#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 2.24 -0.26 0.00 0.09 -1.26 -4.63 115.29 111.46 1qni s HIS 11 Ca 0.00 -0.42 0.02 0.00 -0.00 0.00 0.00 55.06 54.65 1qni s HIS 11 Cb 0.00 -1.43 0.07 0.00 -0.00 0.00 0.00 32.58 31.22 1qni s HIS 11 CO 0.00 -0.03 -0.03 0.08 -0.00 0.00 0.00 174.74 174.76 1qni s VAL 12 N -0.60 1.72 0.71 -0.90 1.01 -1.26 -4.99 120.40 116.09 1qni s VAL 12 Ca 0.10 -1.51 -0.10 0.00 0.00 0.00 0.00 61.98 60.47 1qni s VAL 12 Cb -0.10 -2.03 0.04 0.00 0.00 0.00 0.00 36.38 34.29 1qni s VAL 12 CO -0.01 -0.22 1.07 0.00 0.00 0.00 0.00 175.10 175.94 1qni s ALA 13 N 1.28 2.94 0.04 5.51 0.00 -1.26 -4.93 121.76 125.33 1qni s ALA 13 Ca -0.02 -0.55 -0.33 0.00 0.00 0.00 0.00 51.96 51.06 1qni s ALA 13 Cb -0.19 -2.88 -0.11 0.00 0.00 0.00 0.00 23.12 19.94 1qni s ALA 13 CO -0.08 -1.23 1.83 -2.30 0.00 0.00 0.00 175.76 173.98 1qni n PRO 14 N -3.00 2.46 0.00 0.00 -0.02 -1.26 -1.16 135.00 132.03 1qni n PRO 14 Ca 0.07 0.90 0.00 0.00 -2.02 0.00 0.00 63.50 62.45 1qni n PRO 14 Cb 0.59 -2.76 0.00 0.00 -0.02 0.00 0.00 33.50 31.30 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 4.21 2.35 3.86 -1.23 0.00 -1.26 -5.06 105.19 108.06 1qni n GLY 15 Ca 0.20 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.05 3.83 0.19 1.61 2.02 -0.31 -5.09 118.70 120.91 1qni s GLU 16 Ca 0.00 0.63 0.07 0.00 0.02 0.00 0.00 54.97 55.69 1qni s GLU 16 Cb 0.00 -2.31 -0.04 0.00 0.10 0.00 0.00 34.13 31.88 1qni s GLU 16 CO 0.00 -0.11 0.03 -0.51 0.02 0.00 0.00 175.26 174.68 1qni s LEU 17 N -3.92 3.39 0.81 1.80 1.43 -1.26 -4.76 118.68 116.16 1qni s LEU 17 Ca 0.54 -0.39 -0.11 0.00 -1.03 0.00 0.00 54.13 53.13 1qni s LEU 17 Cb -0.10 -2.01 0.08 0.00 0.03 0.00 0.00 46.19 44.19 1qni s LEU 17 CO 0.31 0.07 1.09 -1.81 0.23 0.00 0.00 176.35 176.24 1qni s ASP 18 N -3.12 4.33 -0.01 2.29 1.11 -1.26 -4.99 116.67 115.02 1qni s ASP 18 Ca 0.29 1.42 0.20 0.00 0.18 0.00 0.00 52.55 54.64 1qni s ASP 18 Cb -0.09 -2.16 -0.23 0.00 1.07 0.00 0.00 42.92 41.52 1qni s ASP 18 CO 0.20 -2.09 0.56 -0.62 1.18 0.00 0.00 175.17 174.40 1qni n GLU 19 N -3.52 0.65 -4.26 8.23 1.02 0.46 -4.90 120.64 118.32 1qni n GLU 19 Ca 0.07 -0.02 -0.15 0.00 -0.02 0.00 0.00 57.16 57.04 1qni n GLU 19 Cb 0.55 -1.63 -0.10 0.00 -0.02 0.00 0.00 31.44 30.25 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 -3.17 1.33 -0.08 -0.32 1.51 -0.68 -1.74 117.35 114.20 1qni s TYR 20 Ca -0.06 -0.72 -0.05 0.00 -1.01 0.00 0.00 57.07 55.23 1qni s TYR 20 Cb 0.11 -0.67 -0.04 0.00 -0.11 0.00 0.00 41.96 41.25 1qni s TYR 20 CO 0.85 0.12 0.12 0.71 -1.11 0.00 0.00 175.55 176.25 1qni s TYR 21 N -3.20 3.49 -0.16 2.71 2.02 0.23 -1.87 117.35 120.57 1qni s TYR 21 Ca 0.17 0.41 0.01 0.00 -0.37 0.00 0.00 57.07 57.29 1qni s TYR 21 Cb 0.02 -1.87 0.02 0.00 -0.40 0.00 0.00 41.96 39.72 1qni s TYR 21 CO 0.02 0.66 -0.19 0.20 -1.57 0.00 0.00 175.55 174.67 1qni s GLY 22 N -1.30 1.30 -0.49 0.71 0.00 0.10 -1.53 107.32 106.12 1qni s GLY 22 Ca 0.18 -1.09 -0.10 0.00 0.00 0.00 0.00 44.72 43.72 1qni s GLY 22 CO 0.08 0.23 0.37 -1.36 0.00 0.00 0.00 173.10 172.43 1qni s PHE 23 N 1.16 3.41 -0.07 1.90 0.08 -0.51 0.26 117.98 124.22 1qni s PHE 23 Ca 0.01 -1.82 -0.22 0.00 0.12 0.00 0.00 56.93 55.01 1qni s PHE 23 Cb -0.14 -3.54 -0.04 0.00 -0.57 0.00 0.00 43.02 38.73 1qni s PHE 23 CO -0.08 -1.00 0.64 -1.58 -0.10 0.00 0.00 175.22 173.10 1qni s TRP 24 N 1.35 3.58 0.43 0.36 0.51 0.10 -2.07 118.94 123.21 1qni s TRP 24 Ca 0.06 1.17 -0.23 0.00 -2.12 0.00 0.00 56.10 54.98 1qni s TRP 24 Cb -0.26 -2.72 -0.09 0.00 -0.81 0.00 0.00 33.47 29.59 1qni s TRP 24 CO -0.00 0.15 1.05 -1.54 -0.51 0.00 0.00 176.95 176.09 1qni s SER 25 N 0.61 6.57 0.00 2.95 1.04 -1.09 -0.11 113.70 123.67 1qni s SER 25 Ca 0.34 2.02 0.25 0.00 0.48 0.00 0.00 55.95 59.04 1qni s SER 25 Cb -0.17 -2.58 0.51 0.00 0.10 0.00 0.00 66.02 63.88 1qni s SER 25 CO 0.16 -0.62 1.43 0.61 0.98 0.00 0.00 173.24 175.80 1qni n GLY 26 N 0.14 0.20 7.00 7.32 0.00 0.09 -4.12 105.19 115.81 1qni n GLY 26 Ca 0.07 -0.55 0.00 0.00 0.00 0.00 0.00 46.02 45.53 1qni n GLY 26 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1qni n GLY 27 N 1.31 1.12 0.17 -0.02 0.00 0.03 -2.71 105.19 105.09 1qni n GLY 27 Ca 0.14 -0.76 0.01 0.00 0.00 0.00 0.00 46.02 45.41 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 10.58 0.09 0.05 1.61 1.44 -1.26 -0.95 115.22 126.79 1qni n HIS 28 Ca 0.00 -0.04 -0.02 0.00 -2.01 0.00 0.00 57.72 55.65 1qni n HIS 28 Cb 0.00 -0.02 -0.07 0.00 0.12 0.00 0.00 29.99 30.02 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 0.33 0.00 0.00 -1.40 -0.00 -1.66 -3.42 115.11 108.96 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 0.15 0.00 0.00 0.00 0.00 0.00 0.00 27.48 27.63 1qni h GLN 29 CO 0.00 0.49 0.00 0.41 0.00 0.00 0.00 178.83 179.74 1qni n GLY 30 N 1.37 3.35 3.13 2.39 0.00 -1.12 -4.59 105.19 109.72 1qni n GLY 30 Ca -0.06 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.80 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 -1.41 0.55 -4.92 1.61 0.28 -1.26 -2.01 120.64 113.48 1qni n GLU 31 Ca 0.00 -2.44 -0.31 0.00 -0.16 0.00 0.00 57.16 54.25 1qni n GLU 31 Cb 0.00 -0.26 -0.17 0.00 1.43 0.00 0.00 31.44 32.44 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 -2.00 1.90 -0.15 3.84 1.01 -0.91 -0.73 120.40 123.37 1qni s VAL 32 Ca 0.50 -0.91 -0.06 0.00 0.00 0.00 0.00 61.98 61.51 1qni s VAL 32 Cb -0.04 -1.67 -0.04 0.00 0.00 0.00 0.00 36.38 34.64 1qni s VAL 32 CO 0.32 0.52 0.05 -0.13 0.00 0.00 0.00 175.10 175.86 1qni s ARG 33 N 0.58 3.70 -0.32 2.72 0.52 0.84 -0.17 118.95 126.83 1qni s ARG 33 Ca -0.14 -0.35 -0.12 0.00 -0.52 0.00 0.00 55.73 54.60 1qni s ARG 33 Cb -0.17 -3.10 -0.03 0.00 0.52 0.00 0.00 34.95 32.18 1qni s ARG 33 CO 0.04 0.40 0.22 0.08 0.02 0.00 0.00 175.30 176.07 1qni s VAL 34 N -0.02 5.27 0.27 3.52 1.01 0.17 0.01 120.40 130.63 1qni s VAL 34 Ca 0.05 -0.07 0.09 0.00 0.00 0.00 0.00 61.98 62.06 1qni s VAL 34 Cb -0.12 -3.63 -0.04 0.00 0.00 0.00 0.00 36.38 32.58 1qni s VAL 34 CO 0.01 0.09 0.01 -0.76 0.00 0.00 0.00 175.10 174.46 1qni s LEU 35 N 1.73 3.23 -0.21 3.92 1.43 0.14 0.20 118.68 129.13 1qni s LEU 35 Ca 0.06 -0.63 -0.07 0.00 -1.03 0.00 0.00 54.13 52.46 1qni s LEU 35 Cb -0.17 -1.75 -0.04 0.00 0.03 0.00 0.00 46.19 44.27 1qni s LEU 35 CO 0.11 -0.01 0.07 -0.83 0.23 0.00 0.00 176.35 175.91 1qni s GLY 36 N -3.69 1.85 -0.05 -3.19 0.00 0.58 0.03 107.32 102.85 1qni s GLY 36 Ca 0.32 -0.89 0.01 0.00 0.00 0.00 0.00 44.72 44.16 1qni s GLY 36 CO 0.20 0.23 -0.04 0.14 0.00 0.00 0.00 173.10 173.63 1qni s VAL 37 N 0.83 3.92 -2.06 1.40 1.01 -0.78 0.14 120.40 124.86 1qni s VAL 37 Ca 0.04 -0.48 0.12 0.00 0.00 0.00 0.00 61.98 61.66 1qni s VAL 37 Cb -0.14 -2.65 0.30 0.00 0.00 0.00 0.00 36.38 33.90 1qni s VAL 37 CO 0.02 0.54 1.31 -0.81 0.00 0.00 0.00 175.10 176.17 1qni n PRO 38 N 1.99 1.58 0.27 2.72 -0.04 -1.26 -0.41 135.00 139.86 1qni n PRO 38 Ca -0.17 -0.90 0.15 0.00 -0.04 0.00 0.00 63.50 62.54 1qni n PRO 38 Cb 0.53 -1.25 0.75 0.00 -0.04 0.00 0.00 33.50 33.49 1qni n PRO 38 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1qni h SER 39 N 1.55 0.00 -0.74 3.54 4.64 -1.74 -3.46 113.55 117.33 1qni h SER 39 Ca 0.00 0.00 -0.32 0.00 -0.47 0.00 0.00 61.79 61.00 1qni h SER 39 Cb 0.35 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 62.31 1qni h SER 39 CO 0.00 0.10 -0.29 0.23 -0.87 0.00 0.00 176.83 176.00 1qni n MET 40 N -3.44 -1.16 -3.27 4.77 2.81 0.38 -4.98 117.12 112.22 1qni n MET 40 Ca -0.01 1.05 -0.35 0.00 -1.81 0.00 0.00 57.70 56.57 1qni n MET 40 Cb 0.25 -5.24 -0.06 0.00 -0.71 0.00 0.00 33.22 27.46 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 -3.30 4.04 -0.40 0.03 0.52 -1.17 -4.80 118.95 113.86 1qni s ARG 41 Ca 0.00 0.59 -0.26 0.00 -0.52 0.00 0.00 55.73 55.54 1qni s ARG 41 Cb 0.00 -2.84 0.02 0.00 0.52 0.00 0.00 34.95 32.65 1qni s ARG 41 CO 0.00 0.41 0.96 -2.00 0.02 0.00 0.00 175.30 174.68 1qni s GLU 42 N -2.16 3.78 -0.01 3.54 2.12 -1.26 -0.31 118.70 124.40 1qni s GLU 42 Ca 0.42 0.52 0.13 0.00 0.36 0.00 0.00 54.97 56.40 1qni s GLU 42 Cb -0.15 -3.84 -0.21 0.00 0.26 0.00 0.00 34.13 30.20 1qni s GLU 42 CO 0.20 -1.05 0.72 -0.07 -0.54 0.00 0.00 175.26 174.51 1qni h LEU 43 N 10.31 0.00 -7.00 2.70 3.38 -0.57 -3.49 115.31 120.64 1qni h LEU 43 Ca -0.23 0.00 0.02 0.00 0.09 0.00 0.00 57.88 57.76 1qni h LEU 43 Cb 1.07 0.00 -0.20 0.00 0.09 0.00 0.00 40.66 41.63 1qni h LEU 43 CO 1.01 0.90 0.37 -0.32 0.09 0.00 0.00 178.44 180.50 1qni s MET 44 N -2.67 0.85 -0.12 1.13 0.00 -0.92 -5.00 119.30 112.57 1qni s MET 44 Ca -0.04 0.11 0.01 0.00 0.00 0.00 0.00 55.69 55.77 1qni s MET 44 Cb 0.08 0.40 -0.01 0.00 0.00 0.00 0.00 34.83 35.30 1qni s MET 44 CO 0.82 -0.29 -0.16 1.03 0.00 0.00 0.00 175.02 176.42 1qni s ARG 45 N -1.51 3.23 -0.47 4.11 0.52 -1.26 0.44 118.95 124.01 1qni s ARG 45 Ca -0.05 -0.74 -0.06 0.00 -0.52 0.00 0.00 55.73 54.36 1qni s ARG 45 Cb -0.00 -2.52 0.12 0.00 0.52 0.00 0.00 34.95 33.07 1qni s ARG 45 CO 0.03 0.23 0.30 0.42 0.02 0.00 0.00 175.30 176.30 1qni s ILE 46 N 0.28 3.76 0.38 1.52 1.01 0.76 -4.98 121.20 123.93 1qni s ILE 46 Ca -0.12 -2.06 -0.27 0.00 0.00 0.00 0.00 60.65 58.21 1qni s ILE 46 Cb -0.16 -3.51 -0.11 0.00 0.01 0.00 0.00 42.46 38.69 1qni s ILE 46 CO 0.06 -0.76 1.32 -0.81 0.00 0.00 0.00 174.94 174.76 1qni n PRO 47 N 4.59 2.15 0.09 2.79 -0.04 -1.26 -2.13 135.00 141.19 1qni n PRO 47 Ca -0.03 0.76 0.00 0.00 -0.04 0.00 0.00 63.50 64.19 1qni n PRO 47 Cb 0.41 -2.43 0.00 0.00 -0.04 0.00 0.00 33.50 31.44 1qni n PRO 47 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1qni n VAL 48 N 0.11 0.19 0.46 0.52 0.31 -1.24 -4.37 118.33 114.32 1qni n VAL 48 Ca 0.05 0.06 0.05 0.00 -0.01 0.00 0.00 64.34 64.49 1qni n VAL 48 Cb 0.38 -0.59 0.00 0.00 -0.91 0.00 0.00 33.84 32.73 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 -3.19 0.00 -2.67 3.52 3.72 -0.85 -5.00 117.46 112.99 1qni n PHE 49 Ca 0.00 0.00 -0.22 0.00 -0.05 0.00 0.00 57.45 57.18 1qni n PHE 49 Cb 0.00 0.00 0.07 0.00 -0.94 0.00 0.00 39.48 38.61 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 -1.37 4.81 -0.30 4.37 6.03 -1.25 -3.83 114.94 123.40 1qni s ASN 50 Ca 0.09 -0.30 -0.00 0.00 -1.03 0.00 0.00 52.86 51.62 1qni s ASN 50 Cb 0.08 -0.30 0.06 0.00 -3.03 0.00 0.00 41.25 38.06 1qni s ASN 50 CO 0.26 -1.51 -0.01 -0.69 -2.03 0.00 0.00 177.10 173.11 1qni s VAL 51 N -2.93 2.75 -0.38 3.54 1.01 -1.26 -4.61 120.40 118.52 1qni s VAL 51 Ca 0.62 -1.56 -0.23 0.00 0.00 0.00 0.00 61.98 60.82 1qni s VAL 51 Cb -0.07 -2.63 0.01 0.00 0.00 0.00 0.00 36.38 33.68 1qni s VAL 51 CO 0.41 -0.15 0.77 -0.62 0.00 0.00 0.00 175.10 175.50 1qni s ASP 52 N 1.23 6.51 0.59 3.32 2.15 -0.48 -4.91 116.67 125.07 1qni s ASP 52 Ca -0.04 0.24 0.34 0.00 0.43 0.00 0.00 52.55 53.52 1qni s ASP 52 Cb -0.20 -2.39 1.87 0.00 -0.30 0.00 0.00 42.92 41.90 1qni s ASP 52 CO -0.03 -0.75 2.21 -1.28 -0.17 0.00 0.00 175.17 175.15 1qni h SER 53 N 8.57 0.00 0.00 -0.34 0.87 -1.95 -0.30 113.55 120.40 1qni h SER 53 Ca -0.25 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.31 1qni h SER 53 Cb 1.09 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.05 1qni h SER 53 CO 0.91 0.04 0.00 0.00 -0.53 0.00 0.00 176.83 177.25 1qni n ALA 54 N -2.21 -0.01 0.34 6.23 0.00 -1.26 -4.33 120.51 119.27 1qni n ALA 54 Ca -0.02 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.55 1qni n ALA 54 Cb 0.15 0.00 0.57 0.00 0.00 0.00 0.00 19.45 20.16 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 -1.90 -3.35 112.91 109.01 1qni h THR 55 Ca 0.00 -0.24 0.00 0.00 -0.55 0.00 0.00 66.41 65.62 1qni h THR 55 Cb 0.00 1.00 0.00 0.00 -1.73 0.00 0.00 68.15 67.42 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 -0.21 0.63 3.68 5.82 0.00 -0.13 -1.76 105.19 113.22 1qni n GLY 56 Ca 0.01 -0.17 -0.42 0.00 0.00 0.00 0.00 46.02 45.44 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 2.07 0.00 1.61 -0.11 -1.20 0.13 118.94 119.43 1qni s TRP 57 Ca 0.00 0.11 0.00 0.00 1.22 0.00 0.00 56.10 57.43 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 -4.28 0.00 0.41 -4.62 0.00 0.00 176.95 168.46 1qni n GLY 58 N 4.16 2.62 0.14 5.86 0.00 -1.26 -1.39 105.19 115.31 1qni n GLY 58 Ca 0.17 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.93 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 -0.64 1.52 -0.81 -0.61 5.41 0.12 -4.74 119.36 119.60 1qni n ILE 59 Ca 0.00 -0.45 -0.30 0.00 1.00 0.00 0.00 62.75 63.00 1qni n ILE 59 Cb 0.00 -1.73 0.18 0.00 -0.71 0.00 0.00 39.64 37.38 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 -2.51 2.29 -0.03 1.39 -4.23 0.48 -4.68 115.64 108.35 1qni s THR 60 Ca -0.37 0.10 0.15 0.00 -1.18 0.00 0.00 61.69 60.38 1qni s THR 60 Cb 0.13 -2.27 0.03 0.00 1.34 0.00 0.00 72.50 71.74 1qni s THR 60 CO 0.53 -0.12 1.49 0.78 -0.54 0.00 0.00 174.62 176.75 1qni h ASN 61 N -1.96 0.00 0.14 3.99 -0.26 -1.81 -2.02 115.58 113.65 1qni h ASN 61 Ca -0.50 0.00 -0.01 0.00 -0.56 0.00 0.00 56.30 55.23 1qni h ASN 61 Cb 1.29 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.55 1qni h ASN 61 CO 0.48 0.56 -0.07 -0.33 -1.06 0.00 0.00 177.43 177.01 1qni h GLU 62 N 0.00 -0.18 -0.98 0.81 3.07 -1.91 -2.08 114.58 113.31 1qni h GLU 62 Ca -0.01 0.01 0.08 0.00 -0.50 0.00 0.00 59.36 58.95 1qni h GLU 62 Cb 1.33 0.04 -0.07 0.00 -0.84 0.00 0.00 28.75 29.21 1qni h GLU 62 CO 0.07 0.28 0.62 0.66 -1.40 0.00 0.00 179.01 179.24 1qni h SER 63 N -0.77 0.97 -0.08 1.42 4.64 -1.90 -2.18 113.55 115.64 1qni h SER 63 Ca -0.02 0.02 -0.12 0.00 -0.47 0.00 0.00 61.79 61.20 1qni h SER 63 Cb 0.54 -0.18 -0.01 0.00 -0.31 0.00 0.00 62.40 62.43 1qni h SER 63 CO 0.03 0.59 -0.33 0.11 -0.87 0.00 0.00 176.83 176.36 1qni h LYS 64 N 1.09 0.57 -0.80 4.77 1.57 -1.39 -1.50 116.57 120.88 1qni h LYS 64 Ca 0.44 -0.26 -0.05 0.00 -1.87 0.00 0.00 60.65 58.91 1qni h LYS 64 Cb 0.25 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.52 1qni h LYS 64 CO -0.20 0.83 0.32 1.49 -0.57 0.00 0.00 