57.34 1qni s TYR 453 Cb -0.08 -2.89 -0.05 0.00 -0.11 0.00 0.00 41.96 38.83 1qni s TYR 453 CO -0.01 -0.55 0.24 -1.21 -1.11 0.00 0.00 175.55 172.91 1qni s GLU 454 N -3.80 4.14 0.56 -0.62 2.02 -1.26 -4.74 118.70 114.99 1qni s GLU 454 Ca 0.62 0.01 0.20 0.00 0.02 0.00 0.00 54.97 55.82 1qni s GLU 454 Cb -0.12 -3.39 1.09 0.00 0.10 0.00 0.00 34.13 31.81 1qni s GLU 454 CO 0.28 0.34 1.57 0.00 0.02 0.00 0.00 175.26 177.47 1qni h ARG 455 N 6.38 0.00 -0.60 1.61 2.47 -1.98 0.30 114.38 122.56 1qni h ARG 455 Ca -0.43 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.29 1qni h ARG 455 Cb 1.17 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.49 1qni h ARG 455 CO 0.73 0.00 0.00 0.27 0.56 0.00 0.00 179.97 181.53 1qni n ASN 456 N -2.56 5.21 -4.76 7.04 2.04 -1.26 -4.99 115.26 115.97 1qni n ASN 456 Ca -0.01 -2.70 -0.41 0.00 -0.44 0.00 0.00 54.58 51.02 1qni n ASN 456 Cb 0.47 -0.63 -0.02 0.00 -2.53 0.00 0.00 39.78 37.07 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 -0.89 6.76 0.55 0.53 -1.08 0.10 -4.91 116.67 117.73 1qni s ASP 457 Ca 0.53 2.66 0.37 0.00 -0.52 0.00 0.00 52.55 55.59 1qni s ASP 457 Cb 0.37 -2.64 1.96 0.00 -1.46 0.00 0.00 42.92 41.15 1qni s ASP 457 CO 0.20 -0.57 2.13 -0.65 0.52 0.00 0.00 175.17 176.80 1qni h PRO 458 N 3.84 0.00 0.00 4.34 0.11 -1.94 -2.96 132.00 135.39 1qni h PRO 458 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1qni h PRO 458 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1qni h PRO 458 CO 0.69 0.00 0.00 0.98 -0.21 0.00 0.00 178.00 179.46 1qni n TYR 459 N -2.83 0.00 -2.14 0.65 9.36 -1.26 -3.15 117.16 117.80 1qni n TYR 459 Ca -0.02 0.00 -0.03 0.00 3.32 0.00 0.00 57.90 61.17 1qni n TYR 459 Cb 0.09 -0.08 -0.03 0.00 -0.63 0.00 0.00 39.34 38.68 1qni n TYR 459 CO 0.00 0.00 0.00 1.97 0.22 0.00 0.00 176.86 179.05 1qni n PHE 460 N -1.08 0.00 0.12 2.98 1.16 -1.12 -4.92 117.46 114.59 1qni n PHE 460 Ca 0.12 -0.41 0.04 0.00 -1.87 0.00 0.00 57.45 55.33 1qni n PHE 460 Cb 0.08 0.26 0.44 0.00 -1.61 0.00 0.00 39.48 38.65 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 0.28 1.64 -0.10 1.98 0.00 -1.58 -1.57 119.26 119.91 1qni h ALA 461 Ca -0.37 -0.13 -0.17 0.00 0.00 0.00 0.00 54.91 54.24 1qni h ALA 461 Cb 1.50 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.19 1qni h ALA 461 CO -0.13 0.27 -0.66 0.66 0.00 0.00 0.00 179.25 179.40 1qni h SER 462 N 0.26 0.47 -0.35 0.00 4.64 -1.92 -2.35 113.55 114.30 1qni h SER 462 Ca 0.06 -0.28 -0.01 0.00 -0.47 0.00 0.00 61.79 61.09 1qni h SER 462 Cb 0.21 -0.14 -0.02 0.00 -0.31 0.00 0.00 62.40 62.15 1qni h SER 462 CO 0.01 0.99 0.18 0.00 -0.87 0.00 0.00 176.83 177.14 1qni n ARG 464 N -4.75 0.44 0.09 0.00 1.85 -0.98 -1.41 116.66 111.91 1qni n ARG 464 Ca -0.01 -0.06 -0.20 0.00 -1.00 0.00 0.00 57.85 56.58 1qni n ARG 464 Cb 0.10 -1.50 -0.15 0.00 -1.05 0.00 0.00 32.46 29.86 1qni n ARG 464 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1qni h ALA 465 N 3.42 0.12 0.03 2.89 0.00 -0.99 -2.05 119.26 122.67 1qni h ALA 465 Ca 0.00 -1.02 -0.22 0.00 0.00 0.00 0.00 54.91 53.67 1qni h ALA 465 Cb 0.33 0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 1qni h ALA 465 CO 0.00 0.98 -0.97 0.37 0.00 0.00 0.00 179.25 179.64 1qni h GLN 466 N 0.10 0.23 -0.35 0.00 5.75 -1.24 -2.55 115.11 117.05 1qni h GLN 466 Ca -0.25 -0.28 -0.06 0.00 -0.15 0.00 0.00 58.65 57.91 1qni h GLN 466 Cb 2.06 0.09 -0.01 0.00 1.07 0.00 0.00 27.48 30.69 1qni h GLN 466 CO 0.20 1.03 -0.01 0.00 -2.65 0.00 0.00 178.83 177.40 1qni h ALA 467 N 0.86 0.47 -0.31 3.38 0.00 -1.30 -1.54 119.26 120.81 1qni h ALA 467 Ca -0.06 -0.25 0.04 0.00 0.00 0.00 0.00 54.91 54.63 1qni h ALA 467 Cb 1.63 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 19.25 1qni h ALA 467 CO 0.15 0.24 0.08 1.49 0.00 0.00 0.00 179.25 181.21 1qni h GLU 468 N 0.42 0.20 -0.33 0.00 4.57 -1.34 0.10 114.58 118.20 1qni h GLU 468 Ca 0.10 -0.01 0.04 0.00 -1.18 0.00 0.00 59.36 58.31 1qni h GLU 468 Cb 0.47 -0.04 -0.04 0.00 -0.16 0.00 0.00 28.75 28.98 1qni h GLU 468 CO 0.02 0.13 0.08 0.87 -1.18 0.00 0.00 179.01 178.93 1qni h LYS 469 N 0.20 0.20 0.00 1.92 1.57 -1.27 0.14 116.57 119.33 1qni h LYS 469 Ca 0.14 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.91 1qni h LYS 469 Cb 0.14 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.40 1qni h LYS 469 CO -0.17 0.13 0.00 -0.25 -0.57 0.00 0.00 179.45 178.59 1qni n ASP 470 N -5.07 0.00 -3.48 0.86 8.00 -0.60 -4.88 116.55 111.39 1qni n ASP 470 Ca 0.01 -1.38 -0.25 0.00 0.71 0.00 0.00 54.79 53.88 1qni n ASP 470 Cb 0.14 0.00 0.05 0.00 -0.02 0.00 0.00 41.12 41.29 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 0.46 -0.53 3.49 0.44 0.00 0.17 -5.00 105.19 104.22 1qni n GLY 471 Ca 0.07 0.20 -0.32 0.00 0.00 0.00 0.00 46.02 45.97 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 -3.24 3.05 -0.32 1.61 -7.23 -0.16 -5.01 120.40 109.09 1qni s VAL 472 Ca 0.51 -0.98 -0.12 0.00 -1.81 0.00 0.00 61.98 59.58 1qni s VAL 472 Cb -0.23 -2.27 -0.02 0.00 0.56 0.00 0.00 36.38 34.41 1qni s VAL 472 CO 0.63 0.41 0.22 -0.89 -0.31 0.00 0.00 175.10 175.16 1qni s THR 473 N -0.89 5.20 0.52 5.32 2.01 -1.26 -4.32 115.64 122.21 1qni s THR 473 Ca 0.14 -0.15 0.31 0.00 0.31 0.00 0.00 61.69 62.30 1qni s THR 473 Cb -0.11 -3.62 0.34 0.00 0.01 0.00 0.00 72.50 69.13 1qni s THR 473 CO 0.05 0.06 2.19 -0.07 -0.69 0.00 0.00 174.62 176.16 1qni h LEU 474 N 8.44 0.00 0.00 4.42 3.38 -1.96 -0.03 115.31 129.57 1qni h LEU 474 Ca -0.32 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.65 1qni h LEU 474 Cb 1.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.91 1qni h LEU 474 CO 0.61 0.05 -0.39 -0.62 0.09 0.00 0.00 178.44 178.18 1qni n GLU 475 N -3.64 0.13 0.00 1.13 4.71 -1.26 -4.55 120.64 117.16 1qni n GLU 475 Ca -0.02 0.05 0.00 0.00 -0.01 0.00 0.00 57.16 57.18 1qni n GLU 475 Cb 0.15 -1.60 0.00 0.00 -1.01 0.00 0.00 31.44 28.98 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 -1.80 0.11 -4.84 1.62 3.41 -1.09 -4.98 113.62 106.05 1qni n SER 476 Ca 0.05 -0.00 -0.32 0.00 -0.26 0.00 0.00 58.87 58.34 1qni n SER 476 Cb 0.38 0.03 -0.05 0.00 -0.26 0.00 0.00 64.21 64.32 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 -0.05 6.71 -0.41 4.04 1.01 -0.04 -5.01 116.67 122.92 1qni s ASP 477 Ca 0.00 1.45 0.04 0.00 0.71 0.00 0.00 52.55 54.74 1qni s ASP 477 Cb 0.00 -2.45 0.17 0.00 1.01 0.00 0.00 42.92 41.65 1qni s ASP 477 CO 0.00 -0.41 0.35 0.20 0.21 0.00 0.00 175.17 175.52 1qni s ASN 478 N -2.69 1.40 0.28 0.27 0.01 -1.26 -4.24 114.94 108.70 1qni s ASN 478 Ca 0.57 -2.87 0.12 0.00 -0.71 0.00 0.00 52.86 49.97 1qni s ASN 478 Cb -0.10 -0.28 -0.05 0.00 0.41 0.00 0.00 41.25 41.24 1qni s ASN 478 CO 0.24 -0.18 -0.18 -0.54 -1.51 0.00 0.00 177.10 174.92 1qni s LYS 479 N 0.24 1.73 -0.12 -0.60 1.02 -0.82 -4.96 119.74 116.22 1qni s LYS 479 Ca 0.31 -1.73 -0.00 0.00 0.02 0.00 0.00 55.97 54.57 1qni s LYS 479 Cb 0.00 -1.81 0.02 0.00 -0.52 0.00 0.00 37.83 35.53 1qni s LYS 479 CO -0.17 0.34 -0.10 0.08 -0.92 0.00 0.00 175.35 174.58 1qni s VAL 480 N -2.46 1.21 -0.16 3.17 1.01 -1.26 -0.17 120.40 121.74 1qni s VAL 480 Ca 0.30 -0.41 -0.01 0.00 0.00 0.00 0.00 61.98 61.86 1qni s VAL 480 Cb -0.05 -1.19 -0.00 0.00 0.00 0.00 0.00 36.38 35.14 1qni s VAL 480 CO 0.15 0.40 -0.13 -0.63 0.00 0.00 0.00 175.10 174.89 1qni s ILE 481 N 1.57 2.82 -0.21 2.22 1.01 0.71 -4.97 121.20 124.36 1qni s ILE 481 Ca 0.04 -0.71 -0.06 0.00 0.00 0.00 0.00 60.65 59.92 1qni s ILE 481 Cb -0.13 -2.21 -0.03 0.00 0.01 0.00 0.00 42.46 40.11 1qni s ILE 481 CO -0.08 0.50 0.02 -0.13 0.00 0.00 0.00 174.94 175.25 1qni s ARG 482 N 0.88 3.68 -0.53 2.79 0.52 -1.26 -0.42 118.95 124.62 1qni s ARG 482 Ca -0.03 -0.48 0.06 0.00 -0.52 0.00 0.00 55.73 54.75 1qni s ARG 482 Cb -0.15 -3.15 0.22 0.00 0.52 0.00 0.00 34.95 32.39 1qni s ARG 482 CO -0.01 0.02 0.56 -3.47 0.02 0.00 0.00 175.30 172.42 1qni n ASP 483 N 4.25 1.73 0.00 0.23 2.03 -0.37 -5.03 116.55 119.39 1qni n ASP 483 Ca -0.17 -2.97 0.00 0.00 0.52 0.00 0.00 54.79 52.17 1qni n ASP 483 Cb 0.52 -0.66 0.00 0.00 -0.72 0.00 0.00 41.12 40.26 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 1.59 1.82 0.14 0.27 0.00 -1.26 -2.86 105.19 104.90 1qni n GLY 484 Ca 0.25 -0.28 0.12 0.00 0.00 0.00 0.00 46.02 46.12 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 9.88 0.94 -4.89 1.61 3.02 -1.26 -4.90 115.26 119.66 1qni n ASN 485 Ca 0.00 -0.74 -0.35 0.00 -0.03 0.00 0.00 54.58 53.46 1qni n ASN 485 Cb 0.00 0.36 -0.05 0.00 -0.61 0.00 0.00 39.78 39.48 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 -2.77 3.48 -0.13 3.52 1.02 -1.13 -0.91 119.74 122.82 1qni s LYS 486 Ca 0.16 -0.16 -0.01 0.00 0.02 0.00 0.00 55.97 55.97 1qni s LYS 486 Cb 0.18 -3.14 0.04 0.00 -0.52 0.00 0.00 37.83 34.38 1qni s LYS 486 CO 0.65 0.72 -0.01 0.08 -0.92 0.00 0.00 175.35 175.87 1qni s VAL 487 N -1.17 0.65 -0.25 3.17 1.01 -0.75 -1.23 120.40 121.82 1qni s VAL 487 Ca 0.21 -0.26 -0.08 0.00 0.00 0.00 0.00 61.98 61.86 1qni s VAL 487 Cb -0.13 -0.88 -0.03 0.00 0.00 0.00 0.00 36.38 35.34 1qni s VAL 487 CO 0.11 0.13 0.08 -0.13 0.00 0.00 0.00 175.10 175.29 1qni s ARG 488 N 1.84 3.68 -0.21 2.72 0.52 0.44 -0.84 118.95 127.11 1qni s ARG 488 Ca 0.03 -0.46 -0.05 0.00 -0.52 0.00 0.00 55.73 54.72 1qni s ARG 488 Cb -0.14 -3.35 -0.03 0.00 0.52 0.00 0.00 34.95 31.95 1qni s ARG 488 CO -0.07 -0.18 0.01 0.08 0.02 0.00 0.00 175.30 175.16 1qni s VAL 489 N 1.61 4.02 -0.22 3.52 1.01 0.68 -0.20 120.40 130.82 1qni s VAL 489 Ca 0.06 -0.29 -0.04 0.00 0.00 0.00 0.00 61.98 61.71 1qni s VAL 489 Cb -0.15 -2.82 -0.01 0.00 0.00 0.00 0.00 36.38 33.39 1qni s VAL 489 CO 0.04 0.42 -0.04 -0.31 0.00 0.00 0.00 175.10 175.21 1qni s TYR 490 N 1.06 2.96 0.25 5.22 1.51 0.76 -0.22 117.35 128.89 1qni s TYR 490 Ca 0.02 -0.89 0.10 0.00 -1.01 0.00 0.00 57.07 55.30 1qni s TYR 490 Cb -0.14 -2.11 -0.05 0.00 -0.11 0.00 0.00 41.96 39.55 1qni s TYR 490 CO 0.02 -0.52 -0.18 -1.64 -1.11 0.00 0.00 175.55 172.11 1qni s MET 491 N 1.46 1.54 0.27 -0.62 -1.94 0.16 -1.95 119.30 118.22 1qni s MET 491 Ca 0.05 -1.69 0.11 0.00 -1.71 0.00 0.00 55.69 52.45 1qni s MET 491 Cb -0.14 -1.53 -0.05 0.00 2.01 0.00 0.00 34.83 35.12 1qni s MET 491 CO -0.03 0.28 -0.17 -0.08 -0.01 0.00 0.00 175.02 175.01 1qni s THR 492 N -2.65 2.26 -0.14 2.05 -1.32 -1.26 -2.21 115.64 112.37 1qni s THR 492 Ca 0.27 -2.33 -0.10 0.00 -1.21 0.00 0.00 61.69 58.32 1qni s THR 492 Cb -0.04 -2.31 0.04 0.00 -1.51 0.00 0.00 72.50 68.69 1qni s THR 492 CO 0.12 -0.41 0.34 -0.94 -2.21 0.00 0.00 174.62 171.53 1qni s SER 493 N -3.48 -0.39 0.08 8.08 1.04 -0.28 0.10 113.70 118.84 1qni s SER 493 Ca 0.29 0.72 -0.20 0.00 0.48 0.00 0.00 55.95 57.24 1qni s SER 493 Cb -0.03 0.66 0.05 0.00 0.10 0.00 0.00 66.02 66.80 1qni s SER 493 CO 0.13 -0.15 0.47 0.68 0.98 0.00 0.00 173.24 175.35 1qni s VAL 494 N 0.82 0.04 0.00 5.02 -7.23 -1.05 -1.03 120.40 116.97 1qni s VAL 494 Ca -0.05 -0.36 0.00 0.00 -1.81 0.00 0.00 61.98 59.76 1qni s VAL 494 Cb -0.06 -1.02 0.00 0.00 0.56 0.00 0.00 36.38 35.86 1qni s VAL 494 CO -0.06 -0.20 0.00 0.00 -0.31 0.00 0.00 175.10 174.53 1qni n ALA 495 N 0.20 0.00 -1.65 1.32 0.00 -1.26 -1.18 120.51 117.94 1qni n ALA 495 Ca -0.18 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 52.89 1qni n ALA 495 Cb 0.61 0.00 0.06 0.00 0.00 0.00 0.00 19.45 20.12 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 14.00 2.73 -3.80 0.00 -0.04 -1.26 -4.89 135.00 141.73 1qni n PRO 496 Ca 0.00 -3.42 -0.12 0.00 -0.04 0.00 0.00 63.50 59.92 1qni n PRO 496 Cb 0.00 -2.28 -0.11 0.00 -0.04 0.00 0.00 33.50 31.07 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 -3.96 0.36 0.12 0.54 -0.21 -0.32 -3.98 119.66 112.21 1qni s GLN 497 Ca 0.58 0.11 -0.12 0.00 0.02 0.00 0.00 55.36 55.96 1qni s GLN 497 Cb 0.47 0.17 -0.06 0.00 1.00 0.00 0.00 33.01 34.59 1qni s GLN 497 CO -0.23 -0.07 0.47 0.71 -2.12 0.00 0.00 175.29 174.06 1qni s TYR 498 N -0.36 3.58 -1.70 0.91 2.02 -1.26 -2.51 117.35 118.02 1qni s TYR 498 Ca -0.05 0.90 0.10 0.00 -0.37 0.00 0.00 57.07 57.66 1qni s TYR 498 Cb -0.03 -2.25 0.55 0.00 -0.40 0.00 0.00 41.96 39.82 1qni s TYR 498 CO 0.01 0.46 1.13 0.41 -1.57 0.00 0.00 175.55 175.99 1qni n GLY 499 N 0.77 -0.47 3.12 0.71 0.00 0.11 -4.47 105.19 104.98 1qni n GLY 499 Ca -0.06 -0.05 -0.12 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.30 0.27 -0.02 1.61 -2.45 -1.26 -4.87 119.30 110.27 1qni s MET 500 Ca 0.12 0.58 0.04 0.00 -1.25 0.00 0.00 55.69 55.18 1qni s MET 500 Cb 0.07 -0.06 0.09 0.00 1.25 0.00 0.00 34.83 36.18 1qni