179.45 181.32 1qni h GLU 65 N 0.48 1.20 -0.03 3.15 4.81 -0.76 0.23 114.58 123.66 1qni h GLU 65 Ca 0.05 -0.22 -0.01 0.00 -0.13 0.00 0.00 59.36 59.06 1qni h GLU 65 Cb 0.81 -0.19 -0.00 0.00 0.63 0.00 0.00 28.75 30.00 1qni h GLU 65 CO 0.07 0.97 -0.02 0.82 -0.73 0.00 0.00 179.01 180.12 1qni h ILE 66 N 1.17 1.33 -0.68 2.32 2.04 -1.33 -2.95 117.51 119.42 1qni h ILE 66 Ca 0.27 -1.01 0.08 0.00 1.00 0.00 0.00 64.86 65.19 1qni h ILE 66 Cb 0.22 1.95 -0.04 0.00 -0.74 0.00 0.00 36.82 38.20 1qni h ILE 66 CO -0.02 0.27 0.45 -0.07 0.00 0.00 0.00 178.15 178.78 1qni h LEU 67 N -0.33 0.56 0.00 1.44 3.38 -1.06 -3.34 115.31 115.95 1qni h LEU 67 Ca 0.01 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1qni h LEU 67 Cb 0.45 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.08 1qni h LEU 67 CO 0.00 0.35 0.00 0.61 0.09 0.00 0.00 178.44 179.50 1qni n GLY 68 N -1.47 1.93 0.66 0.83 0.00 0.79 -4.94 105.19 102.99 1qni n GLY 68 Ca 0.10 -0.29 0.03 0.00 0.00 0.00 0.00 46.02 45.86 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 -3.19 1.61 -0.02 0.00 -1.26 -4.63 105.19 97.70 1qni n GLY 69 Ca 0.00 -1.18 -0.03 0.00 0.00 0.00 0.00 46.02 44.81 1qni n GLY 69 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1qni n ASP 70 N -2.43 3.99 -3.63 1.61 5.68 -1.26 -4.84 116.55 115.68 1qni n ASP 70 Ca -0.02 -2.82 -0.12 0.00 -0.50 0.00 0.00 54.79 51.33 1qni n ASP 70 Cb 0.25 -0.67 -0.07 0.00 -1.14 0.00 0.00 41.12 39.49 1qni n ASP 70 CO 0.00 0.00 0.00 -1.58 -1.33 0.00 0.00 177.20 174.29 1qni s GLN 71 N -2.24 0.69 0.21 0.11 0.74 -1.26 -5.15 119.66 112.76 1qni s GLN 71 Ca 0.38 0.81 -0.27 0.00 0.05 0.00 0.00 55.36 56.33 1qni s GLN 71 Cb 0.30 0.34 -0.09 0.00 1.10 0.00 0.00 33.01 34.67 1qni s GLN 71 CO 0.10 -0.09 0.86 -1.14 -0.55 0.00 0.00 175.29 174.47 1qni s GLN 72 N 0.28 4.69 -0.14 1.67 0.74 -1.26 -5.05 119.66 120.60 1qni s GLN 72 Ca 0.01 1.31 -0.00 0.00 0.05 0.00 0.00 55.36 56.73 1qni s GLN 72 Cb -0.05 -3.24 0.03 0.00 1.10 0.00 0.00 33.01 30.85 1qni s GLN 72 CO -0.02 0.53 -0.11 0.71 -0.55 0.00 0.00 175.29 175.85 1qni s TYR 73 N -1.20 1.85 -2.23 1.67 2.02 -1.26 -5.00 117.35 113.21 1qni s TYR 73 Ca 0.39 -1.02 0.25 0.00 -0.37 0.00 0.00 57.07 56.32 1qni s TYR 73 Cb -0.24 -1.42 1.16 0.00 -0.40 0.00 0.00 41.96 41.05 1qni s TYR 73 CO 0.29 -0.60 1.78 1.28 -1.57 0.00 0.00 175.55 176.73 1qni n LEU 74 N 4.85 0.92 -4.26 -1.29 4.77 -1.26 -4.89 117.00 115.84 1qni n LEU 74 Ca -0.15 -0.35 -0.14 0.00 -0.03 0.00 0.00 56.01 55.34 1qni n LEU 74 Cb 0.50 -0.03 -0.10 0.00 -2.33 0.00 0.00 43.42 41.46 1qni n LEU 74 CO 0.19 0.17 -0.30 0.54 -1.33 0.00 0.00 177.39 176.67 1qni s ASN 75 N -1.79 1.08 0.21 -1.43 6.03 -1.25 -4.37 114.94 113.43 1qni s ASN 75 Ca 0.36 -1.26 -0.23 0.00 -1.03 0.00 0.00 52.86 50.71 1qni s ASN 75 Cb 0.18 0.16 0.04 0.00 -3.03 0.00 0.00 41.25 38.61 1qni s ASN 75 CO 0.30 -0.65 0.80 -0.83 -2.03 0.00 0.00 177.10 174.68 1qni s GLY 76 N -3.21 -0.21 -0.37 0.45 0.00 -1.25 -4.79 107.32 97.94 1qni s GLY 76 Ca 0.29 -0.02 0.02 0.00 0.00 0.00 0.00 44.72 45.01 1qni s GLY 76 CO 0.07 -0.01 0.30 -0.35 0.00 0.00 0.00 173.10 173.12 1qni s ASP 77 N -2.89 1.96 -0.16 1.64 2.15 -1.26 -3.89 116.67 114.22 1qni s ASP 77 Ca 0.10 -1.95 -0.12 0.00 0.43 0.00 0.00 52.55 51.01 1qni s ASP 77 Cb -0.04 0.09 -0.05 0.00 -0.30 0.00 0.00 42.92 42.63 1qni s ASP 77 CO 0.03 -0.27 0.25 0.00 -0.17 0.00 0.00 175.17 175.00 1qni n HIS 79 N 3.37 0.00 -3.89 0.00 8.25 -1.26 -0.79 115.22 120.90 1qni n HIS 79 Ca -0.14 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.02 1qni n HIS 79 Cb 0.52 -0.14 -0.15 0.00 1.12 0.00 0.00 29.99 31.34 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 -2.07 2.85 -0.18 4.41 3.76 -1.26 -1.67 115.29 121.13 1qni s HIS 80 Ca -0.03 -2.44 -0.20 0.00 -0.15 0.00 0.00 55.06 52.24 1qni s HIS 80 Cb 0.01 -2.38 -0.03 0.00 1.11 0.00 0.00 32.58 31.29 1qni s HIS 80 CO 0.10 -0.92 0.60 -1.25 -0.85 0.00 0.00 174.74 172.43 1qni s PRO 81 N 1.22 4.24 -0.00 8.40 0.04 -1.26 -4.13 135.00 143.51 1qni s PRO 81 Ca 0.10 0.59 0.02 0.00 0.04 0.00 0.00 61.00 61.76 1qni s PRO 81 Cb -0.18 -3.55 -0.01 0.00 0.04 0.00 0.00 34.50 30.80 1qni s PRO 81 CO -0.16 -0.17 -0.08 -1.01 0.04 0.00 0.00 177.00 175.63 1qni s HIS 82 N 1.66 0.71 -0.12 0.56 3.76 -0.47 -4.37 115.29 117.02 1qni s HIS 82 Ca 0.28 -0.16 -0.06 0.00 -0.15 0.00 0.00 55.06 54.97 1qni s HIS 82 Cb -0.16 -0.45 -0.04 0.00 1.11 0.00 0.00 32.58 33.04 1qni s HIS 82 CO 0.11 -0.01 0.10 -1.50 -0.85 0.00 0.00 174.74 172.59 1qni s ILE 83 N -0.29 5.18 0.75 0.60 2.07 -1.26 -0.28 121.20 127.97 1qni s ILE 83 Ca 0.02 0.09 -0.15 0.00 -1.41 0.00 0.00 60.65 59.20 1qni s ILE 83 Cb -0.04 -3.26 0.04 0.00 0.13 0.00 0.00 42.46 39.33 1qni s ILE 83 CO -0.00 0.59 1.09 -1.54 -1.91 0.00 0.00 174.94 173.17 1qni n SER 84 N 2.26 0.86 -4.27 4.50 3.41 -0.26 -4.88 113.62 115.25 1qni n SER 84 Ca -0.19 0.65 -0.15 0.00 -0.26 0.00 0.00 58.87 58.92 1qni n SER 84 Cb 0.54 -1.46 -0.10 0.00 -0.26 0.00 0.00 64.21 62.93 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 -3.67 1.17 -0.19 4.33 1.00 -1.26 -1.38 119.30 119.30 1qni s MET 85 Ca 0.74 -1.56 -0.03 0.00 0.00 0.00 0.00 55.69 54.84 1qni s MET 85 Cb -0.32 -0.46 0.06 0.00 0.00 0.00 0.00 34.83 34.11 1qni s MET 85 CO 0.49 -0.07 0.05 0.99 0.00 0.00 0.00 175.02 176.48 1qni s THR 86 N -3.51 0.36 -1.27 2.05 2.01 -0.01 -1.00 115.64 114.27 1qni s THR 86 Ca 0.24 -0.48 -0.02 0.00 0.31 0.00 0.00 61.69 61.74 1qni s THR 86 Cb 0.05 -0.92 -0.00 0.00 0.01 0.00 0.00 72.50 71.63 1qni s THR 86 CO 0.05 -0.25 0.74 -0.67 -0.69 0.00 0.00 174.62 173.80 1qni n ASP 87 N 5.11 -1.74 -0.08 3.53 2.03 0.24 -2.50 116.55 123.14 1qni n ASP 87 Ca -0.08 -0.81 -0.01 0.00 0.52 0.00 0.00 54.79 54.41 1qni n ASP 87 Cb 0.47 -4.17 -0.00 0.00 -0.72 0.00 0.00 41.12 36.70 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 -1.52 0.42 3.19 0.27 0.00 -0.40 -4.91 105.19 102.24 1qni n GLY 88 Ca -0.28 -0.11 -0.23 0.00 0.00 0.00 0.00 46.02 45.41 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 -0.97 1.14 0.07 1.61 0.52 -1.04 -1.02 118.95 119.25 1qni s ARG 89 Ca 0.00 -0.82 -0.31 0.00 -0.52 0.00 0.00 55.73 54.08 1qni s ARG 89 Cb 0.00 -1.20 -0.08 0.00 0.52 0.00 0.00 34.95 34.19 1qni s ARG 89 CO 0.00 0.30 1.66 0.71 0.02 0.00 0.00 175.30 178.00 1qni s TYR 90 N -0.80 2.40 -2.25 -0.53 2.02 -1.26 -0.83 117.35 116.10 1qni s TYR 90 Ca 0.04 0.30 0.24 0.00 -0.37 0.00 0.00 57.07 57.28 1qni s TYR 90 Cb -0.08 -3.98 0.21 0.00 -0.40 0.00 0.00 41.96 37.71 1qni s TYR 90 CO 0.01 -3.93 1.23 -0.40 -1.57 0.00 0.00 175.55 170.90 1qni n ASP 91 N 5.61 2.09 -1.23 2.29 5.68 -0.48 -4.86 116.55 125.64 1qni n ASP 91 Ca 0.16 -1.55 -0.15 0.00 -0.50 0.00 0.00 54.79 52.75 1qni n ASP 91 Cb 0.40 0.29 -0.06 0.00 -1.14 0.00 0.00 41.12 40.62 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 1.34 0.08 6.12 0.00 -1.24 -4.92 105.19 107.95 1qni n GLY 92 Ca 0.11 -0.30 -0.09 0.00 0.00 0.00 0.00 46.02 45.74 1qni n GLY 92 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1qni h LYS 93 N 0.00 0.00 -5.74 1.61 3.64 -1.87 -3.43 116.57 110.78 1qni h LYS 93 Ca -0.32 0.00 -0.52 0.00 -1.27 0.00 0.00 60.65 58.54 1qni h LYS 93 Cb 1.03 0.00 -0.14 0.00 -0.41 0.00 0.00 32.23 32.70 1qni h LYS 93 CO 0.45 0.32 -0.72 0.71 -2.27 0.00 0.00 179.45 177.94 1qni s TYR 94 N -2.22 1.99 -0.06 1.91 2.02 -1.26 -2.12 117.35 117.60 1qni s TYR 94 Ca -0.18 -0.54 -0.01 0.00 -0.37 0.00 0.00 57.07 55.97 1qni s TYR 94 Cb 0.03 -0.99 0.03 0.00 -0.40 0.00 0.00 41.96 40.63 1qni s TYR 94 CO 0.32 0.45 0.01 -1.17 -1.57 0.00 0.00 175.55 173.59 1qni s LEU 95 N -3.43 0.54 0.04 -1.29 0.20 -0.76 -1.10 118.68 112.89 1qni s LEU 95 Ca 0.27 -0.04 0.04 0.00 0.69 0.00 0.00 54.13 55.09 1qni s LEU 95 Cb -0.00 -0.35 -0.04 0.00 -0.43 0.00 0.00 46.19 45.37 1qni s LEU 95 CO 0.11 -0.20 -0.05 -0.36 -0.29 0.00 0.00 176.35 175.57 1qni s PHE 96 N 1.91 2.91 0.07 5.38 0.40 0.61 0.29 117.98 129.56 1qni s PHE 96 Ca 0.03 -0.04 -0.09 0.00 -0.60 0.00 0.00 56.93 56.23 1qni s PHE 96 Cb -0.12 -1.57 0.00 0.00 0.51 0.00 0.00 43.02 41.84 1qni s PHE 96 CO -0.04 0.42 0.20 -1.50 0.70 0.00 0.00 175.22 175.00 1qni s ILE 97 N -1.12 0.12 0.39 0.64 2.07 -0.65 -1.36 121.20 121.28 1qni s ILE 97 Ca 0.20 -1.02 0.06 0.00 -1.41 0.00 0.00 60.65 58.48 1qni s ILE 97 Cb -0.11 -1.13 0.00 0.00 0.13 0.00 0.00 42.46 41.35 1qni s ILE 97 CO 0.12 -0.57 0.55 0.54 -1.91 0.00 0.00 174.94 173.67 1qni s ASN 98 N -2.48 5.80 -0.27 4.50 2.20 -1.26 -0.41 114.94 123.02 1qni s ASN 98 Ca 0.00 -0.21 -0.02 0.00 -0.94 0.00 0.00 52.86 51.69 1qni s ASN 98 Cb 0.02 -1.04 0.09 0.00 -2.00 0.00 0.00 41.25 38.32 1qni s ASN 98 CO -0.08 -0.62 0.09 -0.62 -2.94 0.00 0.00 177.10 172.93 1qni s ASP 99 N -4.26 3.58 0.18 3.54 2.15 0.69 -3.43 116.67 119.13 1qni s ASP 99 Ca 0.50 -1.31 0.04 0.00 0.43 0.00 0.00 52.55 52.20 1qni s ASP 99 Cb -0.10 -0.64 0.05 0.00 -0.30 0.00 0.00 42.92 41.93 1qni s ASP 99 CO 0.33 -0.39 1.42 0.50 -0.17 0.00 0.00 175.17 176.86 1qni h LYS 100 N 8.22 0.16 0.93 4.34 3.64 -0.86 -2.64 116.57 130.37 1qni h LYS 100 Ca -0.16 -0.16 -0.05 0.00 -1.27 0.00 0.00 60.65 59.01 1qni h LYS 100 Cb 1.04 0.04 0.01 0.00 -0.41 0.00 0.00 32.23 32.92 1qni h LYS 100 CO 0.42 0.89 -0.44 0.00 -2.27 0.00 0.00 179.45 178.05 1qni h ALA 101 N 1.05 -1.24 -0.57 5.00 0.00 -1.88 -3.34 119.26 118.28 1qni h ALA 101 Ca -0.03 -0.27 -0.38 0.00 0.00 0.00 0.00 54.91 54.22 1qni h ALA 101 Cb 1.43 0.48 -0.25 0.00 0.00 0.00 0.00 17.79 19.45 1qni h ALA 101 CO 0.12 -1.18 -0.31 0.09 0.00 0.00 0.00 179.25 177.98 1qni n ASN 102 N -5.61 4.13 -3.60 0.00 3.02 -1.26 -4.84 115.26 107.10 1qni n ASN 102 Ca -0.16 -3.79 -0.19 0.00 -0.03 0.00 0.00 54.58 50.41 1qni n ASN 102 Cb 0.49 -0.55 0.00 0.00 -0.61 0.00 0.00 39.78 39.12 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 -0.92 -5.31 -4.03 3.41 -1.04 -1.09 -4.94 114.28 100.34 1qni n THR 103 Ca 0.40 -0.13 -0.09 0.00 -2.04 0.00 0.00 64.05 62.19 1qni n THR 103 Cb 0.91 -4.08 -0.09 0.00 -1.82 0.00 0.00 70.33 65.26 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 -4.52 0.91 -0.01 -2.82 0.52 -1.01 -2.83 118.95 109.19 1qni s ARG 104 Ca 0.03 -1.24 0.04 0.00 -0.52 0.00 0.00 55.73 54.04 1qni s ARG 104 Cb -0.01 0.29 -0.01 0.00 0.52 0.00 0.00 34.95 35.74 1qni s ARG 104 CO 0.86 -0.28 -0.12 0.08 0.02 0.00 0.00 175.30 175.86 1qni s VAL 105 N -3.97 0.94 0.16 3.52 1.01 -0.54 -0.22 120.40 121.31 1qni s VAL 105 Ca 0.16 -0.50 0.09 0.00 0.00 0.00 0.00 61.98 61.73 1qni s VAL 105 Cb 0.06 -0.79 -0.04 0.00 0.00 0.00 0.00 36.38 35.61 1qni s VAL 105 CO -0.03 0.27 -0.20 0.00 0.00 0.00 0.00 175.10 175.13 1qni s ALA 106 N -0.22 2.13 -0.05 5.51 0.00 0.46 -1.32 121.76 128.26 1qni s ALA 106 Ca 0.04 -1.49 0.04 0.00 0.00 0.00 0.00 51.96 50.55 1qni s ALA 106 Cb -0.05 -0.24 -0.00 0.00 0.00 0.00 0.00 23.12 22.83 1qni s ALA 106 CO -0.00 0.31 -0.19 0.50 0.00 0.00 0.00 175.76 176.39 1qni s ARG 107 N -2.60 1.98 -0.06 0.00 3.52 -0.40 -1.64 118.95 119.75 1qni s ARG 107 Ca 0.16 -0.67 0.05 0.00 -0.13 0.00 0.00 55.73 55.14 1qni s ARG 107 Cb -0.07 -1.69 -0.02 0.00 -1.56 0.00 0.00 34.95 31.61 1qni s ARG 107 CO 0.07 0.25 -0.20 0.42 -0.81 0.00 0.00 175.30 175.03 1qni s ILE 108 N 0.05 2.53 -0.33 4.11 1.01 0.15 0.61 121.20 129.33 1qni s ILE 108 Ca -0.05 -0.90 -0.24 0.00 0.00 0.00 0.00 60.65 59.45 1qni s ILE 108 Cb -0.12 -1.96 0.01 0.00 0.01 0.00 0.00 42.46 40.39 1qni s ILE 108 CO 0.03 0.57 0.84 -0.13 0.00 0.00 0.00 174.94 176.25 1qni s ARG 109 N -0.36 3.90 0.11 2.79 0.52 -0.18 -1.83 118.95 123.90 1qni s ARG 109 Ca 0.03 0.57 0.22 0.00 -0.52 0.00 0.00 55.73 56.02 1qni s ARG 109 Cb -0.12 -3.76 0.88 0.00 0.52 0.00 0.00 34.95 32.47 1qni s ARG 109 CO 0.02 -0.78 1.68 1.28 0.02 0.00 0.00 175.30 177.52 1qni n LEU 110 N 6.40 0.33 0.07 2.53 4.77 -0.90 -0.61 117.00 129.59 1qni n LEU 110 Ca 0.05 0.56 -0.07 0.00 -0.03 0.00 0.00 56.01 56.52 1qni n LEU 110 Cb 0.48 -0.49 0.07 0.00 -2.33 0.00 0.00 43.42 41.15 1qni n LEU 110 CO 0.53 -0.28 0.41 -2.24 -1.33 0.00 0.00 177.39 174.48 1qni h ASP 111 N 0.00 0.33 0.00 -1.43 2.03 -1.79 -3.34 116.42 112.22 1qni h ASP 111 Ca 0.00 -0.21 0.00 0.00 -0.73 0.00 0.00 57.03 56.09 1qni h ASP 111 Cb 0.41 -0.10 0.00 0.00 -0.83 0.00 0.00 39.33 38.81 1qni h ASP 111 CO 0.00 0.91 0.00 2.30 -1.03 0.00 0.00 179.24 181.42 1qni n ILE 112 N -3.83 0.00 -3.32 4.15 -5.35 -1.17 -0.86 119.36 108.97 1qni n ILE 112 Ca -0.03 -0.47 -0.16 0.00 -0.27 0.00 0.00 62.75 61.82 1qni n ILE 112 Cb 0.67 1.05 0.05 0.00 -1.74 0.00 0.00 39.64 39.67 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 -0.13 -1.86 -3.79 6.28 2.81 0.22 -5.04 117.12 115.60 1qni n MET 113 Ca 0.00 0.88 -0.13 0.00 -1.81 0.00 0.00 57.70 56.65 1qni n MET 113 Cb 0.01 -5.38 -0.10 0.00 -0.71 0.00 0.00 33.22 27.03 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 -4.50 0.44 0.25 0.03 -0.14 -1.14 -4.85 119.74 109.82 1qni s LYS 114 Ca 0.38 0.09 -0.30 0.00 -1.36 0.00 0.00 55.97 54.78 1qni s LYS 114 Cb -0.07 0.20 -0.11 0.00 -1.68 0.00 0.00 37.83 36.17 1qni s LYS 114 CO 0.77 -0.09 1.57 0.99 -0.76 0.00 0.00 175.35 177.83 1qni s THR 115 N -0.50 2.30 -0.15 2.17 2.01 -1.26 -1.01 115.64 119.20 1qni s THR 115 Ca -0.06 0.24 0.02 0.00 0.31 0.00 0.00 61.69 62.20 1qni s THR 115 Cb -0.04 -3.15 -0.11 0.00 0.01 0.00 0.00 72.50 69.21 1qni s THR 115 CO 0.02 0.03 -0.11 -0.67 -0.69 0.00 0.00 174.62 173.20 1qni n ASP 116 N 2.74 2.72 -4.03 3.53 2.03 0.20 -4.83 116.55 118.91 1qni n ASP 116 Ca 0.10 -0.07 -0.08 0.00 0.52 0.00 0.00 54.79 55.26 1qni n ASP 116 Cb 0.38 -0.10 -0.10 0.00 -0.72 0.00 0.00 41.12 40.58 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 -2.30 0.49 -0.17 -0.67 -0.14 -0.94 -4.96 119.74 111.05 1qni s LYS 117 Ca -0.18 -0.93 -0.04 0.00 -1.36 0.00 0.00 55.97 53.45 1qni s LYS 117 Cb 0.05 0.17 0.08 0.00 -1.68 0.00 0.00 37.83 36.45 1qni s LYS 117 CO 0.37 -0.09 0.26 0.42 -0.76 0.00 0.00 175.35 175.55 1qni s ILE 118 N -2.81 -0.40 -0.10 2.17 1.01 -1.26 -1.27 121.20 118.54 1qni s ILE 118 Ca -0.03 0.11 0.01 0.00 0.00 0.00 0.00 60.65 60.74 1qni s ILE 118 Cb -0.00 -0.56 -0.02 0.00 0.01 0.00 0.00 42.46 41.89 1qni s ILE 118 CO -0.06 -0.02 -0.14 -0.89 0.00 0.00 0.00 174.94 173.83 1qni s THR 119 N 2.40 2.97 -0.15 2.92 2.01 -0.43 -4.84 115.64 120.51 1qni s THR 119 Ca 0.04 -0.71 -0.19 0.00 0.31 0.00 0.00 61.69 61.14 1qni s THR 119 Cb -0.14 -2.21 -0.04 0.00 0.01 0.00 0.00 72.50 70.13 1qni s THR 119 CO -0.10 0.55 0.51 -1.00 -0.69 0.00 0.00 174.62 173.88 1qni s HIS 120 N 0.00 3.45 -0.14 4.92 3.76 -1.26 -1.46 115.29 124.57 1qni s HIS 120 Ca -0.04 0.86 -0.21 0.00 -0.15 0.00 0.00 55.06 55.52 1qni s HIS 120 Cb -0.14 -2.62 -0.03 0.00 1.11 0.00 0.00 32.58 30.89 1qni s HIS 120 CO 0.04 0.05 0.60 0.42 -0.85 0.00 0.00 174.74 175.00 1qni s ILE 121 N 1.08 5.08 0.52 0.60 -1.09 -1.13 -5.00 121.20 121.25 1qni s ILE 121 Ca 0.26 1.18 -0.11 0.00 -2.23 0.00 0.00 60.65 59.75 1qni s ILE 121 Cb -0.15 -3.93 -0.05 0.00 -1.58 0.00 0.00 42.46 36.74 1qni s ILE 121 CO 0.10 0.21 0.91 -2.16 -1.23 0.00 0.00 174.94 172.78 1qni s PRO 122 N 1.25 3.72 -0.91 2.79 0.04 -1.26 -4.37 135.00 136.26 1qni s PRO 122 Ca 0.30 0.64 -0.04 0.00 0.04 0.00 0.00 61.00 61.94 1qni s PRO 122 Cb -0.16 -2.22 0.03 0.00 0.04 0.00 0.00 34.50 32.19 1qni s PRO 122 CO 0.12 -0.30 0.18 0.09 0.04 0.00 0.00 177.00 177.13 1qni n ASN 123 N -2.02 -3.06 -3.79 6.66 3.02 -1.26 -4.92 115.26 109.89 1qni n ASN 123 Ca 0.04 0.02 -0.10 0.00 -0.03 0.00 0.00 54.58 54.52 1qni n ASN 123 Cb 0.54 -2.61 -0.06 0.00 -0.61 0.00 0.00 39.78 37.04 1qni n ASN 123 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1qni s VAL 124 N -2.60 0.08 0.03 2.41 0.11 -1.26 -4.85 120.40 114.31 1qni s VAL 124 Ca 0.16 -0.97 0.03 0.00 -2.93 0.00 0.00 61.98 58.27 1qni s VAL 124 Cb -0.09 -1.46 -0.02 0.00 -1.53 0.00 0.00 36.38 33.28 1qni s VAL 124 CO 0.20 -0.35 -0.08 -1.10 -3.33 0.00 0.00 175.10 170.44 1qni s GLN 125 N -3.87 0.57 -0.29 1.54 -0.21 -1.26 -4.97 119.66 111.17 1qni s GLN 125 Ca 0.08 -0.56 -0.01 0.00 0.02 0.00 0.00 55.36 54.89 1qni s GLN 125 Cb 0.02 -0.46 0.00 0.00 1.00 0.00 0.00 33.01 33.57 1qni s GLN 125 CO -0.07 0.11 0.04 0.00 -2.12 0.00 0.00 175.29 173.25 1qni n ALA 126 N 2.06 -3.32 -2.61 6.09 0.00 -1.25 -3.16 120.51 118.31 1qni n ALA 126 Ca -0.18 0.49 -0.43 0.00 0.00 0.00 0.00 53.44 53.31 1qni n ALA 126 Cb 0.56 -1.11 -0.03 0.00 0.00 0.00 0.00 19.45 18.87 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 -1.63 4.55 0.00 0.00 -1.09 -1.23 -0.42 121.20 121.39 1qni s ILE 127 Ca 0.02 1.34 0.00 0.00 -2.23 0.00 0.00 60.65 59.78 1qni s ILE 127 Cb -0.00 -4.36 0.00 0.00 -1.58 0.00 0.00 42.46 36.51 1qni s ILE 127 CO 0.71 -0.54 0.00 1.57 -1.23 0.00 0.00 174.94 175.45 1qni n HIS 128 N 6.84 0.00 -1.77 3.97 -0.00 0.47 -2.59 115.22 122.14 1qni n HIS 128 Ca 0.09 0.00 -0.42 0.00 0.46 0.00 0.00 57.72 57.85 1qni n HIS 128 Cb 0.48 0.00 -0.02 0.00 -0.12 0.00 0.00 29.99 30.33 1qni n HIS 128 CO 0.00 0.00 0.00 0.20 0.46 0.00 0.00 176.34 177.00 1qni s GLY 129 N -1.35 1.83 -0.16 1.57 0.00 -0.55 -4.75 107.32 103.92 1qni s GLY 129 Ca 0.00 1.57 -0.09 0.00 0.00 0.00 0.00 44.72 46.20 1qni s GLY 129 CO 0.00 2.65 0.39 -2.27 0.00 0.00 0.00 173.10 173.87 1qni s LEU 130 N 0.05 -0.02 0.14 0.66 0.20 -1.26 0.13 118.68 118.57 1qni s LEU 130 Ca 0.67 0.84 -0.14 0.00 0.69 0.00 0.00 54.13 56.19 1qni s LEU 130 Cb -0.48 1.27 0.02 0.00 -0.43 0.00 0.00 46.19 46.57 1qni s LEU 130 CO 0.43 -0.19 0.39 -0.13 -0.29 0.00 0.00 176.35 176.55 1qni s ARG 131 N 1.37 1.13 0.15 1.98 0.52 -0.63 -4.88 118.95 118.59 1qni s ARG 131 Ca -0.09 -0.85 0.04 0.00 -0.52 0.00 0.00 55.73 54.31 1qni s ARG 131 Cb -0.09 0.45 -0.04 0.00 0.52 0.00 0.00 34.95 35.80 1qni s ARG 131 CO -0.12 -0.44 0.16 -0.51 0.02 0.00 0.00 175.30 174.41 1qni s LEU 132 N -2.85 3.92 0.49 2.53 1.43 -1.26 -0.43 118.68 122.51 1qni s LEU 132 Ca 0.07 -0.05 -0.22 0.00 -1.03 0.00 0.00 54.13 52.90 1qni s LEU 132 Cb 0.02 -2.53 -0.06 0.00 0.03 0.00 0.00 46.19 43.64 1qni s LEU 132 CO -0.08 0.08 1.21 -1.58 0.23 0.00 0.00 176.35 176.21 1qni s GLN 133 N -3.04 3.53 -0.18 1.70 0.74 -0.97 -4.57 119.66 116.88 1qni s GLN 133 Ca 0.32 1.88 0.03 0.00 0.05 0.00 0.00 55.36 57.64 1qni s GLN 133 Cb -0.11 -2.32 -0.13 0.00 1.10 0.00 0.00 33.01 31.56 1qni s GLN 133 CO 0.24 -0.77 -0.13 1.63 -0.55 0.00 0.00 175.29 175.72 1qni n LYS 134 N -0.74 0.68 -4.52 1.67 5.02 -1.26 -3.79 118.16 115.22 1qni n LYS 134 Ca 0.09 0.09 -0.21 0.00 -2.02 0.00 0.00 58.31 56.26 1qni n LYS 134 Cb 0.48 -1.37 -0.15 0.00 -0.02 0.00 0.00 35.03 33.97 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 -2.37 0.96 0.29 -0.18 1.01 -1.26 -1.27 120.40 117.59 1qni s VAL 135 Ca -0.22 -0.56 0.22 0.00 0.00 0.00 0.00 61.98 61.43 1qni s VAL 135 Cb 0.06 -0.81 0.21 0.00 0.00 0.00 0.00 36.38 35.84 1qni s VAL 135 CO 0.46 0.25 1.91 -0.65 0.00 0.00 0.00 175.10 177.06 1qni h PRO 136 N 5.77 0.00 -2.38 2.72 0.11 -1.94 -3.13 132.00 133.14 1qni h PRO 136 Ca -0.33 0.00 0.21 0.00 0.11 0.00 0.00 66.00 65.98 1qni h PRO 136 Cb 1.17 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.23 1qni h PRO 136 CO 0.49 0.24 0.65 -1.59 -0.21 0.00 0.00 178.00 177.58 1qni s LYS 137 N -3.96 1.08 -1.05 1.05 -2.85 -1.23 0.80 119.74 113.58 1qni s LYS 137 Ca -0.01 -0.68 -0.22 0.00 -1.00 0.00 0.00 55.97 54.05 1qni s LYS 137 Cb 0.12 0.31 0.03 0.00 -2.06 0.00 0.00 37.83 36.23 1qni s LYS 137 CO 0.64 -0.50 1.60 0.99 0.10 0.00 0.00 175.35 178.18 1qni s THR 138 N -2.23 3.85 -0.14 3.79 2.01 -0.17 -4.48 115.64 118.27 1qni s THR 138 Ca 0.22 -0.88 0.05 0.00 0.31 0.00 0.00 61.69 61.39 1qni s THR 138 Cb -0.02 -4.88 -0.23 0.00 0.01 0.00 0.00 72.50 67.38 1qni s THR 138 CO 0.03 -1.74 0.27 0.59 -0.69 0.00 0.00 174.62 173.08 1qni n ASN 139 N 9.92 1.36 -4.56 3.53 5.03 -1.26 -4.68 115.26 124.59 1qni n ASN 139 Ca 0.37 0.15 -0.30 0.00 0.87 0.00 0.00 54.58 55.67 1qni n ASN 139 Cb 0.49 -0.20 -0.10 0.00 -1.02 0.00 0.00 39.78 38.95 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 -2.55 2.74 -0.18 3.10 2.02 -1.26 -1.08 117.35 120.15 1qni s TYR 140 Ca -0.18 -0.15 -0.00 0.00 -0.37 0.00 0.00 57.07 56.37 1qni s TYR 140 Cb 0.07 -1.47 0.01 0.00 -0.40 0.00 0.00 41.96 40.17 1qni s TYR 140 CO 0.76 0.39 -0.16 0.08 -1.57 0.00 0.00 175.55 175.05 1qni s VAL 141 N -1.12 2.50 -0.26 0.71 1.01 0.09 -2.29 120.40 121.04 1qni s VAL 141 Ca 0.19 -0.80 -0.12 0.00 0.00 0.00 0.00 61.98 61.25 1qni s VAL 141 Cb -0.11 -2.07 -0.05 0.00 0.00 0.00 0.00 36.38 34.15 1qni s VAL 141 CO 0.11 0.51 0.22 -0.36 0.00 0.00 0.00 175.10 175.58 1qni s PHE 142 N 1.13 3.27 -0.03 5.22 0.08 0.43 -0.71 117.98 127.36 1qni s PHE 142 Ca 0.01 0.23 0.07 0.00 0.12 0.00 0.00 56.93 57.36 1qni s PHE 142 Cb -0.14 -2.38 -0.02 0.00 -0.57 0.00 0.00 43.02 39.91 1qni s PHE 142 CO -0.06 -0.08 -0.24 0.00 -0.10 0.00 0.00 175.22 174.74 1qni s ASN 144 N -0.50 5.07 -0.29 0.00 0.02 0.12 -1.13 114.94 118.23 1qni s ASN 144 Ca 0.06 0.05 -0.08 0.00 -1.02 0.00 0.00 52.86 51.87 1qni s ASN 144 Cb -0.11 -1.53 -0.01 0.00 0.02 0.00 0.00 41.25 39.62 1qni s ASN 144 CO 0.00 0.31 0.10 0.00 0.02 0.00 0.00 177.10 177.53 1qni s ALA 145 N -0.48 3.16 0.11 0.60 0.00 -1.24 -0.39 121.76 123.51 1qni s ALA 145 Ca 0.08 -1.34 -0.12 0.00 0.00 0.00 0.00 51.96 50.59 1qni s ALA 145 Cb -0.12 -2.20 -0.13 0.00 0.00 0.00 0.00 23.12 20.67 1qni s ALA 145 CO 0.02 -0.78 1.33 1.49 0.00 0.00 0.00 175.76 177.82 1qni h GLU 146 N 8.27 0.79 -4.92 0.00 4.81 -0.69 -3.32 114.58 119.53 1qni h GLU 146 Ca -0.34 -0.62 -0.64 0.00 -0.13 0.00 0.00 59.36 57.63 1qni h GLU 146 Cb 1.15 0.12 -0.19 0.00 0.63 0.00 0.00 28.75 30.46 1qni h GLU 146 CO 0.60 1.23 -0.56 -0.06 -0.73 0.00 0.00 179.01 179.50 1qni s PHE 147 N -3.80 3.17 0.32 0.92 0.08 -1.20 -4.39 117.98 113.08 1qni s PHE 147 Ca -0.10 -0.08 -0.29 0.00 0.12 0.00 0.00 56.93 56.59 1qni s PHE 147 Cb 0.09 -2.33 -0.10 0.00 -0.57 0.00 0.00 43.02 40.11 1qni s PHE 147 CO 0.90 -0.23 1.25 0.14 -0.10 0.00 0.00 175.22 177.18 1qni s VAL 148 N 1.71 2.90 0.07 -0.44 -7.23 -1.26 -4.18 120.40 111.97 1qni s VAL 148 Ca 0.07 0.90 -0.05 0.00 -1.81 0.00 0.00 61.98 61.10 1qni s VAL 148 Cb -0.16 -3.57 -0.02 0.00 0.56 0.00 0.00 36.38 33.19 1qni s VAL 148 CO 0.08 0.21 0.07 0.27 -0.31 0.00 0.00 175.10 175.43 1qni s ILE 149 N -1.16 0.18 0.86 -0.62 -4.36 -0.61 -4.72 121.20 110.78 1qni s ILE 149 Ca 0.48 -1.52 -0.10 0.00 -0.26 0.00 0.00 60.65 59.25 1qni s ILE 149 Cb -0.38 -1.44 0.11 0.00 1.25 0.00 0.00 42.46 42.01 1qni s ILE 149 CO 0.50 -0.84 1.12 -2.16 0.24 0.00 0.00 174.94 173.80 1qni s PRO 150 N -3.89 1.51 -0.24 0.37 0.04 -1.26 -0.22 135.00 131.31 1qni s PRO 150 Ca 0.06 1.38 0.00 0.00 0.04 0.00 0.00 61.00 62.48 1qni s PRO 150 Cb 0.07 -1.80 0.06 0.00 0.04 0.00 0.00 34.50 32.87 1qni s PRO 150 CO -0.10 -2.24 -0.03 -0.65 0.04 0.00 0.00 177.00 174.02 1qni s GLN 151 N -4.76 1.48 0.67 4.56 -0.21 -1.25 -2.33 119.66 117.82 1qni s GLN 151 Ca 0.64 -0.96 -0.11 0.00 0.02 0.00 0.00 55.36 54.95 1qni s GLN 151 Cb -0.20 -2.54 -0.01 0.00 1.00 0.00 0.00 33.01 31.26 1qni s GLN 151 CO 0.57 -0.63 1.06 -1.25 -2.12 0.00 0.00 175.29 172.92 1qni s PRO 152 N 1.44 3.15 -1.25 2.91 0.04 -1.26 -5.06 135.00 134.97 1qni s PRO 152 Ca -0.04 0.67 -0.11 0.00 0.04 0.00 0.00 61.00 61.56 1qni s PRO 152 Cb -0.19 -2.04 0.18 0.00 0.04 0.00 0.00 34.50 32.49 1qni s PRO 152 CO -0.07 -0.87 1.70 -1.71 0.04 0.00 0.00 177.00 176.09 1qni n ASN 153 N -2.94 5.20 -0.47 6.66 5.15 -0.98 -4.63 115.26 123.25 1qni n ASN 153 Ca 0.07 -3.08 0.08 0.00 -0.60 0.00 0.00 54.58 51.04 1qni n ASN 153 Cb 0.55 -1.50 0.02 0.00 -0.53 0.00 0.00 39.78 38.33 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 4.31 1.88 0.00 1.20 5.68 -1.26 -5.00 116.55 123.36 1qni n ASP 154 Ca 0.38 -1.44 0.00 0.00 -0.50 0.00 0.00 54.79 53.23 1qni n ASP 154 Cb 0.38 0.30 0.00 0.00 -1.14 0.00 0.00 41.12 40.67 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 1.06 0.64 0.46 6.12 0.00 -1.26 -4.94 105.19 107.28 1qni n GLY 155 Ca 0.08 -0.59 0.11 0.00 0.00 0.00 0.00 46.02 45.61 1qni n GLY 155 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1qni n THR 156 N -2.58 0.00 -3.19 2.61 -2.24 -1.26 -4.85 114.28 102.76 1qni n THR 156 Ca 0.00 -0.24 0.04 0.00 -2.27 0.00 0.00 64.05 61.58 1qni n THR 156 Cb 0.00 1.19 -0.02 0.00 -2.10 0.00 0.00 70.33 69.40 1qni n THR 156 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1qni s ASP 157 N -2.51 -0.99 0.01 3.42 2.15 -1.26 -5.04 116.67 112.45 1qni s ASP 157 Ca 0.18 0.69 0.23 0.00 0.43 0.00 0.00 52.55 54.08 1qni s ASP 157 Cb 0.18 1.86 0.15 0.00 -0.30 0.00 0.00 42.92 44.81 1qni s ASP 157 CO 0.59 -0.19 1.15 0.49 -0.17 0.00 0.00 175.17 177.04 1qni n PHE 158 N 5.42 0.05 -1.54 -5.34 3.72 -1.26 -4.68 117.46 113.83 1qni n PHE 158 Ca -0.04 0.02 -0.49 0.00 -0.05 0.00 0.00 57.45 56.88 1qni n PHE 158 Cb 0.52 -0.20 -0.04 0.00 -0.94 0.00 0.00 39.48 38.82 1qni n PHE 158 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1qni n SER 159 N -1.60 0.76 0.23 4.37 3.41 -1.26 -4.86 113.62 114.67 1qni n SER 159 Ca 0.04 1.15 0.12 0.00 -0.26 0.00 0.00 58.87 59.92 1qni n SER 159 Cb 0.35 -1.15 0.47 0.00 -0.26 0.00 0.00 64.21 63.62 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 2.68 0.00 -1.31 1.04 3.38 -1.94 -3.00 115.31 116.16 1qni h LEU 160 Ca -0.41 0.00 0.08 0.00 0.09 0.00 0.00 57.88 57.65 1qni h LEU 160 Cb 1.37 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 42.06 1qni h LEU 160 CO 0.66 0.15 0.52 0.44 0.09 0.00 0.00 178.44 180.30 1qni h ASP 161 N 0.00 0.71 -0.46 -0.43 5.19 -1.89 -2.02 116.42 117.52 1qni h ASP 161 Ca -0.00 0.01 -0.14 0.00 -0.62 0.00 0.00 57.03 56.28 1qni h ASP 161 Cb 0.75 -0.14 -0.08 0.00 0.18 0.00 0.00 39.33 40.04 1qni h ASP 161 CO 0.02 0.43 0.09 0.59 -3.12 0.00 0.00 179.24 177.25 1qni n ASN 162 N -4.50 3.76 -4.76 6.45 3.02 -1.14 -4.97 115.26 113.12 1qni n ASN 162 Ca 0.13 -3.32 -0.36 0.00 -0.03 0.00 0.00 54.58 51.00 1qni n ASN 162 Cb 0.28 -0.64 -0.08 0.00 -0.61 0.00 0.00 39.78 38.73 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 -1.82 6.16 0.21 6.41 0.01 -0.76 -3.94 113.70 119.97 1qni s SER 163 Ca 0.47 0.28 -0.03 0.00 1.31 0.00 0.00 55.95 57.99 1qni s SER 163 Cb 0.40 -2.05 -0.03 0.00 0.21 0.00 0.00 66.02 64.55 1qni s SER 163 CO 0.08 0.26 0.18 -0.31 0.41 0.00 0.00 173.24 173.86 1qni s TYR 164 N -0.11 1.03 0.37 2.43 1.51 0.70 -4.64 117.35 118.64 1qni s TYR 164 Ca 0.10 -1.27 0.03 0.00 -1.01 0.00 0.00 57.07 54.92 1qni s TYR 164 Cb -0.11 -0.44 -0.04 0.00 -0.11 0.00 0.00 41.96 41.25 1qni s TYR 164 CO 0.00 -0.69 0.09 -0.08 -1.11 0.00 0.00 175.55 173.76 1qni s THR 165 N -4.14 0.85 0.01 -0.71 -1.32 -1.26 -1.57 115.64 107.51 1qni s THR 165 Ca 0.36 -2.00 -0.05 0.00 -1.21 0.00 0.00 61.69 58.79 1qni s THR 165 Cb 0.06 -2.53 -0.01 0.00 -1.51 0.00 0.00 72.50 68.51 1qni s THR 165 CO 0.11 0.00 0.09 -0.04 -2.21 0.00 0.00 174.62 172.57 1qni s MET 166 N -3.81 0.45 -0.16 7.08 -1.94 -1.26 -2.76 119.30 116.90 1qni s MET 166 Ca 0.29 -0.49 -0.18 0.00 -1.71 0.00 0.00 55.69 53.59 1qni s MET 166 Cb 0.05 0.18 -0.04 0.00 2.01 0.00 0.00 34.83 37.04 1qni s MET 166 CO 0.14 -0.10 0.49 0.12 -0.01 0.00 0.00 175.02 175.66 1qni s PHE 167 N -1.53 3.44 -0.09 -0.03 5.36 0.52 -3.60 117.98 122.05 1qni s PHE 167 Ca -0.14 0.82 0.03 0.00 -0.96 0.00 0.00 56.93 56.68 1qni s PHE 167 Cb -0.08 -2.61 -0.02 0.00 -0.34 0.00 0.00 43.02 39.98 1qni s PHE 167 CO 0.00 0.03 -0.17 0.99 -1.46 0.00 0.00 175.22 174.62 1qni s THR 168 N 1.12 2.80 -0.17 0.12 2.01 -0.29 -0.03 115.64 121.20 1qni s THR 168 Ca 0.25 -0.78 -0.03 0.00 0.31 0.00 0.00 61.69 61.44 1qni s THR 168 Cb -0.15 -2.12 -0.02 0.00 0.01 0.00 0.00 72.50 70.23 1qni s THR 168 CO 0.10 0.56 -0.07 0.00 -0.69 0.00 0.00 174.62 174.52 1qni s ALA 169 N -0.13 2.81 -0.04 7.40 0.00 -0.45 -0.36 121.76 130.99 1qni s ALA 169 Ca -0.02 -0.96 0.02 0.00 0.00 0.00 0.00 51.96 51.00 1qni s ALA 169 Cb -0.14 -1.49 -0.03 0.00 0.00 0.00 0.00 23.12 21.46 1qni s ALA 169 CO 0.04 0.01 -0.06 0.42 0.00 0.00 0.00 175.76 176.17 1qni s ILE 170 N 0.73 3.75 -0.31 0.00 1.01 0.11 0.56 121.20 127.06 1qni s ILE 170 Ca -0.03 -0.59 -0.29 0.00 0.00 0.00 0.00 60.65 59.74 1qni s ILE 170 Cb -0.15 -2.58 -0.00 0.00 0.01 0.00 0.00 42.46 39.73 1qni s ILE 170 CO 0.02 0.50 1.39 -0.62 0.00 0.00 0.00 174.94 176.23 1qni s ASP 171 N -1.11 6.53 0.24 3.58 2.15 -0.09 -0.73 116.67 127.25 1qni s ASP 171 Ca 0.15 1.20 -0.05 0.00 0.43 0.00 0.00 52.55 54.28 1qni s ASP 171 Cb -0.11 -2.54 0.39 0.00 -0.30 0.00 0.00 42.92 40.36 1qni s ASP 171 CO 0.05 -1.20 1.80 0.00 -0.17 0.00 0.00 175.17 175.65 1qni h ALA 172 N 9.91 1.13 -0.09 3.66 0.00 -1.38 0.97 119.26 133.45 1qni h ALA 172 Ca -0.28 0.