s MET 500 CO 0.13 -0.15 1.06 0.25 1.05 0.00 0.00 175.02 177.37 1qni n THR 501 N 4.07 1.15 -3.64 10.11 -2.24 -1.26 -4.88 114.28 117.60 1qni n THR 501 Ca -0.23 -1.20 -0.08 0.00 -2.27 0.00 0.00 64.05 60.27 1qni n THR 501 Cb 0.54 0.38 -0.07 0.00 -2.10 0.00 0.00 70.33 69.08 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 -1.28 -0.54 -0.10 3.42 -1.08 -1.26 -1.76 116.67 114.07 1qni s ASP 502 Ca 0.08 0.98 -0.29 0.00 -0.52 0.00 0.00 52.55 52.80 1qni s ASP 502 Cb 0.06 1.06 0.07 0.00 -1.46 0.00 0.00 42.92 42.65 1qni s ASP 502 CO 0.03 -0.16 0.68 0.72 0.52 0.00 0.00 175.17 176.95 1qni s PHE 503 N 0.61 -0.68 0.05 -5.34 -0.71 -1.10 -4.99 117.98 105.82 1qni s PHE 503 Ca -0.01 1.30 0.05 0.00 -1.04 0.00 0.00 56.93 57.23 1qni s PHE 503 Cb -0.05 0.37 -0.04 0.00 -1.21 0.00 0.00 43.02 42.10 1qni s PHE 503 CO -0.09 -0.55 -0.09 0.15 -1.34 0.00 0.00 175.22 173.30 1qni s LYS 504 N -0.82 2.34 0.17 1.99 1.02 -1.26 -1.15 119.74 122.03 1qni s LYS 504 Ca -0.08 -0.86 -0.07 0.00 0.02 0.00 0.00 55.97 54.97 1qni s LYS 504 Cb -0.01 -2.39 -0.02 0.00 -0.52 0.00 0.00 37.83 34.89 1qni s LYS 504 CO 0.08 0.56 0.25 0.14 -0.92 0.00 0.00 175.35 175.45 1qni s VAL 505 N -1.07 0.06 -0.08 3.17 -7.23 0.62 -4.94 120.40 110.93 1qni s VAL 505 Ca 0.19 -1.55 -0.03 0.00 -1.81 0.00 0.00 61.98 58.77 1qni s VAL 505 Cb -0.11 -1.99 -0.04 0.00 0.56 0.00 0.00 36.38 34.80 1qni s VAL 505 CO 0.10 -0.26 0.07 -0.54 -0.31 0.00 0.00 175.10 174.15 1qni s LYS 506 N -4.01 3.16 0.03 4.82 1.02 -1.26 -1.06 119.74 122.43 1qni s LYS 506 Ca 0.21 -0.33 -0.38 0.00 0.02 0.00 0.00 55.97 55.50 1qni s LYS 506 Cb 0.04 -2.94 -0.18 0.00 -0.52 0.00 0.00 37.83 34.23 1qni s LYS 506 CO 0.03 0.72 1.30 -1.91 -0.92 0.00 0.00 175.35 174.57 1qni n GLU 507 N 1.89 0.83 -0.48 1.68 2.13 -0.70 -0.98 120.64 125.01 1qni n GLU 507 Ca -0.18 0.30 0.00 0.00 0.66 0.00 0.00 57.16 57.94 1qni n GLU 507 Cb 0.54 -1.91 0.00 0.00 0.27 0.00 0.00 31.44 30.34 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 2.40 0.74 3.78 8.31 0.00 -0.41 -4.70 105.19 115.32 1qni n GLY 508 Ca 0.20 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.85 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 -2.97 6.46 -0.72 1.61 1.01 -0.15 -4.70 116.67 117.20 1qni s ASP 509 Ca 0.00 2.11 -0.20 0.00 0.71 0.00 0.00 52.55 55.17 1qni s ASP 509 Cb 0.00 -2.59 0.11 0.00 1.01 0.00 0.00 42.92 41.45 1qni s ASP 509 CO 0.00 -0.71 0.90 -0.70 0.21 0.00 0.00 175.17 174.88 1qni s GLU 510 N -2.72 3.26 -0.11 8.23 2.12 -0.08 -1.14 118.70 128.25 1qni s GLU 510 Ca 0.62 -1.39 -0.20 0.00 0.36 0.00 0.00 54.97 54.36 1qni s GLU 510 Cb -0.23 -4.45 -0.04 0.00 0.26 0.00 0.00 34.13 29.67 1qni s GLU 510 CO 0.28 -1.67 0.57 0.08 -0.54 0.00 0.00 175.26 173.98 1qni s VAL 511 N 2.90 5.12 -0.16 3.70 1.01 0.06 -1.82 120.40 131.21 1qni s VAL 511 Ca 0.21 1.14 0.01 0.00 0.00 0.00 0.00 61.98 63.34 1qni s VAL 511 Cb -0.16 -3.91 0.02 0.00 0.00 0.00 0.00 36.38 32.34 1qni s VAL 511 CO 0.02 0.27 -0.18 -0.89 0.00 0.00 0.00 175.10 174.32 1qni s THR 512 N 0.87 1.87 -0.15 3.92 2.01 -0.02 -0.55 115.64 123.59 1qni s THR 512 Ca 0.30 -0.82 -0.02 0.00 0.31 0.00 0.00 61.69 61.45 1qni s THR 512 Cb -0.16 -1.70 -0.02 0.00 0.01 0.00 0.00 72.50 70.62 1qni s THR 512 CO 0.13 0.51 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.80 1qni s VAL 513 N 1.32 3.54 -0.19 3.82 1.01 -0.95 -0.23 120.40 128.71 1qni s VAL 513 Ca 0.04 -0.49 -0.03 0.00 0.00 0.00 0.00 61.98 61.51 1qni s VAL 513 Cb -0.13 -2.53 -0.01 0.00 0.00 0.00 0.00 36.38 33.71 1qni s VAL 513 CO -0.11 0.51 -0.07 -0.31 0.00 0.00 0.00 175.10 175.12 1qni s TYR 514 N 0.37 2.92 -0.10 5.22 1.51 0.70 -2.22 117.35 125.76 1qni s TYR 514 Ca -0.07 -0.85 0.03 0.00 -1.01 0.00 0.00 57.07 55.16 1qni s TYR 514 Cb -0.15 -2.03 -0.01 0.00 -0.11 0.00 0.00 41.96 39.66 1qni s TYR 514 CO 0.04 -0.45 -0.18 0.42 -1.11 0.00 0.00 175.55 174.27 1qni s ILE 515 N 1.13 2.60 -0.18 2.71 -1.09 -0.53 -0.66 121.20 125.18 1qni s ILE 515 Ca 0.01 -0.84 0.01 0.00 -2.23 0.00 0.00 60.65 57.60 1qni s ILE 515 Cb -0.14 -2.04 0.02 0.00 -1.58 0.00 0.00 42.46 38.72 1qni s ILE 515 CO -0.01 0.55 -0.19 -0.89 -1.23 0.00 0.00 174.94 173.17 1qni s THR 516 N 0.12 2.04 -0.55 2.92 2.01 -0.94 -1.95 115.64 119.30 1qni s THR 516 Ca -0.09 -0.97 -0.26 0.00 0.31 0.00 0.00 61.69 60.67 1qni s THR 516 Cb -0.15 -1.87 0.03 0.00 0.01 0.00 0.00 72.50 70.52 1qni s THR 516 CO 0.06 0.49 1.07 0.21 -0.69 0.00 0.00 174.62 175.76 1qni s ASN 517 N 1.29 6.43 0.08 3.53 3.84 -0.65 -1.13 114.94 128.33 1qni s ASN 517 Ca 0.04 -0.03 0.27 0.00 0.21 0.00 0.00 52.86 53.36 1qni s ASN 517 Cb -0.13 -2.50 0.99 0.00 -0.55 0.00 0.00 41.25 39.05 1qni s ASN 517 CO -0.12 -1.32 1.81 0.18 -2.79 0.00 0.00 177.10 174.86 1qni n LEU 518 N 7.89 0.37 -4.71 3.21 4.77 -0.20 0.07 117.00 128.38 1qni n LEU 518 Ca 0.06 0.48 -0.35 0.00 -0.03 0.00 0.00 56.01 56.17 1qni n LEU 518 Cb 0.48 -0.40 0.10 0.00 -2.33 0.00 0.00 43.42 41.27 1qni n LEU 518 CO 0.68 -0.06 0.84 -1.81 -1.33 0.00 0.00 177.39 175.71 1qni s ASP 519 N -3.62 4.10 0.00 -1.43 1.01 -1.25 -4.78 116.67 110.69 1qni s ASP 519 Ca 0.12 2.51 0.00 0.00 0.71 0.00 0.00 52.55 55.89 1qni s ASP 519 Cb 0.16 -2.60 0.00 0.00 1.01 0.00 0.00 42.92 41.49 1qni s ASP 519 CO 0.58 -2.33 0.58 0.23 0.21 0.00 0.00 175.17 174.43 1qni n MET 520 N -2.58 0.51 -2.77 8.23 2.81 -1.26 -3.33 117.12 118.73 1qni n MET 520 Ca 0.15 -0.73 -0.42 0.00 -1.81 0.00 0.00 57.70 54.89 1qni n MET 520 Cb 0.49 -0.86 -0.03 0.00 -0.71 0.00 0.00 33.22 32.11 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 -0.31 4.88 0.52 2.03 1.01 -1.26 -4.99 120.40 122.27 1qni s VAL 521 Ca 0.00 1.93 -0.21 0.00 0.00 0.00 0.00 61.98 63.70 1qni s VAL 521 Cb 0.00 -4.26 -0.08 0.00 0.00 0.00 0.00 36.38 32.04 1qni s VAL 521 CO 0.00 0.12 0.91 -0.62 0.00 0.00 0.00 175.10 175.51 1qni n GLU 522 N 4.27 1.03 -0.35 2.72 1.02 -1.26 -2.31 120.64 125.76 1qni n GLU 522 Ca 0.05 0.38 0.00 0.00 -0.02 0.00 0.00 57.16 57.58 1qni n GLU 522 Cb 0.50 -2.04 0.00 0.00 -0.02 0.00 0.00 31.44 29.89 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 -0.00 0.00 -4.38 1.62 2.03 -1.26 -4.92 116.55 109.64 1qni n ASP 523 Ca 0.11 0.00 -0.43 0.00 0.52 0.00 0.00 54.79 54.99 1qni n ASP 523 Cb 0.44 -0.78 0.00 0.00 -0.72 0.00 0.00 41.12 40.06 1qni n ASP 523 CO 0.00 0.00 0.00 0.52 -1.92 0.00 0.00 177.20 175.80 1qni n VAL 524 N -2.00 4.10 -3.58 5.18 0.31 -0.98 -4.97 118.33 116.40 1qni n VAL 524 Ca 0.00 -4.35 -0.32 0.00 -0.01 0.00 0.00 64.34 59.66 1qni n VAL 524 Cb 0.00 -2.43 -0.05 0.00 -0.91 0.00 0.00 33.84 30.45 1qni n VAL 524 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 1qni s THR 525 N 2.45 5.08 0.22 2.52 2.01 -1.26 -4.05 115.64 122.61 1qni s THR 525 Ca 0.47 0.23 0.11 0.00 0.31 0.00 0.00 61.69 62.81 1qni s THR 525 Cb 0.02 -3.63 -0.05 0.00 0.01 0.00 0.00 72.50 68.86 1qni s THR 525 CO 0.02 0.04 -0.22 -1.00 -0.69 0.00 0.00 174.62 172.77 1qni s HIS 526 N -1.67 2.26 0.46 4.92 3.76 0.10 -4.56 115.29 120.56 1qni s HIS 526 Ca 0.42 -0.36 0.03 0.00 -0.15 0.00 0.00 55.06 55.00 1qni s HIS 526 Cb -0.12 -1.07 -0.01 0.00 1.11 0.00 0.00 32.58 32.48 1qni s HIS 526 CO 0.23 0.56 0.11 0.20 -0.85 0.00 0.00 174.74 174.98 1qni s GLY 527 N -2.94 2.86 -0.21 -2.22 0.00 -1.26 0.13 107.32 103.68 1qni s GLY 527 Ca 0.23 -0.80 -0.12 0.00 0.00 0.00 0.00 44.72 44.04 1qni s GLY 527 CO 0.11 -1.94 0.50 -0.12 0.00 0.00 0.00 173.10 171.65 1qni s PHE 528 N -3.09 -0.75 -0.08 1.90 5.36 -1.08 -4.25 117.98 115.99 1qni s PHE 528 Ca 0.16 1.56 -0.03 0.00 -0.96 0.00 0.00 56.93 57.66 1qni s PHE 528 Cb 0.01 0.39 0.04 0.00 -0.34 0.00 0.00 43.02 43.12 1qni s PHE 528 CO 0.11 -0.40 0.17 0.00 -1.46 0.00 0.00 175.22 173.63 1qni s MET 530 N 1.39 3.13 0.19 0.00 1.75 -1.18 -1.80 119.30 122.78 1qni s MET 530 Ca -0.07 -0.88 -0.32 0.00 -1.25 0.00 0.00 55.69 53.16 1qni s MET 530 Cb -0.11 -3.75 -0.15 0.00 2.84 0.00 0.00 34.83 33.65 1qni s MET 530 CO -0.06 -0.58 1.15 0.28 -0.65 0.00 0.00 175.02 175.16 1qni n VAL 531 N 5.05 1.00 -1.24 10.11 0.31 -0.77 -1.68 118.33 131.11 1qni n VAL 531 Ca -0.12 -0.25 -0.10 0.00 -0.01 0.00 0.00 64.34 63.86 1qni n VAL 531 Cb 0.48 -0.87 -0.04 0.00 -0.91 0.00 0.00 33.84 32.50 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 1.95 -5.31 -0.19 4.52 3.02 -1.26 -4.77 115.26 113.21 1qni n ASN 532 Ca 0.14 0.24 0.03 0.00 -0.03 0.00 0.00 54.58 