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.53 1qni h ALA 172 Cb 1.11 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 1qni h ALA 172 CO 1.04 0.05 -0.58 0.93 0.00 0.00 0.00 179.25 180.70 1qni h GLU 173 N 0.74 0.29 0.00 0.00 4.39 -1.85 -3.32 114.58 114.83 1qni h GLU 173 Ca 0.39 -0.19 -0.03 0.00 0.34 0.00 0.00 59.36 59.87 1qni h GLU 173 Cb 0.38 0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 29.05 1qni h GLU 173 CO -0.26 0.79 -1.83 2.41 -1.16 0.00 0.00 179.01 178.96 1qni n THR 174 N -3.90 0.10 -1.94 1.13 -1.04 -1.08 -4.99 114.28 102.55 1qni n THR 174 Ca -0.02 -0.43 -0.14 0.00 -2.04 0.00 0.00 64.05 61.42 1qni n THR 174 Cb 0.60 0.04 -0.03 0.00 -1.82 0.00 0.00 70.33 69.12 1qni n THR 174 CO 0.00 0.00 0.00 0.23 -0.64 0.00 0.00 175.07 174.66 1qni n MET 175 N -2.15 -1.09 -4.21 -2.82 2.81 0.33 -5.00 117.12 104.99 1qni n MET 175 Ca -0.05 0.81 -0.35 0.00 -1.81 0.00 0.00 57.70 56.30 1qni n MET 175 Cb 0.51 -5.04 -0.09 0.00 -0.71 0.00 0.00 33.22 27.89 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 -2.54 5.52 0.23 7.83 1.01 -1.24 -4.72 116.67 122.75 1qni s ASP 176 Ca 0.00 0.18 -0.32 0.00 0.71 0.00 0.00 52.55 53.13 1qni s ASP 176 Cb 0.00 -1.70 -0.12 0.00 1.01 0.00 0.00 42.92 42.10 1qni s ASP 176 CO 0.00 0.34 1.62 0.52 0.21 0.00 0.00 175.17 177.86 1qni n VAL 177 N 2.44 0.42 -0.09 -1.27 0.31 -1.26 -0.91 118.33 117.97 1qni n VAL 177 Ca -0.18 -0.11 -0.18 0.00 -0.01 0.00 0.00 64.34 63.86 1qni n VAL 177 Cb 0.54 -1.83 -0.11 0.00 -0.91 0.00 0.00 33.84 31.53 1qni n VAL 177 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1qni h ALA 178 N 5.70 0.16 -2.47 3.52 0.00 -0.19 -3.45 119.26 122.53 1qni h ALA 178 Ca -0.45 -0.90 0.16 0.00 0.00 0.00 0.00 54.91 53.71 1qni h ALA 178 Cb 1.23 0.47 -0.07 0.00 0.00 0.00 0.00 17.79 19.42 1qni h ALA 178 CO 0.87 0.45 0.44 1.67 0.00 0.00 0.00 179.25 182.68 1qni s TRP 179 N -2.28 -0.12 0.01 0.00 1.48 -1.09 -4.34 118.94 112.60 1qni s TRP 179 Ca -0.24 -0.23 0.02 0.00 -1.06 0.00 0.00 56.10 54.59 1qni s TRP 179 Cb 0.03 0.66 -0.01 0.00 -1.16 0.00 0.00 33.47 32.99 1qni s TRP 179 CO 0.58 -0.92 -0.05 -0.65 -4.06 0.00 0.00 176.95 171.84 1qni s GLN 180 N -3.29 0.40 -0.15 3.25 -0.21 -0.58 -1.35 119.66 117.73 1qni s GLN 180 Ca 0.13 -0.39 0.01 0.00 0.02 0.00 0.00 55.36 55.13 1qni s GLN 180 Cb -0.02 -0.28 0.01 0.00 1.00 0.00 0.00 33.01 33.71 1qni s GLN 180 CO 0.04 0.07 -0.19 0.08 -2.12 0.00 0.00 175.29 173.16 1qni s VAL 181 N -0.64 2.29 0.13 1.09 1.01 0.95 -1.51 120.40 123.72 1qni s VAL 181 Ca -0.04 -0.89 -0.30 0.00 0.00 0.00 0.00 61.98 60.75 1qni s VAL 181 Cb -0.05 -1.94 -0.06 0.00 0.00 0.00 0.00 36.38 34.32 1qni s VAL 181 CO -0.00 0.53 0.97 -0.63 0.00 0.00 0.00 175.10 175.97 1qni s ILE 182 N 0.92 4.42 0.30 2.22 1.01 -0.54 -0.36 121.20 129.18 1qni s ILE 182 Ca -0.04 2.05 0.03 0.00 0.00 0.00 0.00 60.65 62.69 1qni s ILE 182 Cb -0.15 -4.31 -0.05 0.00 0.01 0.00 0.00 42.46 37.96 1qni s ILE 182 CO -0.03 0.33 0.09 0.68 0.00 0.00 0.00 174.94 176.01 1qni s VAL 183 N -0.14 0.82 0.55 2.92 -7.23 -1.11 0.43 120.40 116.63 1qni s VAL 183 Ca 0.46 -2.00 -0.01 0.00 -1.81 0.00 0.00 61.98 58.63 1qni s VAL 183 Cb -0.24 -2.68 0.03 0.00 0.56 0.00 0.00 36.38 34.05 1qni s VAL 183 CO 0.30 0.00 0.79 -1.81 -0.31 0.00 0.00 175.10 174.07 1qni s ASP 184 N -3.41 5.39 1.40 4.85 1.01 -1.26 -4.32 116.67 120.32 1qni s ASP 184 Ca 0.36 0.18 0.00 0.00 0.71 0.00 0.00 52.55 53.80 1qni s ASP 184 Cb 0.08 -1.14 0.00 0.00 1.01 0.00 0.00 42.92 42.87 1qni s ASP 184 CO 0.15 -1.08 0.00 0.61 0.21 0.00 0.00 175.17 175.06 1qni n GLY 185 N -2.37 3.21 0.00 0.21 0.00 -1.26 -4.85 105.19 100.13 1qni n GLY 185 Ca 0.06 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.90 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 3.02 0.00 -4.04 1.61 2.04 -1.25 -4.54 115.26 112.10 1qni n ASN 186 Ca 0.00 -0.93 -0.20 0.00 -0.44 0.00 0.00 54.58 53.01 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 1.96 0.00 -4.53 1.43 -1.25 -4.34 118.68 111.96 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 -0.55 0.00 0.00 0.03 0.00 0.00 46.19 45.67 1qni s LEU 187 CO 0.00 0.11 0.00 -0.67 0.23 0.00 0.00 176.35 176.02 1qni n ASP 188 N 2.94 0.00 -4.52 2.29 -0.08 0.86 -3.92 116.55 114.12 1qni n ASP 188 Ca -0.15 0.00 -0.24 0.00 -1.51 0.00 0.00 54.79 52.89 1qni n ASP 188 Cb 0.56 -0.12 -0.11 0.00 2.34 0.00 0.00 41.12 43.79 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 -2.88 3.22 0.14 1.67 -0.87 -1.26 -1.48 114.94 113.49 1qni s ASN 189 Ca 0.00 -1.29 -0.15 0.00 -1.57 0.00 0.00 52.86 49.85 1qni s ASN 189 Cb 0.00 -0.26 0.03 0.00 -0.02 0.00 0.00 41.25 41.00 1qni s ASN 189 CO 0.00 -0.40 0.41 0.28 -2.57 0.00 0.00 177.10 174.81 1qni s THR 190 N -2.90 0.06 0.26 1.60 -1.32 -1.26 -1.61 115.64 110.49 1qni s THR 190 Ca 0.33 -0.71 -0.21 0.00 -1.21 0.00 0.00 61.69 59.90 1qni s THR 190 Cb 0.06 -1.31 0.02 0.00 -1.51 0.00 0.00 72.50 69.77 1qni s THR 190 CO 0.16 -0.29 0.69 -0.62 -2.21 0.00 0.00 174.62 172.35 1qni s ASP 191 N -2.83 -0.29 0.27 8.08 -1.08 -0.49 -4.48 116.67 115.84 1qni s ASP 191 Ca 0.05 -0.56 0.07 0.00 -0.52 0.00 0.00 52.55 51.59 1qni s ASP 191 Cb 0.02 0.71 -0.06 0.00 -1.46 0.00 0.00 42.92 42.13 1qni s ASP 191 CO -0.09 -1.29 -0.06 0.00 0.52 0.00 0.00 175.17 174.24 1qni s ALA 192 N -3.91 2.30 0.83 3.66 0.00 -1.26 -0.92 121.76 122.46 1qni s ALA 192 Ca 0.10 -1.87 0.00 0.00 0.00 0.00 0.00 51.96 50.19 1qni s ALA 192 Cb -0.05 0.17 0.00 0.00 0.00 0.00 0.00 23.12 23.24 1qni s ALA 192 CO 0.05 -0.06 0.00 -0.40 0.00 0.00 0.00 175.76 175.34 1qni n ASP 193 N -0.56 0.00 -1.29 0.00 5.68 -0.92 -4.81 116.55 114.65 1qni n ASP 193 Ca -0.06 -0.71 -0.07 0.00 -0.50 0.00 0.00 54.79 53.45 1qni n ASP 193 Cb 0.63 0.00 0.19 0.00 -1.14 0.00 0.00 41.12 40.80 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 -1.31 1.31 0.00 2.11 4.02 -1.26 -4.19 117.16 117.83 1qni n TYR 194 Ca 0.00 -1.68 0.00 0.00 -0.01 0.00 0.00 57.90 56.21 1qni n TYR 194 Cb 0.00 -0.54 0.00 0.00 -0.02 0.00 0.00 39.34 38.78 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 -1.12 0.00 0.00 -0.72 -2.24 -1.26 -4.69 114.28 104.25 1qni n THR 195 Ca 0.36 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.14 1qni n THR 195 Cb 1.08 -0.42 0.00 0.00 -2.10 0.00 0.00 70.33 68.88 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 2.30 1.02 0.17 3.38 0.00 -1.18 -4.28 105.19 106.60 1qni n GLY 196 Ca 0.00 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.09 1qni n GLY 196 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1qni h LYS 197 N 2.72 0.00 -5.39 1.61 3.64 -1.94 -3.43 116.57 113.78 1qni h LYS 197 Ca 0.00 0.00 -0.44 0.00 -1.27 0.00 0.00 60.65 58.94 1qni h LYS 197 Cb 0.00 0.00 -0.23 0.00 -0.41 0.00 0.00 32.23 31.59 1qni h LYS 197 CO 0.00 0.27 -0.79 0.71 -2.27 0.00 0.00 179.45 177.37 1qni s TYR 198 N -3.07 1.26 0.03 1.91 2.02 -1.26 -1.40 117.35 116.84 1qni s TYR 198 Ca 0.05 -0.40 -0.02 0.00 -0.37 0.00 0.00 57.07 56.32 1qni s TYR 198 Cb 0.07 -0.73 -0.02 0.00 -0.40 0.00 0.00 41.96 40.88 1qni s TYR 198 CO 0.72 0.05 0.02 0.00 -1.57 0.00 0.00 175.55 174.77 1qni s ALA 199 N -1.05 0.14 0.03 3.71 0.00 -0.95 -2.17 121.76 121.47 1qni s ALA 199 Ca 0.00 -0.72 -0.13 0.00 0.00 0.00 0.00 51.96 51.11 1qni s ALA 199 Cb -0.09 0.21 0.02 0.00 0.00 0.00 0.00 23.12 23.26 1qni s ALA 199 CO 0.02 -0.27 0.29 0.95 0.00 0.00 0.00 175.76 176.75 1qni s THR 200 N -2.49 0.08 0.02 0.00 -4.23 -0.10 0.25 115.64 109.16 1qni s THR 200 Ca -0.06 -0.67 -0.03 0.00 -1.18 0.00 0.00 61.69 59.75 1qni s THR 200 Cb -0.02 -0.86 -0.01 0.00 1.34 0.00 0.00 72.50 72.94 1qni s THR 200 CO -0.04 -0.37 0.05 -0.44 -0.54 0.00 0.00 174.62 173.28 1qni s SER 201 N -1.91 0.15 0.36 3.99 0.01 -0.28 -1.40 113.70 114.63 1qni s SER 201 Ca -0.07 -0.40 -0.06 0.00 1.31 0.00 0.00 55.95 56.73 1qni s SER 201 Cb -0.02 0.15 -0.05 0.00 0.21 0.00 0.00 66.02 66.31 1qni s SER 201 CO -0.02 -0.35 0.65 0.42 0.41 0.00 0.00 173.24 174.36 1qni s THR 202 N -1.57 4.94 -0.02 1.44 -4.23 -0.63 0.22 115.64 115.79 1qni s THR 202 Ca -0.14 0.20 0.02 0.00 -1.18 0.00 0.00 61.69 60.59 1qni s THR 202 Cb -0.08 -3.77 0.00 0.00 1.34 0.00 0.00 72.50 70.00 1qni s THR 202 CO -0.00 -0.49 -0.07 0.00 -0.54 0.00 0.00 174.62 173.52 1qni n TYR 204 N 3.29 0.00 -2.77 0.00 0.18 -1.26 -3.73 117.16 112.87 1qni n TYR 204 Ca -0.18 0.00 -0.27 0.00 1.88 0.00 0.00 57.90 59.33 1qni n TYR 204 Cb 0.55 0.00 -0.03 0.00 -0.38 0.00 0.00 39.34 39.48 1qni n TYR 204 CO 0.00 0.00 0.00 -1.71 -2.08 0.00 0.00 176.86 173.07 1qni n ASN 205 N -0.94 4.57 0.22 9.48 2.85 -1.26 -4.60 115.26 125.57 1qni n ASN 205 Ca 0.00 -3.70 0.15 0.00 -0.11 0.00 0.00 54.58 50.92 1qni n ASN 205 Cb 0.00 -0.52 0.68 0.00 1.24 0.00 0.00 39.78 41.18 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 2.84 0.00 1.07 1.20 4.64 -1.88 -0.73 113.55 120.68 1qni h SER 206 Ca 0.19 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.51 1qni h SER 206 Cb 0.65 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.74 1qni h SER 206 CO 0.83 0.00 -0.21 -0.62 -0.87 0.00 0.00 176.83 175.96 1qni n GLU 207 N -2.66 0.16 -3.89 4.77 4.71 -1.26 -4.45 120.64 118.02 1qni n GLU 207 Ca 0.00 0.09 -0.28 0.00 -0.01 0.00 0.00 57.16 56.96 1qni n GLU 207 Cb 0.20 -1.65 -0.00 0.00 -1.01 0.00 0.00 31.44 28.98 1qni n GLU 207 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 177.13 177.76 1qni n ARG 208 N -1.90 -2.49 -4.35 3.49 1.74 -0.28 -4.98 116.66 107.89 1qni n ARG 208 Ca 0.05 0.39 -0.24 0.00 -0.77 0.00 0.00 57.85 57.29 1qni n ARG 208 Cb 0.39 -4.27 -0.09 0.00 -1.02 0.00 0.00 32.46 27.48 1qni n ARG 208 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1qni s ALA 209 N -3.80 3.13 -0.19 7.54 0.00 -1.26 -4.87 121.76 122.31 1qni s ALA 209 Ca 0.17 -1.90 0.04 0.00 0.00 0.00 0.00 51.96 50.27 1qni s ALA 209 Cb -0.07 -0.43 -0.14 0.00 0.00 0.00 0.00 23.12 22.49 1qni s ALA 209 CO 0.89 0.13 -0.12 1.55 0.00 0.00 0.00 175.76 178.21 1qni n VAL 210 N -0.90 1.10 -2.34 0.00 3.14 -1.26 -4.70 118.33 113.37 1qni n VAL 210 Ca -0.05 -0.48 -0.36 0.00 -2.96 0.00 0.00 64.34 60.50 1qni n VAL 210 Cb 0.61 -1.06 -0.02 0.00 -1.06 0.00 0.00 33.84 32.32 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 -5.67 6.18 0.16 6.55 -4.77 -1.26 -4.92 116.67 112.95 1qni s ASP 211 Ca -0.22 2.18 -0.21 0.00 -3.30 0.00 0.00 52.55 50.99 1qni s ASP 211 Cb 0.06 -2.59 0.07 0.00 -1.09 0.00 0.00 42.92 39.37 1qni s ASP 211 CO 0.49 -0.90 1.62 0.25 0.70 0.00 0.00 175.17 177.32 1qni h LEU 212 N 1.85 -0.88 -0.70 2.11 6.46 -2.00 -2.42 115.31 119.73 1qni h LEU 212 Ca -0.49 0.17 0.08 0.00 -0.12 0.00 0.00 57.88 57.51 1qni h LEU 212 Cb 1.24 0.43 -0.06 0.00 -0.73 0.00 0.00 40.66 41.54 1qni h LEU 212 CO 0.60 -0.28 0.37 0.00 -0.62 0.00 0.00 178.44 178.50 1qni h ALA 213 N 0.90 0.95 -0.85 1.25 0.00 -1.98 -2.08 119.26 117.44 1qni h ALA 213 Ca 0.18 0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.15 1qni h ALA 213 Cb 0.49 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.14 1qni h ALA 213 CO -0.49 0.01 0.56 0.78 0.00 0.00 0.00 179.25 180.12 1qni h GLY 214 N 0.66 1.21 1.83 0.00 0.00 -1.83 -1.36 103.07 103.59 1qni h GLY 214 Ca 0.33 -0.43 0.00 0.00 0.00 0.00 0.00 47.33 47.23 1qni h GLY 214 CO -0.22 0.38 0.00 -1.30 0.00 0.00 0.00 176.54 175.40 1qni n THR 215 N -4.44 0.57 0.17 4.70 -2.24 -0.79 -2.65 114.28 109.61 1qni n THR 215 Ca 0.11 0.14 0.03 0.00 -2.27 0.00 0.00 64.05 62.06 1qni n THR 215 Cb 0.09 -0.81 0.04 0.00 -2.10 0.00 0.00 70.33 67.54 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 -1.42 0.52 0.10 -0.78 2.00 -0.59 -4.70 117.12 112.26 1qni n MET 216 Ca 0.06 -1.07 -0.15 0.00 0.00 0.00 0.00 57.70 56.55 1qni n MET 216 Cb 0.20 -1.12 -0.09 0.00 0.00 0.00 0.00 33.22 32.21 1qni n MET 216 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 175.97 175.88 1qni h ARG 217 N 1.15 -0.66 -6.84 0.03 2.43 -1.12 -3.42 114.38 105.96 1qni h ARG 217 Ca 0.00 0.04 -0.52 0.00 -0.81 0.00 0.00 59.98 58.69 1qni h ARG 217 Cb 0.33 0.15 0.06 0.00 -0.42 0.00 0.00 29.97 30.09 1qni h ARG 217 CO 0.00 -0.44 0.64 -0.80 -1.51 0.00 0.00 179.97 177.86 1qni s ASN 218 N -4.41 6.81 0.30 -3.80 0.01 -1.26 -4.92 114.94 107.68 1qni s ASN 218 Ca -0.15 2.63 0.02 0.00 -0.71 0.00 0.00 52.86 54.66 1qni s ASN 218 Cb 0.05 -2.64 0.49 0.00 0.41 0.00 0.00 41.25 39.56 1qni s ASN 218 CO 0.54 -0.52 1.82 0.44 -1.51 0.00 0.00 177.10 177.87 1qni h ASP 219 N 3.75 0.58 -4.29 -1.22 3.32 -1.98 -3.44 116.42 113.14 1qni h ASP 219 Ca -0.48 -0.13 -0.51 0.00 0.02 0.00 0.00 57.03 55.93 1qni h ASP 219 Cb 1.22 -0.15 -0.24 0.00 0.22 0.00 0.00 39.33 40.38 1qni h ASP 219 CO 0.68 0.67 -0.81 -0.13 -1.72 0.00 0.00 179.24 177.92 1qni s ARG 220 N -4.92 1.10 0.00 3.56 0.52 -1.26 -1.86 118.95 116.09 1qni s ARG 220 Ca -0.08 -0.95 0.00 0.00 -0.52 0.00 0.00 55.73 54.18 1qni s ARG 220 Cb 0.15 -1.21 0.00 0.00 0.52 0.00 0.00 34.95 34.40 1qni s ARG 220 CO 0.78 0.30 0.00 -0.25 0.02 0.00 0.00 175.30 176.15 1qni n ASP 221 N 1.57 0.00 -3.65 0.23 8.00 -0.23 -4.87 116.55 117.60 1qni n ASP 221 Ca -0.19 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.32 1qni n ASP 221 Cb 0.54 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.64 1qni n ASP 221 CO 0.00 0.00 0.00 -1.66 -0.39 0.00 0.00 177.20 175.15 1qni s TRP 222 N 3.62 -0.00 -0.14 1.24 -2.14 -1.24 -2.67 118.94 117.61 1qni s TRP 222 Ca 0.00 -0.18 0.02 0.00 2.66 0.00 0.00 56.10 58.60 1qni s TRP 222 Cb 0.00 0.59 0.00 0.00 -3.10 0.00 0.00 33.47 30.97 1qni s TRP 222 CO 0.00 -0.46 -0.20 0.08 -2.66 0.00 0.00 176.95 173.71 1qni s VAL 223 N -2.32 2.23 -0.18 -0.66 1.01 0.11 -1.41 120.40 119.17 1qni s VAL 223 Ca 0.21 -0.93 -0.17 0.00 0.00 0.00 0.00 61.98 61.09 1qni s VAL 223 Cb 0.01 -1.90 -0.04 0.00 0.00 0.00 0.00 36.38 34.45 1qni s VAL 223 CO -0.00 0.54 0.45 -0.69 0.00 0.00 0.00 175.10 175.40 1qni s VAL 224 N 0.72 5.17 -0.17 2.92 1.01 0.13 -0.90 120.40 129.29 1qni s VAL 224 Ca -0.09 0.83 -0.06 0.00 0.00 0.00 0.00 61.98 62.66 1qni s VAL 224 Cb -0.16 -3.78 -0.04 0.00 0.00 0.00 0.00 36.38 32.40 1qni s VAL 224 CO 0.01 0.25 0.04 -0.69 0.00 0.00 0.00 175.10 174.71 1qni s VAL 225 N 1.20 4.61 -0.14 2.92 1.01 0.54 -1.12 120.40 129.41 1qni s VAL 225 Ca 0.22 -0.10 -0.04 0.00 0.00 0.00 0.00 61.98 62.05 1qni s VAL 225 Cb -0.15 -3.06 -0.03 0.00 0.00 0.00 0.00 36.38 33.14 1qni s VAL 225 CO 0.09 0.48 0.02 -0.36 0.00 0.00 0.00 175.10 175.32 1qni s PHE 226 N 0.25 3.17 -0.97 5.22 0.08 0.14 -1.87 117.98 123.98 1qni s PHE 226 Ca 0.03 0.02 -0.13 0.00 0.12 0.00 0.00 56.93 56.96 1qni s PHE 226 Cb -0.13 -1.94 0.21 0.00 -0.57 0.00 0.00 43.02 40.59 1qni s PHE 226 CO 0.01 0.22 1.01 1.21 -0.10 0.00 0.00 175.22 177.57 1qni s ASN 227 N -0.09 6.94 0.42 1.36 3.84 -0.50 -2.24 114.94 124.68 1qni s ASN 227 Ca 0.05 -2.87 0.18 0.00 0.21 0.00 0.00 52.86 50.42 1qni s ASN 227 Cb -0.13 -2.27 1.09 0.00 -0.55 0.00 0.00 41.25 39.40 1qni s ASN 227 CO 0.02 -0.60 1.87 0.58 -2.79 0.00 0.00 177.10 176.17 1qni h VAL 228 N 4.64 0.69 0.48 -5.21 2.07 -1.52 -1.24 116.25 116.16 1qni h VAL 228 Ca 0.16 -0.13 -0.02 0.00 0.82 0.00 0.00 66.70 67.52 1qni h VAL 228 Cb 0.97 0.26 0.00 0.00 -1.52 0.00 0.00 31.29 31.01 1qni h VAL 228 CO 0.95 0.07 -0.23 -0.08 0.02 0.00 0.00 177.57 178.30 1qni h GLU 229 N 0.39 -0.62 -0.24 1.57 4.81 -1.83 0.49 114.58 119.16 1qni h GLU 229 Ca 0.45 0.04 -0.06 0.00 -0.13 0.00 0.00 59.36 59.67 1qni h GLU 229 Cb 1.14 0.14 -0.01 0.00 0.63 0.00 0.00 28.75 30.65 1qni h GLU 229 CO -0.16 -0.38 -0.10 0.00 -0.73 0.00 0.00 179.01 177.64 1qni h ARG 230 N -0.72 0.38 0.27 1.92 3.08 -1.71 -0.96 114.38 116.64 1qni h ARG 230 Ca -0.07 -0.09 -0.01 0.00 0.07 0.00 0.00 59.98 59.88 1qni h ARG 230 Cb 0.53 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.53 1qni h ARG 230 CO 0.11 0.49 -0.13 0.82 -1.07 0.00 0.00 179.97 180.19 1qni h ILE 231 N 0.36 0.75 -0.44 2.04 2.04 -1.12 -1.38 117.51 119.77 1qni h ILE 231 Ca 0.07 -0.66 0.02 0.00 1.00 0.00 0.00 64.86 65.29 1qni h ILE 231 Cb 0.40 1.10 -0.02 0.00 -0.74 0.00 0.00 36.82 37.56 1qni h ILE 231 CO 0.02 0.13 0.29 0.00 0.00 0.00 0.00 178.15 178.59 1qni h ALA 232 N -0.15 1.78 -0.19 1.87 0.00 -0.77 -1.43 119.26 120.38 1qni h ALA 232 Ca -0.04 -0.02 -0.16 0.00 0.00 0.00 0.00 54.91 54.69 1qni h ALA 232 Cb 0.49 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1qni h ALA 232 CO 0.06 0.18 -0.54 0.00 0.00 0.00 0.00 179.25 178.95 1qni h ALA 233 N 1.74 0.71 -0.21 0.00 0.00 -1.09 -2.42 119.26 117.99 1qni h ALA 233 Ca 0.17 -0.51 -0.17 0.00 0.00 0.00 0.00 54.91 54.40 1qni h ALA 233 Cb 0.06 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 1qni h ALA 233 CO -0.04 0.69 -0.57 0.00 0.00 0.00 0.00 179.25 179.33 1qni h ALA 234 N 0.98 0.60 -0.21 0.00 0.00 -0.44 -2.60 119.26 117.60 1qni h ALA 234 Ca 0.01 -0.52 -0.02 0.00 0.00 0.00 0.00 54.91 54.38 1qni h ALA 234 Cb 1.08 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 1qni h ALA 234 CO 0.10 0.69 0.03 0.28 0.00 0.00 0.00 179.25 180.36 1qni h VAL 235 N 0.50 1.22 -0.77 0.00 2.07 -1.25 -1.50 116.25 116.53 1qni h VAL 235 Ca 0.01 -0.73 0.04 0.00 0.82 0.00 0.00 66.70 66.83 1qni h VAL 235 Cb 1.14 1.31 -0.04 0.00 -1.52 0.00 0.00 31.29 32.18 1qni h VAL 235 CO 0.11 0.23 0.51 0.50 0.02 0.00 0.00 177.57 178.94 1qni h LYS 236 N 0.14 0.90 0.00 1.57 3.64 -1.44 0.10 116.57 121.48 1qni h LYS 236 Ca 0.06 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1qni h LYS 236 Cb 0.31 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 31.93 1qni h LYS 236 CO 0.00 0.60 0.00 0.00 -2.27 0.00 0.00 179.45 177.78 1qni n ALA 237 N -2.42 2.60 -1.06 5.00 0.00 -0.98 -4.89 120.51 118.75 1qni n ALA 237 Ca 0.10 -0.18 -0.02 0.00 0.00 0.00 0.00 53.44 53.34 1qni n ALA 237 Cb 0.13 -1.46 -0.01 0.00 0.00 0.00 0.00 19.45 18.11 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 0.84 0.53 3.05 0.00 0.00 0.02 -4.95 105.19 104.68 1qni n GLY 238 Ca 0.21 -0.28 -0.43 0.00 0.00 0.00 0.00 46.02 45.52 1qni n GLY 238 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1qni n ASN 239 N 0.20 5.28 -3.34 1.61 3.02 -0.59 -4.91 115.26 116.53 1qni n ASN 239 Ca -0.02 -3.11 -0.12 0.00 -0.03 0.00 0.00 54.58 51.30 1qni n ASN 239 Cb 0.16 -1.48 -0.03 0.00 -0.61 0.00 0.00 39.78 37.82 1qni n ASN 239 CO 0.00 0.00 0.00 0.72 -2.62 0.00 0.00 177.26 175.36 1qni s PHE 240 N 0.28 0.72 0.40 3.10 -0.12 -1.26 -4.66 117.98 116.43 1qni s PHE 240 Ca 0.39 -1.07 0.04 0.00 -0.05 0.00 0.00 56.93 56.24 1qni s PHE 240 Cb 0.05 0.17 -0.02 0.00 -0.63 0.00 0.00 43.02 42.58 1qni s PHE 240 CO 0.01 -1.20 0.16 0.15 -0.05 0.00 0.00 175.22 174.29 1qni s LYS 241 N -3.10 1.90 0.13 1.99 1.02 -0.38 -4.87 119.74 116.42 1qni s LYS 241 Ca 0.26 -2.15 0.06 0.00 0.02 0.00 0.00 55.97 54.16 1qni s LYS 241 Cb -0.01 -0.43 -0.04 0.00 -0.52 0.00 0.00 37.83 36.83 1qni s LYS 241 CO 0.16 -0.52 -0.15 0.95 -0.92 0.00 0.00 175.35 174.87 1qni s THR 242 N -3.26 1.41 -0.12 2.17 -4.23 -1.26 -0.80 115.64 109.55 1qni s THR 242 Ca 0.26 -1.73 0.02 0.00 -1.18 0.00 0.00 61.69 59.07 1qni s THR 242 Cb 0.02 -1.56 0.01 0.00 1.34 0.00 0.00 72.50 72.31 1qni s THR 242 CO 0.17 -0.39 -0.19 -0.63 -0.54 0.00 0.00 174.62 173.04 1qni s ILE 243 N -2.07 1.80 0.00 2.99 1.01 -1.26 -5.04 121.20 118.63 1qni s ILE 243 Ca 0.09 -0.83 0.00 0.00 0.00 0.00 0.00 60.65 59.91 1qni s ILE 243 Cb -0.05 -1.60 0.00 0.00 0.01 0.00 0.00 42.46 40.81 1qni s ILE 243 CO 0.04 0.50 0.00 0.61 0.00 0.00 0.00 174.94 176.09 1qni n GLY 244 N 4.02 3.43 0.25 6.18 0.00 -1.26 -2.34 105.19 115.47 1qni n GLY 244 Ca -0.20 -0.13 0.15 0.00 0.00 0.00 0.00 46.02 45.84 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 4.08 0.81 -4.83 1.61 8.00 -1.26 -4.90 116.55 120.06 1qni n ASP 245 Ca 0.00 -1.14 -0.36 0.00 0.71 0.00 0.00 54.79 54.00 1qni n ASP 245 Cb 0.00 -0.01 -0.06 0.00 -0.02 0.00 0.00 41.12 41.03 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 -2.11 6.92 0.02 -2.24 0.15 -0.99 -4.96 113.70 110.49 1qni s SER 246 Ca 0.39 1.18 0.23 0.00 0.70 0.00 0.00 55.95 58.45 1qni s SER 246 Cb 0.21 -2.33 0.07 0.00 -1.71 0.00 0.00 66.02 62.27 1qni s SER 246 CO 0.38 0.13 1.08 0.29 1.20 0.00 0.00 173.24 176.32 1qni n LYS 247 N 1.00 0.13 -1.58 5.44 4.76 -1.26 -4.05 118.16 122.61 1qni n LYS 247 Ca -0.06 -0.01 -0.52 0.00 -2.87 0.00 0.00 58.31 54.85 1qni n LYS 247 Cb 0.51 -1.54 -0.06 0.00 -1.84 0.00 0.00 35.03 32.11 1qni n LYS 247 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 1qni n VAL 248 N -1.70 0.12 -1.99 -0.18 0.31 -1.26 -4.88 118.33 108.75 1qni n VAL 248 Ca 0.03 -0.03 -0.40 0.00 -0.01 0.00 0.00 64.34 63.93 1qni n VAL 248 Cb 0.38 -0.75 -0.01 0.00 -0.91 0.00 0.00 33.84 32.55 1qni n VAL 248 CO 0.00 0.00 0.00 -2.84 -1.32 0.00 0.00 176.83 172.67 1qni s PRO 249 N 0.33 4.16 -0.06 5.55 0.02 -1.26 -4.61 135.00 139.13 1qni s PRO 249 Ca 0.83 2.32 -0.01 0.00 0.02 0.00 0.00 61.00 64.17 1qni s PRO 249 Cb -0.97 -2.95 0.03 0.00 0.02 0.00 0.00 34.50 30.63 1qni s PRO 249 CO 0.48 -0.39 -0.00 0.08 -0.33 0.00 0.00 177.00 176.84 1qni s VAL 250 N -1.16 0.35 0.23 3.83 1.01 0.02 -1.52 120.40 123.15 1qni s VAL 250 Ca 0.52 0.11 0.07 0.00 0.00 0.00 0.00 61.98 62.68 1qni s VAL 250 Cb -0.42 -0.49 -0.04 0.00 0.00 0.00 0.00 36.38 35.43 1qni s VAL 250 CO 0.55 0.24 0.19 0.68 0.00 0.00 0.00 175.10 176.76 1qni s VAL 251 N 1.79 4.47 -0.34 2.92 -7.23 -0.57 -1.25 120.40 120.20 1qni s VAL 251 Ca 0.02 -1.33 -0.11 0.00 -1.81 0.00 0.00 61.98 58.75 1qni s VAL 251 Cb -0.13 -3.39 0.00 0.00 0.56 0.00 0.00 36.38 33.43 1qni s VAL 251 CO -0.04 -0.30 0.20 -0.62 -0.31 0.00 0.00 175.10 174.03 1qni s ASP 252 N -3.69 5.78 -0.08 4.85 -1.08 -1.26 -1.46 116.67 119.73 1qni s ASP 252 Ca 0.32 -0.65 0.17 0.00 -0.52 0.00 0.00 52.55 51.87 1qni s ASP 252 Cb -0.08 -2.06 0.58 0.00 -1.46 0.00 0.00 42.92 39.90 1qni s ASP 252 CO 0.25 -0.28 1.50 0.61 0.52 0.00 0.00 175.17 177.77 1qni n GLY 253 N 5.03 2.91 3.81 2.66 0.00 0.17 -4.84 105.19 114.93 1qni n GLY 253 Ca -0.13 -0.75 -0.32 0.00 0.00 0.00 0.00 46.02 44.82 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 -1.65 3.22 3.56 1.61 0.52 -1.06 -4.62 118.95 120.54 1qni s ARG 254 Ca 0.43 1.12 0.00 0.00 -0.52 0.00 0.00 55.73 56.76 1qni s ARG 254 Cb 0.27 -2.02 0.00 0.00 0.52 0.00 0.00 34.95 33.72 1qni s ARG 254 CO 0.22 -0.88 0.00 0.41 0.02 0.00 0.00 175.30 175.06 1qni n GLY 255 N -1.29 2.35 3.51 -3.53 0.00 -1.26 -4.01 105.19 100.96 1qni n GLY 255 Ca 0.08 -0.30 -0.42 0.00 0.00 0.00 0.00 46.02 45.38 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 3.21 0.09 1.61 2.02 -1.26 -4.96 118.70 119.41 1qni s GLU 256 Ca 0.00 -0.41 0.04 0.00 0.02 0.00 0.00 54.97 54.62 1qni s GLU 256 Cb 0.00 -4.17 -0.03 0.00 0.10 0.00 0.00 34.13 30.03 1qni s GLU 256 CO 0.00 -1.90 -0.12 0.45 0.02 0.00 0.00 175.26 173.71 1qni s SER 257 N 3.53 1.59 0.33 -0.19 0.15 -1.26 -5.03 113.70 112.82 1qni s SER 257 Ca 0.30 -0.74 0.26 0.00 0.70 0.00 0.00 55.95 56.47 1qni s SER 257 Cb -0.12 -0.02 0.76 0.00 -1.71 0.00 0.00 66.02 64.93 1qni s SER 257 CO 0.15 -0.19 1.74 1.05 1.20 0.00 0.00 173.24 177.19 1qni h GLU 258 N 3.80 0.00 0.00 5.44 4.11 -1.94 -3.23 114.58 122.76 1qni h GLU 258 Ca -0.39 0.00 -0.17 0.00 0.07 0.00 0.00 59.36 58.88 1qni h GLU 258 Cb 1.19 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.42 1qni h GLU 258 CO 0.48 0.00 -0.99 0.74 0.07 0.00 0.00 179.01 179.31 1qni h PHE 259 N 0.00 0.00 -3.43 2.06 0.04 -1.91 -3.45 116.94 110.25 1qni h PHE 259 Ca 0.00 0.00 -0.33 0.00 2.80 0.00 0.00 57.97 60.44 1qni h PHE 259 Cb 0.74 0.00 -0.15 0.00 2.20 0.00 0.00 35.95 38.74 1qni h PHE 259 CO 0.00 0.70 -0.69 0.95 -0.60 0.00 0.00 178.31 178.67 1qni s THR 260 N -2.85 1.04 -0.03 -1.55 -4.23 -1.22 -1.41 115.64 105.40 1qni s THR 260 Ca 0.01 -2.04 -0.01 0.00 -1.18 0.00 0.00 61.69 58.47 1qni s THR 260 Cb 0.08 -2.04 0.03 0.00 1.34 0.00 0.00 72.50 71.92 1qni s THR 260 CO 0.79 -0.58 0.06 -0.13 -0.54 0.00 0.00 174.62 174.22 1qni s ARG 261 N -3.81 -0.03 -0.41 3.99 3.00 -0.78 -4.46 118.95 116.45 1qni s ARG 261 Ca 0.21 0.29 -0.11 0.00 0.00 0.00 0.00 55.73 56.12 1qni s ARG 261 Cb 0.04 -0.32 0.05 0.00 0.00 0.00 0.00 34.95 34.73 1qni s ARG 261 CO 0.03 -0.22 0.25 0.71 0.00 0.00 0.00 175.30 176.07 1qni s TYR 262 N 1.48 3.28 -0.39 -0.53 1.51 -1.26 -0.34 117.35 121.10 1qni s TYR 262 Ca -0.04 -1.19 -0.17 0.00 -1.01 0.00 0.00 57.07 54.66 1qni s TYR 262 Cb -0.12 -2.74 0.01 0.00 -0.11 0.00 0.00 41.96 38.99 1qni s TYR 262 CO -0.03 -0.75 0.43 0.42 -1.11 0.00 0.00 175.55 174.50 1qni s ILE 263 N 1.51 5.10 0.00 2.71 1.01 -0.08 -4.89 121.20 126.57 1qni s ILE 263 Ca 0.03 -0.13 -0.35 0.00 0.00 0.00 0.00 60.65 60.19 1qni s ILE 263 Cb -0.21 -3.96 -0.14 0.00 0.01 0.00 0.00 42.46 38.15 1qni s ILE 263 CO 0.05 -0.30 1.68 -2.65 0.00 0.00 0.00 174.94 173.72 1qni n PRO 264 N 5.56 1.89 -4.26 2.79 -0.02 -1.26 -0.72 135.00 138.98 1qni n PRO 264 Ca -0.07 0.69 -0.20 0.00 -2.02 0.00 0.00 63.50 61.89 1qni n PRO 264 Cb 0.48 -2.45 -0.16 0.00 -0.02 0.00 0.00 33.50 31.35 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 2.36 0.64 0.02 -1.45 1.01 -1.09 -4.88 120.40 117.02 1qni s VAL 265 Ca 0.87 -0.22 -0.35 0.00 0.00 0.00 0.00 61.98 62.28 1qni s VAL 265 Cb -0.77 -0.63 -0.14 0.00 0.00 0.00 0.00 36.38 34.84 1qni s VAL 265 CO 0.48 0.24 1.65 -0.81 0.00 0.00 0.00 175.10 176.65 1qni n PRO 266 N 3.79 1.85 -0.58 2.72 -0.04 -1.26 -1.07 135.00 140.42 1qni n PRO 266 Ca -0.23 0.67 0.00 0.00 -0.04 0.00 0.00 63.50 63.90 1qni n PRO 266 Cb 0.52 -2.43 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 4.50 -0.21 -3.94 0.54 5.02 -0.78 -4.08 118.16 119.21 1qni n LYS 267 Ca 0.20 0.20 -0.29 0.00 -2.02 0.00 0.00 58.31 56.40 1qni n LYS 267 Cb 0.25 -0.15 -0.01 0.00 -0.02 0.00 0.00 35.03 35.10 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 1.37 -1.56 -4.57 4.39 4.13 -1.26 -2.54 115.26 115.21 1qni n ASN 268 Ca 0.00 -1.06 -0.41 0.00 1.68 0.00 0.00 54.58 54.79 1qni n ASN 268 Cb 0.00 -2.86 0.02 0.00 -1.54 0.00 0.00 39.78 35.40 1qni n ASN 268 CO 0.00 0.00 0.00 -0.81 0.28 0.00 0.00 177.26 176.73 1qni n PRO 269 N -4.43 1.09 0.00 3.52 -0.04 -1.25 -4.52 135.00 129.36 1qni n PRO 269 Ca -0.25 0.40 0.00 0.00 -0.04 0.00 0.00 63.50 63.61 1qni n PRO 269 Cb 0.66 -1.95 0.00 0.00 -0.04 0.00 0.00 33.50 32.17 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 -0.83 0.00 -0.94 0.54 -0.00 0.58 -4.39 115.22 110.18 1qni n HIS 270 Ca 0.11 0.00 -0.32 0.00 0.46 0.00 0.00 57.72 57.97 1qni n HIS 270 Cb 0.41 0.00 0.14 0.00 -0.12 0.00 0.00 29.99 30.42 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 -0.95 1.80 -0.26 1.57 0.00 0.23 -4.06 107.32 105.65 1qni s GLY 271 Ca 0.00 0.57 -0.02 0.00 0.00 0.00 0.00 44.72 45.28 1qni s GLY 271 CO 0.00 0.97 0.37 -2.27 0.00 0.00 0.00 173.10 172.17 1qni s LEU 272 N -6.22 -0.61 0.03 0.66 0.20 -1.25 -0.73 118.68 110.77 1qni s LEU 272 Ca 0.67 -0.01 0.07 0.00 0.69 0.00 0.00 54.13 55.56 1qni s LEU 272 Cb -0.23 1.03 -0.02 0.00 -0.43 0.00 0.00 46.19 46.54 1qni s LEU 272 CO 0.55 -0.32 -0.22 0.20 -0.29 0.00 0.00 176.35 176.28 1qni s ASN 273 N 2.52 2.57 -0.16 3.68 -0.87 0.16 -4.38 114.94 118.47 1qni s ASN 273 Ca 0.11 -0.50 -0.13 0.00 -1.57 0.00 0.00 52.86 50.78 1qni s ASN 273 Cb -0.15 -0.23 -0.05 0.00 -0.02 0.00 0.00 41.25 40.80 1qni s ASN 273 CO -0.20 0.20 0.25 -0.89 -2.57 0.00 0.00 177.10 173.89 1qni s THR 274 N -0.74 5.33 0.49 1.60 2.01 -1.26 0.16 115.64 123.24 1qni s THR 274 Ca 0.08 0.46 -0.20 0.00 0.31 0.00 0.00 61.69 62.34 1qni s THR 274 Cb -0.09 -3.59 -0.08 0.00 0.01 0.00 0.00 72.50 68.75 1qni s THR 274 CO 0.01 0.41 1.07 -0.94 -0.69 0.00 0.00 174.62 174.49 1qni s SER 275 N 0.34 6.19 0.61 3.53 1.04 -0.67 -4.90 113.70 119.84 1qni s SER 275 Ca 0.15 2.03 0.33 0.00 0.48 0.00 0.00 55.95 58.94 1qni s SER 275 Cb -0.13 -2.57 1.90 0.00 0.10 0.00 0.00 66.02 65.32 1qni s SER 275 CO 0.03 -0.89 2.21 -0.65 0.98 0.00 0.00 173.24 174.91 1qni h PRO 276 N 1.56 0.00 -0.00 4.02 0.11 -1.85 0.30 132.00 136.14 1qni h PRO 276 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1qni h PRO 276 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1qni h PRO 276 CO 0.59 0.00 -0.02 -0.40 -0.21 0.00 0.00 178.00 177.96 1qni n ASP 277 N -3.59 0.16 -0.48 -2.05 5.68 -1.26 -4.52 116.55 110.49 1qni n ASP 277 Ca -0.01 -0.63 -0.06 0.00 -0.50 0.00 0.00 54.79 53.59 1qni n ASP 277 Cb 0.18 -0.12 -0.03 0.00 -1.14 0.00 0.00 41.12 40.02 1qni n ASP 277 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1qni n GLY 278 N 1.17 0.81 0.28 6.12 0.00 0.10 -4.91 105.19 108.75 1qni n GLY 278 Ca 0.18 -0.35 0.06 0.00 0.00 0.00 0.00 46.02 45.91 1qni n GLY 278 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1qni n LYS 279 N -2.06 1.88 -4.47 1.61 2.85 -1.26 -4.58 118.16 112.13 1qni n LYS 279 Ca -0.06 -0.70 -0.20 0.00 -1.05 0.00 0.00 58.31 56.30 1qni n LYS 279 Cb 0.30 -1.14 -0.15 0.00 -0.65 0.00 0.00 35.03 33.40 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 -1.44 0.98 -0.29 5.58 2.02 -1.26 -0.71 117.35 122.23 1qni s TYR 280 Ca 0.10 -0.19 -0.04 0.00 -0.37 0.00 0.00 57.07 56.57 1qni s TYR 280 Cb 0.09 -0.63 0.03 0.00 -0.40 0.00 0.00 41.96 41.05 1qni s TYR 280 CO 0.28 -0.02 0.02 -0.06 -1.57 0.00 0.00 175.55 174.20 1qni s PHE 281 N -0.28 3.16 -0.33 2.71 0.08 0.25 -1.67 117.98 121.89 1qni s PHE 281 Ca 0.04 -1.41 -0.10 0.00 0.12 0.00 0.00 56.93 55.59 1qni s PHE 281 Cb -0.04 -2.16 0.01 0.00 -0.57 0.00 0.00 43.02 40.26 1qni s PHE 281 CO -0.00 -0.69 0.16 0.42 -0.10 0.00 0.00 175.22 175.00 1qni s ILE 282 N 1.38 4.48 -0.08 0.64 1.01 0.12 -0.19 121.20 128.56 1qni s ILE 282 Ca -0.00 -0.65 -0.16 0.00 0.00 0.00 0.00 60.65 59.84 1qni s ILE 282 Cb -0.18 -3.38 -0.05 0.00 0.01 0.00 0.00 42.46 38.86 1qni s ILE 282 CO -0.01 -0.05 0.43 0.00 0.00 0.00 0.00 174.94 175.31 1qni s ALA 283 N 1.57 3.56 -0.19 9.38 0.00 0.13 -0.66 121.76 135.55 1qni s ALA 283 Ca 0.03 -0.23 -0.17 0.00 0.00 0.00 0.00 51.96 51.59 1qni s ALA 283 Cb -0.18 -2.53 -0.04 0.00 0.00 0.00 0.00 23.12 20.37 1qni s ALA 283 CO 0.06 0.17 0.44 -0.80 0.00 0.00 0.00 175.76 175.63 1qni s ASN 284 N 0.02 6.50 0.50 0.00 0.01 0.09 -0.36 114.94 121.70 1qni s ASN 284 Ca 0.24 0.60 0.26 0.00 -0.71 0.00 0.00 52.86 53.24 1qni s ASN 284 Cb -0.15 -2.25 1.31 0.00 0.41 0.00 0.00 41.25 40.56 1qni s ASN 284 CO 0.10 -0.09 2.01 1.23 -1.51 0.00 0.00 177.10 178.85 1qni h GLY 285 N 7.55 0.00 0.00 0.66 0.00 -1.38 0.16 103.07 110.07 1qni h GLY 285 Ca -0.36 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.97 1qni h GLY 285 CO 0.73 0.00 0.00 1.17 0.00 0.00 0.00 176.54 178.44 1qni n LYS 286 N -3.64 0.00 0.26 4.80 4.81 0.17 -1.31 118.16 123.24 1qni n LYS 286 Ca -0.01 0.00 0.16 0.00 -0.87 0.00 0.00 58.31 57.58 1qni n LYS 286 Cb 0.28 0.00 0.54 0.00 0.02 0.00 0.00 35.03 35.87 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 -9.32 3.14 3.38 -1.72 -3.17 115.31 107.62 1qni h LEU 287 Ca 0.00 0.00 -0.65 0.00 0.09 0.00 0.00 57.88 57.32 1qni h LEU 287 Cb 0.00 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 40.62 1qni h LEU 287 CO 0.00 0.00 -0.55 -0.55 0.09 0.00 0.00 178.44 177.43 1qni s SER 288 N -5.76 5.80 0.00 -0.43 0.15 -0.43 -4.93 113.70 108.11 1qni s SER 288 Ca 0.03 0.23 0.00 0.00 0.70 0.00 0.00 55.95 56.90 1qni s SER 288 Cb 0.08 -1.88 0.00 0.00 -1.71 0.00 0.00 66.02 62.51 1qni s SER 288 CO 0.57 0.30 0.68 -0.81 1.20 0.00 0.00 173.24 175.18 1qni n PRO 289 N 2.71 0.80 -3.46 5.44 -0.04 -1.26 -4.34 135.00 134.85 1qni n PRO 289 Ca -0.18 0.00 -0.19 0.00 -0.04 0.00 0.00 63.50 63.09 1qni n PRO 289 Cb 0.53 -1.19 -0.03 0.00 -0.04 0.00 0.00 33.50 32.77 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 0.45 0.00 -3.80 0.52 -2.24 -1.26 -0.29 114.28 107.66 1qni n THR 290 Ca 0.00 -1.44 -0.13 0.00 -2.27 0.00 0.00 64.05 60.21 1qni n THR 290 Cb 0.34 0.16 -0.12 0.00 -2.10 0.00 0.00 70.33 68.61 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 -2.01 -0.01 -0.17 2.28 1.01 -1.02 -1.53 120.40 118.96 1qni s VAL 291 Ca 0.05 0.03 -0.02 0.00 0.00 0.00 0.00 61.98 62.03 1qni s VAL 291 Cb -0.00 -0.27 -0.02 0.00 0.00 0.00 0.00 36.38 36.09 1qni s VAL 291 CO 0.03 0.01 -0.08 -0.44 0.00 0.00 0.00 175.10 174.63 1qni s SER 292 N 0.27 4.31 -0.31 3.32 0.01 0.51 -3.23 113.70 118.58 1qni s SER 292 Ca -0.01 -0.30 -0.09 0.00 1.31 0.00 0.00 55.95 56.85 1qni s SER 292 Cb -0.03 -1.70 -0.01 0.00 0.21 0.00 0.00 66.02 64.49 1qni s SER 292 CO -0.01 0.10 0.15 -0.69 0.41 0.00 0.00 173.24 173.19 1qni s VAL 293 N 0.78 4.57 -0.20 3.43 1.01 -0.30 -0.69 120.40 128.99 1qni s VAL 293 Ca -0.03 -0.42 -0.10 0.00 0.00 0.00 0.00 61.98 61.44 1qni s VAL 293 Cb -0.15 -3.32 -0.05 0.00 0.00 0.00 0.00 36.38 32.86 1qni s VAL 293 CO 0.02 0.08 0.12 -0.63 0.00 0.00 0.00 175.10 174.68 1qni s ILE 294 N 1.61 5.31 -0.50 2.22 1.01 0.73 -1.55 121.20 130.03 1qni s ILE 294 Ca 0.05 0.15 -0.25 0.00 0.00 0.00 0.00 60.65 60.60 1qni s ILE 294 Cb -0.17 -3.42 0.03 0.00 0.01 0.00 0.00 42.46 38.91 1qni s ILE 294 CO 0.06 0.44 0.95 0.00 0.00 0.00 0.00 174.94 176.39 1qni s ALA 295 N 0.37 3.20 0.63 9.38 0.00 -0.56 -0.59 121.76 134.19 1qni s ALA 295 Ca 0.07 -0.93 0.37 0.00 0.00 0.00 0.00 51.96 51.47 1qni s ALA 295 Cb -0.11 -3.70 2.10 0.00 0.00 0.00 0.00 23.12 21.41 1qni s ALA 295 CO -0.02 -2.20 2.29 0.82 0.00 0.00 0.00 175.76 176.65 1qni h ILE 296 N 6.07 0.25 -0.03 0.00 2.04 -1.24 -1.36 117.51 123.24 1qni h ILE 296 Ca -0.25 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.57 1qni h ILE 296 Cb 1.07 0.97 -0.01 0.00 -0.74 0.00 0.00 36.82 38.12 1qni h ILE 296 CO 1.06 0.00 -0.17 -0.78 0.00 0.00 0.00 178.15 178.26 1qni h ASP 297 N 0.00 0.04 0.06 1.72 1.82 -1.90 -2.79 116.42 115.38 1qni h ASP 297 Ca 0.01 -0.01 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 1qni h ASP 297 Cb 0.06 -0.01 0.00 0.00 0.68 0.00 0.00 39.33 40.06 1qni h ASP 297 CO -0.00 0.22 -0.18 0.29 -1.61 0.00 0.00 179.24 177.95 1qni n LYS 298 N -4.32 1.42 -0.11 0.28 5.02 -0.51 -4.35 118.16 115.59 1qni n LYS 298 Ca -0.02 -0.99 0.00 0.00 -2.02 0.00 0.00 58.31 55.28 1qni n LYS 298 Cb 0.25 -1.48 0.28 0.00 -0.02 0.00 0.00 35.03 34.06 1qni n LYS 298 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 1qni h LEU 299 N 2.42 0.69 -0.49 -0.35 3.38 -1.56 -2.43 115.31 116.97 1qni h LEU 299 Ca 0.00 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1qni h LEU 299 Cb 0.65 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.20 1qni h LEU 299 CO 0.00 0.58 0.32 0.44 0.09 0.00 0.00 178.44 179.87 1qni h ASP 300 N 0.77 0.56 0.16 -0.43 3.32 -1.78 -1.86 116.42 117.16 1qni h ASP 300 Ca 0.19 -0.02 -0.06 0.00 0.02 0.00 0.00 57.03 57.17 1qni h ASP 300 Cb 0.07 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.47 1qni h ASP 300 CO -0.03 0.41 -0.23 0.44 -1.72 0.00 0.00 179.24 178.12 1qni h ASP 301 N 0.66 0.13 -0.22 6.45 3.32 -1.78 -2.97 116.42 122.02 1qni h ASP 301 Ca 0.18 -0.03 -0.15 0.00 0.02 0.00 0.00 57.03 57.05 1qni h ASP 301 Cb -0.07 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.43 1qni h ASP 301 CO -0.04 0.37 -0.40 0.25 -1.72 0.00 0.00 179.24 177.70 1qni h LEU 302 N 0.13 0.82 -0.29 1.55 5.85 -0.90 0.46 115.31 122.92 1qni h LEU 302 Ca 0.02 -0.37 0.00 0.00 0.84 0.00 0.00 57.88 58.37 1qni h LEU 302 Cb 0.48 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 41.28 1qni h LEU 302 CO 0.03 1.12 0.00 0.49 -0.34 0.00 0.00 178.44 179.74 1qni n PHE 303 N -4.04 0.10 0.20 1.25 3.01 -0.77 -2.02 117.46 115.19 1qni n PHE 303 Ca -0.02 -0.05 0.02 0.00 1.01 0.00 0.00 57.45 58.41 1qni n PHE 303 Cb 0.54 0.00 -0.02 0.00 -0.01 0.00 0.00 39.48 39.99 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 -0.32 4.55 -1.86 -1.08 4.07 -0.84 -5.00 120.64 120.16 1qni n GLU 304 Ca 0.05 -0.14 -0.12 0.00 -0.06 0.00 0.00 57.16 56.89 1qni n GLU 304 Cb 0.08 -0.77 -0.03 0.00 -0.06 0.00 0.00 31.44 30.67 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 -0.85 -4.18 0.14 4.31 8.00 -0.56 -4.91 116.55 118.50 1qni n ASP 305 Ca 0.01 0.12 0.12 0.00 0.71 0.00 0.00 54.79 55.76 1qni n ASP 305 Cb 0.07 -3.12 0.20 0.00 -0.02 0.00 0.00 41.12 38.25 1qni n ASP 305 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 1qni h LYS 306 N 0.00 0.00 -4.94 -1.24 1.57 -1.21 -3.47 116.57 107.28 1qni h LYS 306 Ca -0.28 0.00 -0.50 0.00 -1.87 0.00 0.00 60.65 58.00 1qni h LYS 306 Cb 1.05 0.00 -0.13 0.00 0.08 0.00 0.00 32.23 33.22 1qni h LYS 306 CO 0.36 0.00 -0.50 0.96 -0.57 0.00 0.00 179.45 179.70 1qni s ILE 307 N -3.20 0.23 0.33 1.86 -4.36 -1.25 -5.02 121.20 109.79 1qni s ILE 307 Ca 0.06 -2.00 -0.05 0.00 -0.26 0.00 0.00 60.65 58.41 1qni s ILE 307 Cb 0.09 -2.43 -0.05 0.00 1.25 0.00 0.00 42.46 41.33 1qni s ILE 307 CO 0.68 0.00 0.60 -0.70 0.24 0.00 0.00 174.94 175.76 1qni s GLU 308 N -3.58 3.62 0.12 0.37 2.56 -1.26 -4.83 118.70 115.70 1qni s GLU 308 Ca 0.33 0.03 -0.29 0.00 0.00 0.00 0.00 54.97 55.04 1qni s GLU 308 Cb 0.02 -2.59 -0.07 0.00 2.00 0.00 0.00 34.13 33.50 1qni s GLU 308 CO 0.22 0.13 1.59 -0.07 -0.56 0.00 0.00 175.26 176.57 1qni h LEU 309 N 1.33 -1.18 -1.39 2.70 3.38 -1.96 -1.77 115.31 116.42 1qni h LEU 309 Ca -0.48 0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.64 1qni h LEU 309 Cb 1.20 0.47 0.00 0.00 0.09 0.00 0.00 40.66 42.41 1qni h LEU 309 CO 0.65 -0.44 0.00 0.03 0.09 0.00 0.00 178.44 178.77 1qni h ARG 310 N -0.54 0.00 0.00 1.13 2.47 -1.94 -2.56 114.38 112.94 1qni h ARG 310 Ca 0.05 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.77 1qni h ARG 310 Cb 0.63 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.95 1qni h ARG 310 CO -0.31 0.00 0.00 -0.44 0.56 0.00 0.00 179.97 179.78 1qni h ASP 311 N 0.00 0.00 1.11 7.04 3.32 -1.71 -0.84 116.42 125.34 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 0.13 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.68 1qni h ASP 311 CO 0.00 0.00 0.00 0.71 -1.72 0.00 0.00 179.24 178.23 1qni h THR 312 N 0.00 0.00 -3.37 0.35 1.35 -1.58 -3.42 112.91 106.24 1qni h THR 312 Ca 0.00 -0.43 -0.56 0.00 -0.55 0.00 0.00 66.41 64.87 1qni h THR 312 Cb 0.23 1.31 -0.06 0.00 -1.73 0.00 0.00 68.15 67.90 1qni h THR 312 CO 0.00 0.00 1.02 -0.63 -0.25 0.00 0.00 175.52 175.66 1qni s ILE 313 N -3.33 3.99 -0.38 6.82 -1.09 -0.32 -1.50 121.20 125.40 1qni s ILE 313 Ca 0.05 0.99 0.23 0.00 -2.23 0.00 0.00 60.65 59.69 1qni s ILE 313 Cb 0.10 -4.40 -0.01 0.00 -1.58 0.00 0.00 42.46 36.57 1qni s ILE 313 CO 0.50 -0.93 1.10 0.52 -1.23 0.00 0.00 174.94 174.90 1qni n VAL 314 N 6.96 0.49 -3.56 2.92 0.31 -0.59 -4.96 118.33 119.89 1qni n VAL 314 Ca 0.14 -0.44 -0.08 0.00 -0.01 0.00 0.00 64.34 63.94 1qni n VAL 314 Cb 0.49 -0.22 -0.04 0.00 -0.91 0.00 0.00 33.84 33.16 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 -3.30 -1.94 -0.46 3.52 0.00 -1.24 -4.57 121.76 113.77 1qni s ALA 315 Ca 0.01 1.45 0.07 0.00 0.00 0.00 0.00 51.96 53.50 1qni s ALA 315 Cb 0.11 -0.36 0.25 0.00 0.00 0.00 0.00 23.12 23.12 1qni s ALA 315 CO 0.78 -0.46 0.81 -1.91 0.00 0.00 0.00 175.76 174.98 1qni n GLU 316 N 0.31 0.79 -2.34 0.00 2.13 -1.26 -1.15 120.64 119.11 1qni n GLU 316 Ca -0.07 -2.22 -0.37 0.00 0.66 0.00 0.00 57.16 55.17 1qni n GLU 316 Cb 0.59 -1.37 -0.02 0.00 0.27 0.00 0.00 31.44 30.91 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 0.03 3.84 -0.10 5.31 0.04 -1.20 -4.74 135.00 138.18 1qni s PRO 317 Ca 0.32 1.68 -0.21 0.00 0.04 0.00 0.00 61.00 62.83 1qni s PRO 317 Cb 0.22 -2.40 -0.04 0.00 0.04 0.00 0.00 34.50 32.33 1qni s PRO 317 CO -0.19 -0.46 0.62 -2.00 0.04 0.00 0.00 177.00 175.01 1qni s GLU 318 N -2.71 4.38 -0.00 4.56 2.12 -1.26 -2.44 118.70 123.35 1qni s GLU 318 Ca 0.63 0.71 -0.00 0.00 0.36 0.00 0.00 54.97 56.67 1qni s GLU 318 Cb -0.26 -3.46 -0.00 0.00 0.26 0.00 0.00 34.13 30.67 1qni s GLU 318 CO 0.32 0.06 -0.00 1.28 -0.54 0.00 0.00 175.26 176.37 1qni n LEU 319 N 3.88 0.64 0.00 2.70 4.77 0.60 -4.98 117.00 124.62 1qni n LEU 319 Ca -0.03 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.95 1qni n LEU 319 Cb 0.51 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.59 1qni n LEU 319 CO 0.45 0.11 0.00 0.61 -1.33 0.00 0.00 177.39 177.23 1qni n GLY 320 N 3.08 -1.26 3.64 -0.72 0.00 -1.14 -5.06 105.19 103.73 1qni n GLY 320 Ca -0.01 -0.87 -0.41 0.00 0.00 0.00 0.00 46.02 44.73 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 4.09 -0.02 0.99 1.43 -1.26 -4.18 118.68 119.72 1qni s LEU 321 Ca 0.00 0.93 -0.00 0.00 -1.03 0.00 0.00 54.13 54.02 1qni s LEU 321 Cb 0.00 -3.06 0.00 0.00 0.03 0.00 0.00 46.19 43.16 1qni s LEU 321 CO 0.00 -0.43 0.02 0.61 0.23 0.00 0.00 176.35 176.78 1qni n GLY 322 N 3.85 0.71 3.68 -3.19 0.00 -1.20 -2.01 105.19 107.04 1qni n GLY 322 Ca 0.03 -0.58 -0.42 0.00 0.00 0.00 0.00 46.02 45.05 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 -4.58 4.22 -0.16 1.61 0.04 -1.25 -0.92 135.00 133.96 1qni s PRO 323 Ca 0.01 2.15 -0.05 0.00 0.04 0.00 0.00 61.00 63.15 1qni s PRO 323 Cb -0.00 -3.75 -0.08 0.00 0.04 0.00 0.00 34.50 30.71 1qni s PRO 323 CO 0.01 -0.73 -0.18 1.28 0.04 0.00 0.00 177.00 177.42 1qni n LEU 324 N 6.16 1.83 -4.08 -3.56 4.77 -0.52 -0.66 117.00 120.95 1qni n LEU 324 Ca 0.16 0.09 -0.12 0.00 -0.03 0.00 0.00 56.01 56.11 1qni n LEU 324 Cb 0.42 -0.50 -0.11 0.00 -2.33 0.00 0.00 43.42 40.91 1qni