54.96 1qni n ASN 532 Cb 0.25 -3.89 0.07 0.00 -0.61 0.00 0.00 39.78 35.60 1qni n ASN 532 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1qni n HIS 533 N -2.06 0.15 -4.04 3.10 8.25 -0.67 -5.01 115.22 114.93 1qni n HIS 533 Ca -0.10 -0.60 -0.27 0.00 -0.26 0.00 0.00 57.72 56.49 1qni n HIS 533 Cb 0.55 -0.08 -0.04 0.00 1.12 0.00 0.00 29.99 31.54 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 -0.45 -0.21 3.07 -1.41 0.00 -1.25 -4.95 105.19 99.99 1qni n GLY 534 Ca 0.06 0.16 -0.19 0.00 0.00 0.00 0.00 46.02 46.05 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 -4.06 0.86 -0.09 1.61 1.01 -1.26 -5.06 120.40 113.41 1qni s VAL 535 Ca 0.01 -0.69 -0.31 0.00 0.00 0.00 0.00 61.98 60.99 1qni s VAL 535 Cb -0.00 -0.76 0.09 0.00 0.00 0.00 0.00 36.38 35.71 1qni s VAL 535 CO 0.92 0.08 0.79 -0.55 0.00 0.00 0.00 175.10 176.33 1qni s SER 536 N -0.69 -0.56 0.05 3.32 0.15 -1.25 -3.07 113.70 111.65 1qni s SER 536 Ca 0.01 0.61 -0.26 0.00 0.70 0.00 0.00 55.95 57.01 1qni s SER 536 Cb -0.06 0.46 0.08 0.00 -1.71 0.00 0.00 66.02 64.80 1qni s SER 536 CO 0.00 -0.52 0.73 0.00 1.20 0.00 0.00 173.24 174.65 1qni s MET 537 N -1.16 1.06 -0.05 5.44 0.23 -0.66 -4.12 119.30 120.04 1qni s MET 537 Ca -0.08 -0.26 -0.07 0.00 -1.03 0.00 0.00 55.69 54.25 1qni s MET 537 Cb -0.00 0.49 -0.04 0.00 -1.53 0.00 0.00 34.83 33.75 1qni s MET 537 CO 0.07 -0.44 0.21 -2.00 -2.03 0.00 0.00 175.02 170.83 1qni s GLU 538 N -2.97 3.52 -0.36 3.16 2.12 -0.50 -2.64 118.70 121.03 1qni s GLU 538 Ca 0.00 -0.10 0.01 0.00 0.36 0.00 0.00 54.97 55.24 1qni s GLU 538 Cb -0.01 -3.15 0.15 0.00 0.26 0.00 0.00 34.13 31.38 1qni s GLU 538 CO -0.07 0.72 0.25 0.42 -0.54 0.00 0.00 175.26 176.03 1qni s ILE 539 N -1.16 0.12 0.79 -3.70 1.01 0.12 -4.66 121.20 113.72 1qni s ILE 539 Ca 0.21 -1.80 -0.12 0.00 0.00 0.00 0.00 60.65 58.94 1qni s ILE 539 Cb -0.13 -1.09 0.07 0.00 0.01 0.00 0.00 42.46 41.32 1qni s ILE 539 CO 0.11 -0.99 1.14 -0.44 0.00 0.00 0.00 174.94 174.75 1qni s SER 540 N 0.93 4.66 -0.28 3.58 0.01 -1.26 0.02 113.70 121.36 1qni s SER 540 Ca 0.21 0.96 -0.42 0.00 1.31 0.00 0.00 55.95 58.01 1qni s SER 540 Cb -0.18 -1.58 -0.18 0.00 0.21 0.00 0.00 66.02 64.29 1qni s SER 540 CO -0.03 -1.82 1.55 -2.65 0.41 0.00 0.00 173.24 170.70 1qni n PRO 541 N -3.29 0.57 -0.89 12.44 -0.02 -1.26 -0.64 135.00 141.91 1qni n PRO 541 Ca 0.07 0.21 0.00 0.00 -2.02 0.00 0.00 63.50 61.76 1qni n PRO 541 Cb 0.59 -1.79 0.00 0.00 -0.02 0.00 0.00 33.50 32.28 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 4.01 -0.52 -3.51 -0.52 1.13 0.11 -2.33 117.38 115.75 1qni n GLN 542 Ca 0.26 0.13 -0.29 0.00 -1.94 0.00 0.00 57.00 55.16 1qni n GLN 542 Cb 0.06 -3.74 -0.04 0.00 0.11 0.00 0.00 30.24 26.63 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 -0.74 3.63 -0.08 -1.09 0.74 0.18 -4.61 119.66 117.68 1qni s GLN 543 Ca 0.00 -0.06 0.04 0.00 0.05 0.00 0.00 55.36 55.39 1qni s GLN 543 Cb 0.00 -2.74 0.00 0.00 1.10 0.00 0.00 33.01 31.37 1qni s GLN 543 CO 0.00 0.33 -0.22 0.99 -0.55 0.00 0.00 175.29 175.84 1qni s THR 544 N -1.90 1.86 0.05 -0.34 2.01 -1.26 -1.64 115.64 114.41 1qni s THR 544 Ca 0.42 -0.91 0.03 0.00 0.31 0.00 0.00 61.69 61.54 1qni s THR 544 Cb -0.11 -1.61 -0.02 0.00 0.01 0.00 0.00 72.50 70.77 1qni s THR 544 CO 0.27 0.52 -0.09 0.00 -0.69 0.00 0.00 174.62 174.63 1qni s ALA 545 N 0.29 0.70 0.10 7.40 0.00 -0.82 -4.73 121.76 124.70 1qni s ALA 545 Ca -0.15 -0.80 0.03 0.00 0.00 0.00 0.00 51.96 51.04 1qni s ALA 545 Cb -0.16 0.01 -0.04 0.00 0.00 0.00 0.00 23.12 22.92 1qni s ALA 545 CO 0.07 0.03 -0.08 -1.54 0.00 0.00 0.00 175.76 174.23 1qni s SER 546 N -1.58 1.29 -0.21 0.00 1.04 -1.26 -1.46 113.70 111.52 1qni s SER 546 Ca -0.08 -0.92 -0.10 0.00 0.48 0.00 0.00 55.95 55.33 1qni s SER 546 Cb -0.10 0.05 0.08 0.00 0.10 0.00 0.00 66.02 66.16 1qni s SER 546 CO 0.01 -0.37 0.49 0.54 0.98 0.00 0.00 173.24 174.88 1qni s VAL 547 N -3.10 -0.36 -0.01 5.02 0.11 -0.94 -1.43 120.40 119.68 1qni s VAL 547 Ca 0.09 0.09 0.00 0.00 -2.93 0.00 0.00 61.98 59.24 1qni s VAL 547 Cb 0.02 -0.74 -0.04 0.00 -1.53 0.00 0.00 36.38 34.09 1qni s VAL 547 CO -0.02 0.04 0.02 0.28 -3.33 0.00 0.00 175.10 172.09 