n LEU 324 CO 0.61 0.49 -0.39 -1.00 -1.33 0.00 0.00 177.39 175.78 1qni s HIS 325 N -2.30 0.66 0.05 -1.77 3.76 -1.26 -0.60 115.29 113.82 1qni s HIS 325 Ca -0.22 -0.63 0.06 0.00 -0.15 0.00 0.00 55.06 54.12 1qni s HIS 325 Cb 0.07 -0.40 -0.02 0.00 1.11 0.00 0.00 32.58 33.34 1qni s HIS 325 CO 0.31 -0.13 -0.16 0.99 -0.85 0.00 0.00 174.74 174.90 1qni s THR 326 N -2.02 1.25 0.13 1.30 2.01 -1.26 -1.07 115.64 115.99 1qni s THR 326 Ca -0.05 -1.10 -0.01 0.00 0.31 0.00 0.00 61.69 60.84 1qni s THR 326 Cb -0.06 -1.13 -0.04 0.00 0.01 0.00 0.00 72.50 71.28 1qni s THR 326 CO -0.02 0.01 0.06 0.28 -0.69 0.00 0.00 174.62 174.27 1qni s THR 327 N -0.90 0.10 0.08 -0.82 -1.32 0.13 -4.77 115.64 108.14 1qni s THR 327 Ca 0.03 -1.92 0.06 0.00 -1.21 0.00 0.00 61.69 58.65 1qni s THR 327 Cb -0.08 -2.06 -0.03 0.00 -1.51 0.00 0.00 72.50 68.81 1qni s THR 327 CO 0.02 -0.45 -0.17 -0.36 -2.21 0.00 0.00 174.62 171.45 1qni s PHE 328 N -4.05 1.47 -1.98 9.09 0.40 -1.26 0.09 117.98 121.73 1qni s PHE 328 Ca 0.25 -0.43 0.25 0.00 -0.60 0.00 0.00 56.93 56.39 1qni s PHE 328 Cb 0.07 -0.82 0.42 0.00 0.51 0.00 0.00 43.02 43.21 1qni s PHE 328 CO 0.02 0.12 1.36 -0.40 0.70 0.00 0.00 175.22 177.02 1qni n ASP 329 N 1.25 1.57 0.00 1.36 5.68 -1.16 -4.61 116.55 120.64 1qni n ASP 329 Ca -0.20 -1.25 0.00 0.00 -0.50 0.00 0.00 54.79 52.84 1qni n ASP 329 Cb 0.54 0.27 0.00 0.00 -1.14 0.00 0.00 41.12 40.79 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 1.37 0.40 0.52 6.12 0.00 -1.26 -2.64 105.19 109.69 1qni n GLY 330 Ca 0.11 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.19 1qni n GLY 330 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1qni n ARG 331 N -1.85 1.76 0.00 1.61 1.74 -1.26 -4.96 116.66 113.70 1qni n ARG 331 Ca 0.00 -1.61 0.00 0.00 -0.77 0.00 0.00 57.85 55.47 1qni n ARG 331 Cb 0.13 -1.23 0.00 0.00 -1.02 0.00 0.00 32.46 30.34 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 0.52 0.55 3.93 -0.13 0.00 -1.26 -5.09 105.19 103.71 1qni n GLY 332 Ca 0.09 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.83 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 -1.99 6.32 0.10 1.61 0.01 -1.26 -2.04 114.94 117.69 1qni s ASN 333 Ca 0.00 0.19 0.09 0.00 -0.71 0.00 0.00 52.86 52.43 1qni s ASN 333 Cb 0.00 -1.91 -0.03 0.00 0.41 0.00 0.00 41.25 39.71 1qni s ASN 333 CO 0.00 0.08 -0.24 0.00 -1.51 0.00 0.00 177.10 175.44 1qni s ALA 334 N -1.68 2.05 -0.14 0.60 0.00 0.15 -2.99 121.76 119.75 1qni s ALA 334 Ca 0.35 -1.31 0.02 0.00 0.00 0.00 0.00 51.96 51.02 1qni s ALA 334 Cb -0.12 -0.33 0.01 0.00 0.00 0.00 0.00 23.12 22.69 1qni s ALA 334 CO 0.28 0.45 -0.20 0.71 0.00 0.00 0.00 175.76 177.00 1qni s TYR 335 N -1.04 2.49 0.00 0.00 1.51 0.11 -0.50 117.35 119.92 1qni s TYR 335 Ca 0.10 -1.26 0.07 0.00 -1.01 0.00 0.00 57.07 54.97 1qni s TYR 335 Cb -0.10 -1.72 -0.02 0.00 -0.11 0.00 0.00 41.96 40.01 1qni s TYR 335 CO 0.04 -0.60 -0.23 0.99 -1.11 0.00 0.00 175.55 174.65 1qni s THR 336 N 0.91 1.80 0.05 -0.71 2.01 -0.54 0.19 115.64 119.35 1qni s THR 336 Ca -0.06 -1.06 -0.19 0.00 0.31 0.00 0.00 61.69 60.69 1qni s THR 336 Cb -0.15 -1.51 -0.06 0.00 0.01 0.00 0.00 72.50 70.78 1qni s THR 336 CO -0.03 0.43 0.57 0.42 -0.69 0.00 0.00 174.62 175.32 1qni s THR 337 N -0.61 4.79 -0.47 -0.82 -4.23 -0.23 0.01 115.64 114.07 1qni s THR 337 Ca 0.09 1.21 0.03 0.00 -1.18 0.00 0.00 61.69 61.84 1qni s THR 337 Cb -0.09 -3.90 0.12 0.00 1.34 0.00 0.00 72.50 69.97 1qni s THR 337 CO 0.00 0.52 0.22 -0.76 -0.54 0.00 0.00 174.62 174.06 1qni s LEU 338 N -0.87 4.61 0.15 4.79 1.43 0.17 -1.43 118.68 127.52 1qni s LEU 338 Ca 0.29 -2.70 -0.21 0.00 -1.03 0.00 0.00 54.13 50.49 1qni s LEU 338 Cb -0.19 -1.67 0.03 0.00 0.03 0.00 0.00 46.19 44.39 1qni s LEU 338 CO 0.18 -0.31 1.65 0.15 0.23 0.00 0.00 176.35 178.26 1qni h PHE 339 N 6.97 -0.43 -0.16 0.29 3.57 -1.07 0.58 116.94 126.68 1qni h PHE 339 Ca -0.06 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.41 1qni h PHE 339 Cb 0.94 0.23 -0.00 0.00 2.79 0.00 0.00 35.95 39.91 1qni h PHE 339 CO 0.53 -0.24 -0.13 0.82 -2.23 0.00 0.00 178.31 177.06 1qni h ILE 340 N -0.15 1.33 -0.00 1.41 2.04 -1.60 -2.93 117.51 117.61 1qni h ILE 340 Ca 0.14 -1.24 0.00 0.00 1.00 0.00 0.00 64.86 64.76 1qni h ILE 340 Cb 0.37 1.79 0.00 0.00 -0.74 0.00 0.00 36.82 38.24 1qni h ILE 340 CO -0.35 0.37 -0.00 0.47 0.00 0.00 0.00 178.15 178.63 1qni n ASP 341 N -4.56 0.01 -3.69 1.72 8.00 -1.07 -4.94 116.55 112.02 1qni n ASP 341 Ca -0.06 -0.18 -0.25 0.00 0.71 0.00 0.00 54.79 55.01 1qni n ASP 341 Cb 0.35 -0.27 0.03 0.00 -0.02 0.00 0.00 41.12 41.21 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 -1.27 -3.10 -3.85 -2.24 2.88 0.20 -4.90 113.62 101.33 1qni n SER 342 Ca 0.15 -0.92 -0.09 0.00 -1.33 0.00 0.00 58.87 56.68 1qni n SER 342 Cb 0.24 -3.74 -0.05 0.00 -0.75 0.00 0.00 64.21 59.92 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 -5.92 1.41 -0.17 -1.46 -2.07 -0.84 -0.98 119.66 109.63 1qni s GLN 343 Ca 0.22 -1.02 -0.05 0.00 -1.82 0.00 0.00 55.36 52.69 1qni s GLN 343 Cb -0.07 0.49 -0.03 0.00 -1.09 0.00 0.00 33.01 32.31 1qni s GLN 343 CO 0.84 -0.59 -0.00 0.08 -1.32 0.00 0.00 175.29 174.30 1qni s VAL 344 N -3.93 4.15 -0.27 3.63 1.01 -0.65 0.45 120.40 124.79 1qni s VAL 344 Ca 0.14 -0.26 -0.07 0.00 0.00 0.00 0.00 61.98 61.78 1qni s VAL 344 Cb -0.00 -2.84 -0.01 0.00 0.00 0.00 0.00 36.38 33.52 1qni s VAL 344 CO 0.01 0.47 0.08 0.00 0.00 0.00 0.00 175.10 175.66 1qni s LYS 346 N 1.58 4.17 0.08 0.00 2.20 0.45 -1.47 119.74 126.75 1qni s LYS 346 Ca 0.05 0.61 0.02 0.00 -0.36 0.00 0.00 55.97 56.29 1qni s LYS 346 Cb -0.16 -3.61 -0.04 0.00 -1.51 0.00 0.00 37.83 32.51 1qni s LYS 346 CO 0.03 -0.32 -0.07 1.67 -0.36 0.00 0.00 175.35 176.30 1qni s TRP 347 N 2.20 0.84 -0.17 4.03 1.48 0.34 0.07 118.94 127.74 1qni s TRP 347 Ca 0.28 -0.79 -0.16 0.00 -1.06 0.00 0.00 56.10 54.37 1qni s TRP 347 Cb -0.16 -0.49 -0.04 0.00 -1.16 0.00 0.00 33.47 31.62 1qni s TRP 347 CO 0.09 -0.13 0.38 1.21 -4.06 0.00 0.00 176.95 174.45 1qni s ASN 348 N -2.63 6.49 0.05 -2.66 3.84 0.14 0.31 114.94 120.48 1qni s ASN 348 Ca 0.06 0.58 -0.21 0.00 0.21 0.00 0.00 52.86 53.49 1qni s ASN 348 Cb 0.01 -2.23 -0.13 0.00 -0.55 0.00 0.00 41.25 38.35 1qni s ASN 348 CO -0.03 -0.00 1.47 0.40 -2.79 0.00 0.00 177.10 176.14 1qni h ILE 349 N 4.85 1.26 -0.43 -5.21 2.04 -1.74 -2.75 117.51 115.54 1qni h ILE 349 Ca -0.39 -0.87 0.03 0.00 1.00 0.00 0.00 64.86 64.63 1qni h ILE 349 Cb 1.17 1.58 -0.04 0.00 -0.74 0.00 0.00 36.82 38.79 1qni h ILE 349 CO 0.74 0.25 0.22 0.00 0.00 0.00 0.00 178.15 179.36 1qni h ALA 350 N 0.74 0.54 -0.20 1.87 0.00 -1.95 -1.02 119.26 119.24 1qni h ALA 350 Ca 0.04 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1qni h ALA 350 Cb 0.39 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1qni h ALA 350 CO 0.01 -0.14 0.08 -0.44 0.00 0.00 0.00 179.25 178.76 1qni h ASP 351 N 0.43 0.24 0.49 0.00 3.32 -1.93 0.03 116.42 119.00 1qni h ASP 351 Ca 0.18 -0.02 -0.15 0.00 0.02 0.00 0.00 57.03 57.06 1qni h ASP 351 Cb 0.09 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.56 1qni h ASP 351 CO -0.13 0.22 -0.67 0.00 -1.72 0.00 0.00 179.24 176.94 1qni h ALA 352 N 1.82 0.80 -0.38 3.45 0.00 -1.05 0.55 119.26 124.45 1qni h ALA 352 Ca 0.07 -0.60 -0.02 0.00 0.00 0.00 0.00 54.91 54.37 1qni h ALA 352 Cb 0.06 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1qni h ALA 352 CO -0.01 0.79 0.17 0.82 0.00 0.00 0.00 179.25 181.02 1qni h ILE 353 N 0.11 1.18 -0.20 0.00 2.04 0.23 -0.16 117.51 120.72 1qni h ILE 353 Ca -0.01 -0.53 -0.03 0.00 1.00 0.00 0.00 64.86 65.29 1qni h ILE 353 Cb 1.20 0.83 -0.01 0.00 -0.74 0.00 0.00 36.82 38.11 1qni h ILE 353 CO 0.10 0.19 0.02 0.11 0.00 0.00 0.00 178.15 178.58 1qni h LYS 354 N 0.47 0.33 -0.72 2.37 1.57 -0.95 -2.70 116.57 116.94 1qni h LYS 354 Ca 0.13 -0.09 0.02 0.00 -1.87 0.00 0.00 60.65 58.84 1qni h LYS 354 Cb 0.15 -0.04 -0.04 0.00 0.08 0.00 0.00 32.23 32.39 1qni h LYS 354 CO -0.01 0.50 0.47 1.25 -0.57 0.00 0.00 179.45 181.09 1qni h HIS 355 N 0.12 0.86 -0.03 -1.35 2.76 -0.73 -0.93 115.15 115.85 1qni h HIS 355 Ca 0.06 0.02 -0.08 0.00 -2.20 0.00 0.00 60.37 58.17 1qni h HIS 355 Cb 0.33 -0.29 -0.01 0.00 1.55 0.00 0.00 27.41 28.99 1qni h HIS 355 CO 0.02 0.52 -0.34 -0.92 -1.30 0.00 0.00 177.93 175.91 1qni h TYR 356 N 0.91 0.05 0.00 5.26 3.20 -0.87 -2.78 116.97 122.73 1qni h TYR 356 Ca 0.28 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.14 1qni h TYR 356 Cb -0.00 -0.01 0.00 0.00 1.54 0.00 0.00 36.73 38.25 1qni h TYR 356 CO -0.00 0.38 -0.04 0.09 -1.64 0.00 0.00 178.16 176.95 1qni n ASN 357 N -4.12 0.33 0.00 -2.11 3.02 -0.44 -4.88 115.26 107.05 1qni n ASN 357 Ca -0.02 0.48 0.00 0.00 -0.03 0.00 0.00 54.58 55.01 1qni n ASN 357 Cb 0.39 -0.55 0.00 0.00 -0.61 0.00 0.00 39.78 39.01 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 1.43 0.60 2.17 7.41 0.00 -1.04 -5.11 105.19 110.66 1qni n GLY 358 Ca 0.06 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.89 1qni n GLY 358 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1qni n ASP 359 N 0.00 -2.08 -0.02 1.61 8.00 -0.70 -4.99 116.55 118.37 1qni n ASP 359 Ca 0.00 -0.84 0.00 0.00 0.71 0.00 0.00 54.79 54.66 1qni n ASP 359 Cb 0.00 -0.64 0.00 0.00 -0.02 0.00 0.00 41.12 40.47 1qni n ASP 359 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1qni n ARG 360 N -3.80 1.35 -1.76 -1.24 1.74 -1.26 -4.67 116.66 107.02 1qni n ARG 360 Ca 0.09 -1.01 -0.37 0.00 -0.77 0.00 0.00 57.85 55.79 1qni n ARG 360 Cb 0.37 -0.75 0.07 0.00 -1.02 0.00 0.00 32.46 31.13 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 -0.52 2.12 -0.35 1.55 1.01 -1.26 -4.97 120.40 117.98 1qni s VAL 361 Ca 0.01 0.07 -0.21 0.00 0.00 0.00 0.00 61.98 61.85 1qni s VAL 361 Cb 0.01 -3.01 0.00 0.00 0.00 0.00 0.00 36.38 33.38 1qni s VAL 361 CO 0.00 -0.02 0.69 0.20 0.00 0.00 0.00 175.10 175.98 1qni s ASN 362 N -1.45 6.49 0.10 3.32 0.02 -1.26 -4.79 114.94 117.38 1qni s ASN 362 Ca 0.82 0.27 0.20 0.00 -1.02 0.00 0.00 52.86 53.12 1qni s ASN 362 Cb -0.36 -2.35 -0.10 0.00 0.02 0.00 0.00 41.25 38.45 1qni s ASN 362 CO 0.39 -0.63 0.86 0.00 0.02 0.00 0.00 177.10 177.74 1qni n TYR 363 N 6.16 0.87 -2.82 2.20 0.18 -1.26 -4.85 117.16 117.64 1qni n TYR 363 Ca 0.00 0.27 -0.41 0.00 1.88 0.00 0.00 57.90 59.65 1qni n TYR 363 Cb 0.48 -0.99 -0.04 0.00 -0.38 0.00 0.00 39.34 38.42 1qni n TYR 363 CO 0.00 0.00 0.00 0.42 -2.08 0.00 0.00 176.86 175.20 1qni s ILE 364 N -3.13 4.86 -0.18 -3.48 1.01 -1.26 -0.69 121.20 118.32 1qni s ILE 364 Ca -0.03 1.88 0.15 0.00 0.00 0.00 0.00 60.65 62.65 1qni s ILE 364 Cb 0.09 -4.24 -0.22 0.00 0.01 0.00 0.00 42.46 38.11 1qni s ILE 364 CO 0.81 0.22 0.05 0.54 0.00 0.00 0.00 174.94 176.56 1qni n ARG 365 N 3.64 1.02 -3.59 2.79 5.12 0.11 -4.95 116.66 120.79 1qni n ARG 365 Ca 0.03 -0.00 -0.08 0.00 -1.93 0.00 0.00 57.85 55.87 1qni n ARG 365 Cb 0.51 -1.46 -0.05 0.00 -1.16 0.00 0.00 32.46 30.30 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 -2.44 0.45 -0.11 5.56 0.74 -1.03 -4.99 119.66 117.84 1qni s GLN 366 Ca -0.10 0.09 0.00 0.00 0.05 0.00 0.00 55.36 55.40 1qni s GLN 366 Cb 0.06 0.21 0.02 0.00 1.10 0.00 0.00 33.01 34.40 1qni s GLN 366 CO 0.73 -0.14 -0.10 0.15 -0.55 0.00 0.00 175.29 175.38 1qni s LYS 367 N -1.18 1.70 -0.20 1.67 1.02 -1.26 -0.41 119.74 121.08 1qni s LYS 367 Ca 0.02 -0.33 -0.04 0.00 0.02 0.00 0.00 55.97 55.63 1qni s LYS 367 Cb -0.01 -1.67 -0.01 0.00 -0.52 0.00 0.00 37.83 35.62 1qni s LYS 367 CO -0.01 -0.22 -0.04 -1.17 -0.92 0.00 0.00 175.35 172.98 1qni s LEU 368 N 1.53 2.98 0.15 3.17 0.20 -0.69 -4.96 118.68 121.06 1qni s LEU 368 Ca 0.02 -0.32 -0.31 0.00 0.69 0.00 0.00 54.13 54.21 1qni s LEU 368 Cb -0.13 -1.74 -0.11 0.00 -0.43 0.00 0.00 46.19 43.78 1qni s LEU 368 CO -0.07 0.04 1.79 -1.81 -0.29 0.00 0.00 176.35 176.01 1qni s ASP 369 N 1.15 6.41 -0.03 3.68 1.01 -1.26 -1.63 116.67 125.99 1qni s ASP 369 Ca 0.02 2.80 0.01 0.00 0.71 0.00 0.00 52.55 56.09 1qni s ASP 369 Cb -0.15 -2.58 -0.03 0.00 1.01 0.00 0.00 42.92 41.17 1qni s ASP 369 CO -0.00 -0.99 -0.03 -0.69 0.21 0.00 0.00 175.17 173.66 1qni s VAL 370 N 2.19 3.98 -1.09 -1.27 1.01 -0.15 -4.90 120.40 120.17 1qni s VAL 370 Ca 0.79 -0.54 -0.22 0.00 0.00 0.00 0.00 61.98 62.01 1qni s VAL 370 Cb -0.47 -2.71 0.02 0.00 0.00 0.00 0.00 36.38 33.21 1qni s VAL 370 CO 0.35 0.48 1.68 -1.10 0.00 0.00 0.00 175.10 176.50 1qni s GLN 371 N -1.23 3.36 -0.06 2.72 1.11 -1.26 -4.54 119.66 119.76 1qni s GLN 371 Ca 0.16 -1.18 -0.04 0.00 0.01 0.00 0.00 55.36 54.30 1qni s GLN 371 Cb -0.11 -5.33 0.02 0.00 -1.01 0.00 0.00 33.01 26.57 1qni s GLN 371 CO 0.06 -2.66 0.09 0.66 0.01 0.00 0.00 175.29 173.44 1qni n TYR 372 N 10.42 -1.79 -3.15 0.91 4.01 -1.26 -4.64 117.16 121.65 1qni n TYR 372 Ca 0.40 1.05 -0.19 0.00 -0.16 0.00 0.00 57.90 58.99 1qni n TYR 372 Cb 0.48 -2.49 0.02 0.00 -0.31 0.00 0.00 39.34 37.04 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 0.68 -2.06 -2.29 -0.72 3.00 -1.26 -2.68 117.38 112.04 1qni n GLN 373 Ca -0.15 1.74 -0.41 0.00 -0.01 0.00 0.00 57.00 58.18 1qni n GLN 373 Cb 0.23 -3.56 -0.03 0.00 0.00 0.00 0.00 30.24 26.88 1qni n GLN 373 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.06 175.81 1qni s PRO 374 N -2.24 4.47 0.00 -1.09 0.04 -1.26 -0.90 135.00 134.02 1qni s PRO 374 Ca 0.25 2.00 0.00 0.00 0.04 0.00 0.00 61.00 63.29 1qni s PRO 374 Cb -0.04 -3.16 0.00 0.00 0.04 0.00 0.00 34.50 31.34 1qni s PRO 374 CO 0.72 -0.07 0.00 0.41 0.04 0.00 0.00 177.00 178.10 1qni n GLY 375 N 1.50 0.20 3.82 0.56 0.00 -0.26 -4.10 105.19 106.91 1qni n GLY 375 Ca 0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.73 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 1.41 3.05 0.07 1.61 3.76 -1.25 -4.26 115.29 119.69 1qni s HIS 376 Ca 0.00 1.40 0.06 0.00 -0.15 0.00 0.00 55.06 56.37 1qni s HIS 376 Cb 0.00 -2.91 -0.03 0.00 1.11 0.00 0.00 32.58 30.75 1qni s HIS 376 CO 0.00 -1.32 -0.15 1.21 -0.85 0.00 0.00 