1qni s THR 548 N 2.05 4.34 0.17 5.04 -1.32 -1.26 -2.24 115.64 122.41 1qni s THR 548 Ca -0.06 -0.50 -0.13 0.00 -1.21 0.00 0.00 61.69 59.79 1qni s THR 548 Cb -0.10 -2.94 0.01 0.00 -1.51 0.00 0.00 72.50 67.97 1qni s THR 548 CO -0.15 0.40 0.38 0.72 -2.21 0.00 0.00 174.62 173.77 1qni s PHE 549 N -1.09 0.11 -0.13 9.09 -0.12 0.28 -4.99 117.98 121.14 1qni s PHE 549 Ca 0.20 -0.47 -0.13 0.00 -0.05 0.00 0.00 56.93 56.47 1qni s PHE 549 Cb -0.12 0.15 -0.05 0.00 -0.63 0.00 0.00 43.02 42.38 1qni s PHE 549 CO 0.10 -0.78 0.29 0.99 -0.05 0.00 0.00 175.22 175.77 1qni s THR 550 N -3.91 5.29 0.09 -4.49 2.01 -1.26 -0.76 115.64 112.60 1qni s THR 550 Ca 0.12 0.55 -0.31 0.00 0.31 0.00 0.00 61.69 62.36 1qni s THR 550 Cb 0.02 -3.61 -0.08 0.00 0.01 0.00 0.00 72.50 68.83 1qni s THR 550 CO -0.03 0.45 1.51 0.00 -0.69 0.00 0.00 174.62 175.86 1qni s ALA 551 N 0.03 3.66 1.00 7.40 0.00 -0.29 -4.92 121.76 128.64 1qni s ALA 551 Ca 0.17 1.15 0.00 0.00 0.00 0.00 0.00 51.96 53.29 1qni s ALA 551 Cb -0.13 -3.62 0.00 0.00 0.00 0.00 0.00 23.12 19.37 1qni s ALA 551 CO 0.05 -0.86 0.00 0.41 0.00 0.00 0.00 175.76 175.36 1qni n GLY 552 N 3.74 -1.13 3.76 0.00 0.00 -1.26 -1.28 105.19 109.01 1qni n GLY 552 Ca 0.14 -1.38 -0.37 0.00 0.00 0.00 0.00 46.02 44.41 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 3.22 0.38 1.61 -2.85 -1.26 -4.16 119.74 116.68 1qni s LYS 553 Ca 0.00 1.96 -0.24 0.00 -1.00 0.00 0.00 55.97 56.69 1qni s LYS 553 Cb 0.00 -2.16 -0.13 0.00 -2.06 0.00 0.00 37.83 33.48 1qni s LYS 553 CO 0.00 -1.04 0.75 -0.35 0.10 0.00 0.00 175.35 174.81 1qni n PRO 554 N -1.12 0.87 -1.61 1.78 -0.04 -1.26 -4.87 135.00 128.74 1qni n PRO 554 Ca 0.11 0.31 0.00 0.00 -0.04 0.00 0.00 63.50 63.88 1qni n PRO 554 Cb 0.48 -1.66 0.00 0.00 -0.04 0.00 0.00 33.50 32.27 1qni n PRO 554 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1qni n GLY 555 N 1.54 -0.09 3.82 0.55 0.00 0.77 -4.98 105.19 106.81 1qni n GLY 555 Ca 0.11 -1.65 -0.37 0.00 0.00 0.00 0.00 46.02 44.11 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 -2.20 5.23 -0.18 1.61 1.01 -1.26 -1.46 120.40 123.14 1qni s VAL 556 Ca 0.00 0.60 -0.05 0.00 0.00 0.00 0.00 61.98 62.53 1qni s VAL 556 Cb 0.00 -3.61 0.06 0.00 0.00 0.00 0.00 36.38 32.84 1qni s VAL 556 CO 0.00 0.55 0.09 -0.31 0.00 0.00 0.00 175.10 175.43 1qni s TYR 557 N -0.72 0.27 0.63 5.22 2.02 -0.52 -5.00 117.35 119.26 1qni s TYR 557 Ca 0.20 -0.40 -0.14 0.00 -0.37 0.00 0.00 57.07 56.36 1qni s TYR 557 Cb -0.15 -0.73 -0.02 0.00 -0.40 0.00 0.00 41.96 40.66 1qni s TYR 557 CO 0.09 -0.54 1.06 -1.58 -1.57 0.00 0.00 175.55 173.00 1qni s TRP 558 N 2.11 3.03 0.03 2.71 0.52 -1.26 0.04 118.94 126.12 1qni s TRP 558 Ca 0.02 1.48 0.03 0.00 0.02 0.00 0.00 56.10 57.65 1qni s TRP 558 Cb -0.16 -2.96 -0.02 0.00 -1.15 0.00 0.00 33.47 29.18 1qni s TRP 558 CO -0.11 -1.15 -0.10 1.52 0.02 0.00 0.00 176.95 177.13 1qni s TYR 559 N -2.67 0.84 0.18 -1.98 -0.85 -0.46 -1.85 117.35 110.55 1qni s TYR 559 Ca 0.61 -0.35 -0.12 0.00 -0.52 0.00 0.00 57.07 56.69 1qni s TYR 559 Cb -0.15 -0.50 0.00 0.00 0.38 0.00 0.00 41.96 41.69 1qni s TYR 559 CO 0.43 -0.02 0.37 1.52 -1.52 0.00 0.00 175.55 176.34 1qni s TYR 560 N -0.90 0.22 -0.15 -3.49 1.13 -0.74 -1.04 117.35 112.38 1qni s TYR 560 Ca -0.03 -0.58 -0.27 0.00 -1.41 0.00 0.00 57.07 54.78 1qni s TYR 560 Cb -0.07 0.11 -0.01 0.00 -1.10 0.00 0.00 41.96 40.88 1qni s TYR 560 CO 0.01 -0.80 0.90 0.00 -2.51 0.00 0.00 175.55 173.14 1qni n ASN 562 N 5.22 3.40 -4.15 0.00 2.04 -1.26 -4.78 115.26 115.73 1qni n ASN 562 Ca 0.06 -1.98 -0.36 0.00 -0.44 0.00 0.00 54.58 51.86 1qni n ASN 562 Cb 0.49 -0.28 -0.12 0.00 -2.53 0.00 0.00 39.78 37.33 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 -1.44 3.49 -0.20 -2.53 -0.11 -1.26 -4.91 118.94 111.98 1qni s TRP 563 Ca 0.40 -2.20 -0.38 0.00 1.22 0.00 0.00 56.10 55.14 1qni s TRP 563 Cb 0.23 -2.90 -0.14 0.00 -1.50 0.00 0.00 33.47 29.16 1qni s TRP 563 CO 0.31 -0.91 1.77 0.34 -4.62 0.00 0.00 176.95 173.84 1qni n PHE 564 N 4.63 2.12 -0.63 5.86 -0.00 -1.26 -4.58 117.46 123.59 1qni n PHE 564 Ca -0.06 0.37 0.00 0.00 -0.00 0.00 0.00 57.45 57.77 1qni n PHE 564 Cb 0.42 -2.52 0.00 0.00 -0.00 0.00 0.00 39.48 37.38 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 -0.03 -0.21 0.47 0.00 5.65 -1.26 -4.96 115.29 114.96 1qni s HIS 566 Ca 0.00 0.00 0.17 0.00 0.25 0.00 0.00 55.06 55.48 1qni s HIS 566 Cb 0.00 0.58 1.16 0.00 -1.18 0.00 0.00 32.58 33.14 1qni s HIS 566 CO 0.00 -0.63 2.05 0.00 -0.65 0.00 0.00 174.74 175.51 1qni h ALA 567 N 2.00 1.69 -0.89 1.58 0.00 -2.00 -2.22 119.26 119.42 1qni h ALA 567 Ca -0.23 -0.12 -0.49 0.00 0.00 0.00 0.00 54.91 54.07 1qni h ALA 567 Cb 1.23 -0.02 -0.27 0.00 0.00 0.00 0.00 17.79 18.72 1qni h ALA 567 CO 0.28 0.16 0.62 1.28 0.00 0.00 0.00 179.25 181.59 1qni n LEU 568 N -4.25 6.54 -0.03 0.00 4.77 -1.26 -4.65 117.00 118.12 1qni n LEU 568 Ca -0.03 -3.50 -0.09 0.00 -0.03 0.00 0.00 56.01 52.36 1qni n LEU 568 Cb 0.20 -0.84 -0.02 0.00 -2.33 0.00 0.00 43.42 40.44 1qni n LEU 568 CO 0.35 1.06 0.73 -0.74 -1.33 0.00 0.00 177.39 177.46 1qni h HIS 569 N 1.06 -0.49 -0.94 -1.77 2.76 -1.76 -2.19 115.15 111.81 1qni h HIS 569 Ca 0.57 0.03 0.22 0.00 -2.20 0.00 0.00 60.37 58.99 1qni h HIS 569 Cb 2.36 0.25 -0.07 0.00 1.55 0.00 0.00 27.41 31.50 1qni h HIS 569 CO 1.41 -0.27 0.62 0.52 -1.30 0.00 0.00 177.93 178.91 1qni h MET 570 N -0.21 0.38 0.00 5.26 2.86 -1.86 0.42 114.93 121.77 1qni h MET 570 Ca 0.12 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.74 1qni h MET 570 Cb 0.39 -0.08 0.00 0.00 0.06 0.00 0.00 31.60 31.96 1qni h MET 570 CO -0.31 0.25 -0.19 0.39 1.06 0.00 0.00 176.91 178.10 1qni n GLU 571 N -4.52 0.22 -2.12 1.72 4.71 -0.85 -4.62 120.64 115.18 1qni n GLU 571 Ca 0.21 0.14 -0.29 0.00 -0.01 0.00 0.00 57.16 57.21 1qni n GLU 571 Cb 0.76 -1.72 -0.05 0.00 -1.01 0.00 0.00 31.44 29.42 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 -3.10 2.69 0.00 3.49 1.75 0.14 -4.83 119.30 119.44 1qni s MET 572 Ca 0.10 -0.71 0.00 0.00 -1.25 0.00 0.00 55.69 53.83 1qni s MET 572 Cb 0.14 -5.17 0.00 0.00 2.84 0.00 0.00 34.83 32.64 1qni s MET 572 CO 0.63 -3.41 0.00 1.33 -0.65 0.00 0.00 175.02 172.92 1qni n VAL 573 N 7.70 0.00 -3.76 10.11 0.24 -1.26 -2.42 118.33 128.93 1qni n VAL 573 Ca 0.41 0.00 0.01 0.00 -2.04 0.00 0.00 64.34 62.73 1qni n VAL 573 Cb 0.47 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.84 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 -0.66 -0.28 -0.02 7.63 0.00 -0.20 -4.67 107.32 109.12 1qni s GLY 574 Ca 0.00 0.39 -0.00 0.00 0.00 0.00 0.00 44.72 45.10 1qni s GLY 574 CO 0.00 2.13 0.03 0.50 0.00 0.00 0.00 173.10 175.76 1qni s ARG 575 N -2.29 -0.03 -0.21 2.90 0.52 -0.72 -1.35 118.95 117.76 1qni s ARG 575 Ca 0.20 0.16 -0.08 0.00 -0.52 0.00 0.00 55.73 55.49 1qni s ARG 575 Cb 0.02 -0.20 -0.04 0.00 0.52 0.00 0.00 34.95 35.25 1qni s ARG 575 CO -0.02 -0.14 0.08 1.41 0.02 0.00 0.00 175.30 176.65 1qni s MET 576 N 0.88 3.87 -0.30 3.54 -2.45 0.11 -2.70 119.30 122.26 1qni s MET 576 Ca -0.07 -0.38 -0.09 0.00 -1.25 0.00 0.00 55.69 53.89 1qni s MET 576 Cb -0.11 -3.29 -0.01 0.00 1.25 0.00 0.00 34.83 32.67 1qni s MET 576 CO -0.03 0.09 0.14 -0.51 1.05 0.00 0.00 175.02 175.77 1qni s LEU 577 N 0.88 4.00 -0.26 4.11 1.43 -0.30 -1.44 118.68 127.11 1qni s LEU 577 Ca 0.04 -0.43 -0.07 0.00 -1.03 0.00 0.00 54.13 52.64 1qni s LEU 577 Cb -0.14 -2.00 -0.02 0.00 0.03 0.00 0.00 46.19 44.06 1qni s LEU 577 CO 0.03 -0.16 0.07 -0.69 0.23 0.00 0.00 176.35 175.83 1qni s VAL 578 N 1.63 4.25 0.16 -1.59 1.01 -0.54 -0.27 120.40 125.04 1qni s VAL 578 Ca 0.05 -0.26 0.07 0.00 0.00 0.00 0.00 61.98 61.84 1qni s VAL 578 Cb -0.17 -3.02 -0.04 0.00 0.00 0.00 0.00 36.38 33.16 1qni s VAL 578 CO 0.06 0.30 0.01 -1.83 0.00 0.00 0.00 175.10 173.64 1qni s GLU 579 N 1.60 2.49 0.24 2.72 -1.05 -0.23 -0.17 118.70 124.30 1qni s GLU 579 Ca 0.06 -1.03 -0.31 0.00 -0.15 0.00 0.00 54.97 53.54 1qni s GLU 579 Cb -0.15 -2.43 -0.13 0.00 -0.44 0.00 0.00 34.13 30.98 1qni s GLU 579 CO 0.03 0.48 1.52 0.00 0.95 0.00 0.00 175.26 178.24 1qni n ALA 580 N -0.01 1.70 0.83 -0.84 0.00 -1.26 -1.73 120.51 119.20 1qni n ALA 580 Ca -0.10 0.41 0.07 0.00 0.00 0.00 0.00 53.44 53.81 1qni n ALA 580 Cb 0.54 -2.36 0.39 0.00 0.00 0.00 0.00 19.45 18.03 1qni n ALA 580 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50