174.74 173.63 1qni s ASN 377 N -3.78 1.82 -0.29 1.40 2.47 -1.26 -2.09 114.94 113.21 1qni s ASN 377 Ca 0.58 -0.60 -0.12 0.00 0.42 0.00 0.00 52.86 53.15 1qni s ASN 377 Cb -0.14 -0.07 0.11 0.00 -1.45 0.00 0.00 41.25 39.70 1qni s ASN 377 CO 0.55 -0.04 0.65 -2.28 -3.72 0.00 0.00 177.10 172.26 1qni s HIS 378 N -1.19 -1.23 -0.10 0.43 2.46 -0.36 -4.79 115.29 110.51 1qni s HIS 378 Ca -0.00 2.23 -0.02 0.00 0.47 0.00 0.00 55.06 57.74 1qni s HIS 378 Cb -0.10 0.73 -0.03 0.00 -0.13 0.00 0.00 32.58 33.05 1qni s HIS 378 CO 0.02 -0.61 -0.00 0.00 -2.47 0.00 0.00 174.74 171.68 1qni s ALA 379 N 2.47 3.24 -0.30 1.58 0.00 -1.26 0.39 121.76 127.88 1qni s ALA 379 Ca -0.07 -0.81 -0.40 0.00 0.00 0.00 0.00 51.96 50.68 1qni s ALA 379 Cb -0.10 -1.51 -0.15 0.00 0.00 0.00 0.00 23.12 21.36 1qni s ALA 379 CO -0.19 0.50 1.81 -1.13 0.00 0.00 0.00 175.76 176.75 1qni n SER 380 N 2.47 2.32 -0.25 0.00 3.41 0.17 -0.95 113.62 120.79 1qni n SER 380 Ca -0.18 0.99 -0.03 0.00 -0.26 0.00 0.00 58.87 59.39 1qni n SER 380 Cb 0.53 -1.15 -0.01 0.00 -0.26 0.00 0.00 64.21 63.32 1qni n SER 380 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1qni n LEU 381 N 5.97 0.10 -0.05 1.04 4.77 -1.26 -3.02 117.00 124.55 1qni n LEU 381 Ca 0.29 0.08 0.18 0.00 -0.03 0.00 0.00 56.01 56.53 1qni n LEU 381 Cb 0.13 -1.54 0.62 0.00 -2.33 0.00 0.00 43.42 40.31 1qni n LEU 381 CO 0.81 -0.50 1.19 0.00 -1.33 0.00 0.00 177.39 177.55 1qni h THR 382 N 0.00 0.77 0.00 -5.08 1.03 -1.30 -1.25 112.91 107.07 1qni h THR 382 Ca -0.07 -0.05 0.00 0.00 -0.01 0.00 0.00 66.41 66.28 1qni h THR 382 Cb 0.55 0.60 0.00 0.00 -1.07 0.00 0.00 68.15 68.23 1qni h THR 382 CO 0.10 0.03 0.00 -0.62 -0.01 0.00 0.00 175.52 175.02 1qni n GLU 383 N -4.41 0.97 -4.56 0.00 1.02 -1.26 -4.34 120.64 108.06 1qni n GLU 383 Ca 0.11 0.00 -0.26 0.00 -0.02 0.00 0.00 57.16 56.99 1qni n GLU 383 Cb 0.56 -1.38 -0.10 0.00 -0.02 0.00 0.00 31.44 30.50 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 -1.77 3.19 0.52 1.62 1.04 -0.48 -4.93 113.70 112.88 1qni s SER 384 Ca 0.36 -1.44 0.26 0.00 0.48 0.00 0.00 55.95 55.61 1qni s SER 384 Cb 0.16 -0.07 1.43 0.00 0.10 0.00 0.00 66.02 67.64 1qni s SER 384 CO 0.27 -0.61 2.08 0.03 0.98 0.00 0.00 173.24 175.99 1qni h ARG 385 N 1.86 0.00 -0.92 4.02 3.08 -1.31 -3.00 114.38 118.10 1qni h ARG 385 Ca -0.42 0.00 -0.09 0.00 0.07 0.00 0.00 59.98 59.54 1qni h ARG 385 Cb 1.25 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 31.25 1qni h ARG 385 CO 0.73 0.12 0.12 -0.25 -1.07 0.00 0.00 179.97 179.62 1qni n ASP 386 N -3.73 3.00 -4.49 7.04 8.00 -1.26 -4.93 116.55 120.17 1qni n ASP 386 Ca -0.02 -2.46 -0.45 0.00 0.71 0.00 0.00 54.79 52.57 1qni n ASP 386 Cb 0.23 -0.60 -0.07 0.00 -0.02 0.00 0.00 41.12 40.66 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 0.07 0.96 1.00 2.24 0.00 -1.14 -4.80 120.51 118.85 1qni n ALA 387 Ca 0.16 -0.32 0.13 0.00 0.00 0.00 0.00 53.44 53.41 1qni n ALA 387 Cb 0.76 -2.70 0.50 0.00 0.00 0.00 0.00 19.45 18.01 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 11.61 0.17 -3.86 0.00 5.68 -1.17 -4.31 116.55 124.67 1qni n ASP 388 Ca 0.43 0.24 -0.28 0.00 -0.50 0.00 0.00 54.79 54.68 1qni n ASP 388 Cb 0.30 -0.25 0.03 0.00 -1.14 0.00 0.00 41.12 40.06 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 -0.45 0.19 6.12 0.00 -1.08 -4.91 105.19 106.56 1qni n GLY 389 Ca 0.07 0.18 -0.24 0.00 0.00 0.00 0.00 46.02 46.02 1qni n GLY 389 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1qni n LYS 390 N -4.60 0.55 -4.89 1.61 4.01 -1.26 -3.38 118.16 110.20 1qni n LYS 390 Ca -0.04 0.21 -0.30 0.00 -0.51 0.00 0.00 58.31 57.67 1qni n LYS 390 Cb 0.56 -1.42 -0.15 0.00 -0.51 0.00 0.00 35.03 33.51 1qni n LYS 390 CO 0.00 0.00 0.00 -1.58 -1.11 0.00 0.00 177.40 174.71 1qni s TRP 391 N -2.47 2.28 -0.08 2.13 0.52 -1.26 -2.21 118.94 117.86 1qni s TRP 391 Ca -0.35 -0.41 0.02 0.00 0.02 0.00 0.00 56.10 55.38 1qni s TRP 391 Cb 0.12 -1.37 0.01 0.00 -1.15 0.00 0.00 33.47 31.09 1qni s TRP 391 CO 0.48 0.12 -0.13 -1.17 0.02 0.00 0.00 176.95 176.27 1qni s LEU 392 N -1.23 1.65 -0.13 2.99 2.96 0.12 -0.66 118.68 124.38 1qni s LEU 392 Ca 0.11 -0.34 0.00 0.00 -0.22 0.00 0.00 54.13 53.69 1qni s LEU 392 Cb -0.10 -0.91 -0.01 0.00 0.50 0.00 0.00 46.19 45.67 1qni s LEU 392 CO 0.02 0.03 -0.14 -0.69 -1.32 0.00 0.00 176.35 174.25 1qni s VAL 393 N 0.78 2.95 -0.20 1.68 1.01 0.16 0.27 120.40 127.05 1qni s VAL 393 Ca -0.12 -0.70 -0.01 0.00 0.00 0.00 0.00 61.98 61.15 1qni s VAL 393 Cb -0.16 -2.23 0.01 0.00 0.00 0.00 0.00 36.38 34.00 1qni s VAL 393 CO 0.02 0.53 -0.13 -0.69 0.00 0.00 0.00 175.10 174.83 1qni s VAL 394 N 0.38 2.59 -0.65 2.92 1.01 -0.69 -1.22 120.40 124.75 1qni s VAL 394 Ca -0.11 -0.80 -0.14 0.00 0.00 0.00 0.00 61.98 60.93 1qni s VAL 394 Cb -0.16 -2.15 0.16 0.00 0.00 0.00 0.00 36.38 34.23 1qni s VAL 394 CO 0.06 0.46 0.58 -0.76 0.00 0.00 0.00 175.10 175.44 1qni s LEU 395 N 1.36 6.32 0.53 3.92 1.02 -0.89 -0.77 118.68 130.16 1qni s LEU 395 Ca 0.05 -2.19 -0.12 0.00 0.02 0.00 0.00 54.13 51.89 1qni s LEU 395 Cb -0.14 -2.18 -0.06 0.00 0.02 0.00 0.00 46.19 43.84 1qni s LEU 395 CO -0.09 -0.72 0.94 -0.44 0.02 0.00 0.00 176.35 176.07 1qni s SER 396 N 2.85 6.43 0.03 2.29 0.01 -0.30 -1.10 113.70 123.90 1qni s SER 396 Ca 0.09 1.37 0.23 0.00 1.31 0.00 0.00 55.95 58.95 1qni s SER 396 Cb -0.22 -2.43 0.09 0.00 0.21 0.00 0.00 66.02 63.67 1qni s SER 396 CO -0.02 -0.65 1.08 0.29 0.41 0.00 0.00 173.24 174.35 1qni n LYS 397 N -2.00 0.17 -4.43 12.44 4.76 -0.08 -3.13 118.16 125.90 1qni n LYS 397 Ca 0.05 -0.01 -0.22 0.00 -2.87 0.00 0.00 58.31 55.27 1qni n LYS 397 Cb 0.54 -1.55 -0.13 0.00 -1.84 0.00 0.00 35.03 32.04 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 -3.12 1.40 -0.00 2.13 0.08 -1.09 -4.83 117.98 112.55 1qni s PHE 398 Ca 0.06 -0.36 0.03 0.00 0.12 0.00 0.00 56.93 56.77 1qni s PHE 398 Cb 0.15 -0.83 -0.04 0.00 -0.57 0.00 0.00 43.02 41.73 1qni s PHE 398 CO 0.79 0.06 0.06 -1.13 -0.10 0.00 0.00 175.22 174.90 1qni n SER 399 N 1.86 4.39 0.00 1.36 3.41 -1.25 -4.40 113.62 118.99 1qni n SER 399 Ca -0.18 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.43 1qni n SER 399 Cb 0.54 1.12 0.00 0.00 -0.26 0.00 0.00 64.21 65.61 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 -1.60 0.00 -0.05 4.33 5.02 -1.26 -0.35 118.16 124.26 1qni n LYS 400 Ca -0.01 0.00 0.12 0.00 -2.02 0.00 0.00 58.31 56.41 1qni n LYS 400 Cb 0.07 0.00 0.25 0.00 -0.02 0.00 0.00 35.03 35.33 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 3.88 2.60 0.01 4.39 5.75 -1.26 -4.53 116.55 127.40 1qni n ASP 401 Ca 0.00 -1.85 0.08 0.00 -0.01 0.00 0.00 54.79 53.01 1qni n ASP 401 Cb 0.00 -0.06 0.50 0.00 -1.03 0.00 0.00 41.12 40.53 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 3.85 0.37 -5.07 0.11 2.47 -1.11 -3.45 114.38 111.56 1qni h ARG 402 Ca 0.00 -0.02 -0.57 0.00 -1.26 0.00 0.00 59.98 58.12 1qni h ARG 402 Cb 0.83 -0.08 -0.13 0.00 -1.65 0.00 0.00 29.97 28.93 1qni h ARG 402 CO 0.00 0.25 -0.52 -0.06 0.56 0.00 0.00 179.97 180.20 1qni s PHE 403 N -5.36 1.80 0.50 3.04 0.08 -1.26 -5.12 117.98 111.65 1qni s PHE 403 Ca -0.07 -1.24 -0.23 0.00 0.12 0.00 0.00 56.93 55.51 1qni s PHE 403 Cb 0.18 -1.22 -0.06 0.00 -0.57 0.00 0.00 43.02 41.35 1qni s PHE 403 CO 0.73 -0.23 1.35 -0.51 -0.10 0.00 0.00 175.22 176.46 1qni s LEU 404 N -3.64 3.98 0.32 -0.37 1.43 -1.26 -4.93 118.68 114.20 1qni s LEU 404 Ca 0.22 2.74 -0.29 0.00 -1.03 0.00 0.00 54.13 55.77 1qni s LEU 404 Cb 0.03 -4.14 -0.10 0.00 0.03 0.00 0.00 46.19 42.00 1qni s LEU 404 CO 0.13 -1.32 1.35 -2.16 0.23 0.00 0.00 176.35 174.58 1qni s PRO 405 N -2.69 4.32 -0.02 1.29 0.04 -1.26 -4.90 135.00 131.77 1qni s PRO 405 Ca 0.66 2.26 0.16 0.00 0.04 0.00 0.00 61.00 64.12 1qni s PRO 405 Cb -0.40 -3.07 0.28 0.00 0.04 0.00 0.00 34.50 31.35 1qni s PRO 405 CO 0.49 -0.26 1.11 1.33 0.04 0.00 0.00 177.00 179.71 1qni n VAL 406 N 1.06 0.24 0.00 -0.36 0.24 -1.26 -5.14 118.33 113.11 1qni n VAL 406 Ca 0.01 -0.88 0.00 0.00 -2.04 0.00 0.00 64.34 61.44 1qni n VAL 406 Cb 0.41 0.69 0.00 0.00 -1.47 0.00 0.00 33.84 33.47 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 0.13 0.84 0.41 7.63 0.00 -1.26 -4.69 105.19 108.25 1qni n GLY 407 Ca 0.05 -2.18 0.21 0.00 0.00 0.00 0.00 46.02 44.10 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 0.38 -5.70 1.61 0.11 -2.04 -3.37 132.00 122.99 1qni h PRO 408 Ca 0.00 -0.02 -0.61 0.00 0.11 0.00 0.00 66.00 65.48 1qni h PRO 408 Cb 0.00 -0.09 -0.10 0.00 0.11 0.00 0.00 31.00 30.92 1qni h PRO 408 CO 0.00 0.25 0.34 -1.17 -0.21 0.00 0.00 178.00 177.21 1qni s LEU 409 N -9.45 4.09 0.13 2.35 0.20 -1.26 -5.05 118.68 109.70 1qni s LEU 409 Ca -0.08 0.68 0.04 0.00 0.69 0.00 0.00 54.13 55.46 1qni s LEU 409 Cb 0.23 -3.02 -0.04 0.00 -0.43 0.00 0.00 46.19 42.93 1qni s LEU 409 CO 0.79 -0.55 0.15 -1.00 -0.29 0.00 0.00 176.35 175.45 1qni s HIS 410 N 2.82 3.23 0.82 5.38 3.76 -1.26 -4.73 115.29 125.31 1qni s HIS 410 Ca 0.31 0.04 -0.12 0.00 -0.15 0.00 0.00 55.06 55.14 1qni s HIS 410 Cb -0.15 -1.58 0.08 0.00 1.11 0.00 0.00 32.58 32.05 1qni s HIS 410 CO 0.11 0.52 1.15 -1.25 -0.85 0.00 0.00 174.74 174.43 1qni s PRO 411 N -2.91 1.92 0.78 8.40 0.04 -1.26 -4.93 135.00 137.05 1qni s PRO 411 Ca 0.31 0.23 -0.07 0.00 0.04 0.00 0.00 61.00 61.51 1qni s PRO 411 Cb -0.11 -1.93 0.12 0.00 0.04 0.00 0.00 34.50 32.62 1qni s PRO 411 CO 0.24 -1.65 1.10 -1.21 0.04 0.00 0.00 177.00 175.52 1qni s GLU 412 N -5.46 1.56 -0.24 4.56 0.41 0.25 -3.74 118.70 116.03 1qni s GLU 412 Ca 0.62 -0.60 -0.03 0.00 -0.41 0.00 0.00 54.97 54.55 1qni s GLU 412 Cb -0.12 -2.13 0.08 0.00 -1.78 0.00 0.00 34.13 30.18 1qni s GLU 412 CO 0.51 -1.66 0.08 1.21 -0.49 0.00 0.00 175.26 174.91 1qni s ASN 413 N -4.70 3.32 -0.31 -0.19 2.47 -1.18 -1.93 114.94 112.40 1qni s ASN 413 Ca 0.66 -1.13 -0.11 0.00 0.42 0.00 0.00 52.86 52.70 1qni s ASN 413 Cb -0.07 -0.60 -0.02 0.00 -1.45 0.00 0.00 41.25 39.12 1qni s ASN 413 CO 0.47 -0.37 0.19 -1.81 -3.72 0.00 0.00 177.10 171.86 1qni s ASP 414 N 1.86 5.79 -0.11 -4.21 1.01 -0.07 -1.16 116.67 119.79 1qni s ASP 414 Ca 0.04 -0.40 -0.05 0.00 0.71 0.00 0.00 52.55 52.86 1qni s ASP 414 Cb -0.17 -2.07 -0.04 0.00 1.01 0.00 0.00 42.92 41.66 1qni s ASP 414 CO -0.19 -0.18 0.08 -1.10 0.21 0.00 0.00 175.17 173.99 1qni s GLN 415 N 1.68 3.26 -0.17 8.23 -0.21 0.05 0.04 119.66 132.53 1qni s GLN 415 Ca 0.06 -0.25 -0.15 0.00 0.02 0.00 0.00 55.36 55.03 1qni s GLN 415 Cb -0.17 -3.02 -0.04 0.00 1.00 0.00 0.00 33.01 30.78 1qni s GLN 415 CO 0.08 0.73 0.36 -1.17 -2.12 0.00 0.00 175.29 173.18 1qni s LEU 416 N -0.92 4.21 -0.10 2.90 2.96 0.33 -1.70 118.68 126.36 1qni s LEU 416 Ca 0.14 0.55 0.03 0.00 -0.22 0.00 0.00 54.13 54.63 1qni s LEU 416 Cb -0.12 -2.48 0.01 0.00 0.50 0.00 0.00 46.19 44.10 1qni s LEU 416 CO 0.03 0.01 -0.19 -0.63 -1.32 0.00 0.00 176.35 174.25 1qni s ILE 417 N 0.87 1.75 -0.26 6.68 1.01 0.14 -1.03 121.20 130.36 1qni s ILE 417 Ca 0.19 -0.82 -0.29 0.00 0.00 0.00 0.00 60.65 59.73 1qni s ILE 417 Cb -0.14 -1.55 0.01 0.00 0.01 0.00 0.00 42.46 40.78 1qni s ILE 417 CO 0.07 0.49 1.16 -0.62 0.00 0.00 0.00 174.94 176.04 1qni s ASP 418 N 0.66 6.91 -0.08 3.58 -1.08 -0.30 -0.70 116.67 125.65 1qni s ASP 418 Ca -0.13 1.29 0.11 0.00 -0.52 0.00 0.00 52.55 53.30 1qni s ASP 418 Cb -0.16 -2.54 0.19 0.00 -1.46 0.00 0.00 42.92 38.95 1qni s ASP 418 CO 0.03 -0.86 1.11 2.30 0.52 0.00 0.00 175.17 178.27 1qni n ILE 419 N 5.74 1.53 0.23 4.11 -5.35 -0.94 -2.10 119.36 122.58 1qni n ILE 419 Ca 0.13 -1.70 0.09 0.00 -0.27 0.00 0.00 62.75 61.00 1qni n ILE 419 Cb 0.46 0.08 0.58 0.00 -1.74 0.00 0.00 39.64 39.02 1qni n ILE 419 CO 0.00 0.00 0.00 0.77 -1.76 0.00 0.00 176.55 175.56 1qni h SER 420 N 0.17 0.00 -3.65 7.28 4.64 -1.55 -3.44 113.55 117.01 1qni h SER 420 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1qni h SER 420 Cb 0.82 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.91 1qni h SER 420 CO 0.01 0.20 0.00 0.61 -0.87 0.00 0.00 176.83 176.79 1qni n GLY 421 N -0.52 2.38 0.20 -0.77 0.00 -1.26 -4.99 105.19 100.22 1qni n GLY 421 Ca -0.02 -2.13 0.09 0.00 0.00 0.00 0.00 46.02 43.96 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 -5.76 1.61 4.81 -1.97 -3.44 114.58 109.83 1qni h GLU 422 Ca 0.00 0.00 -0.67 0.00 -0.13 0.00 0.00 59.36 58.56 1qni h GLU 422 Cb 0.00 0.00 -0.21 0.00 0.63 0.00 0.00 28.75 29.17 1qni h GLU 422 CO 0.00 0.20 -0.70 -2.00 -0.73 0.00 0.00 179.01 175.78 1qni s GLU 423 N -3.26 3.12 0.12 1.92 2.12 -1.26 -5.02 118.70 116.44 1qni s GLU 423 Ca 0.04 -0.57 -0.30 0.00 0.36 0.00 0.00 54.97 54.50 1qni s GLU 423 Cb 0.07 -2.68 -0.06 0.00 0.26 0.00 0.00 34.13 31.72 1qni s GLU 423 CO 0.67 0.46 1.02 -1.64 -0.54 0.00 0.00 175.26 175.24 1qni s MET 424 N -0.26 4.64 -0.09 4.30 -1.94 -1.26 -4.75 119.30 119.93 1qni s MET 424 Ca 0.03 1.56 -0.01 0.00 -1.71 0.00 0.00 55.69 55.56 1qni s MET 424 Cb -0.13 -3.35 0.03 0.00 2.01 0.00 0.00 34.83 33.39 1qni s MET 424 CO 0.03 0.12 -0.02 0.15 -0.01 0.00 0.00 175.02 175.28 1qni s LYS 425 N 0.03 0.92 0.26 2.03 1.02 -0.89 -4.97 119.74 118.14 1qni s LYS 425 Ca 0.49 -0.05 -0.30 0.00 0.02 0.00 0.00 55.97 56.13 1qni s LYS 425 Cb -0.26 -1.25 -0.11 0.00 -0.52 0.00 0.00 37.83 35.70 1qni s LYS 425 CO 0.31 -0.31 1.59 -1.17 -0.92 0.00 0.00 175.35 174.85 1qni s LEU 426 N 1.88 4.36 0.00 3.17 2.96 -1.26 -1.15 118.68 128.63 1qni s LEU 426 Ca 0.05 2.86 0.00 0.00 -0.22 0.00 0.00 54.13 56.82 1qni s LEU 426 Cb -0.13 -3.62 0.00 0.00 0.50 0.00 0.00 46.19 42.94 1qni s LEU 426 CO -0.06 -0.89 0.00 0.52 -1.32 0.00 0.00 176.35 174.60 1qni n VAL 427 N 2.69 0.00 -3.73 1.68 0.31 -0.20 -4.89 118.33 114.19 1qni n VAL 427 Ca 0.10 0.00 -0.13 0.00 -0.01 0.00 0.00 64.34 64.30 1qni n VAL 427 Cb 0.37 -0.65 -0.10 0.00 -0.91 0.00 0.00 33.84 32.55 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 -1.91 -0.45 -0.38 3.52 5.65 -1.12 -4.98 115.29 115.62 1qni s HIS 428 Ca 0.00 1.09 -0.13 0.00 0.25 0.00 0.00 55.06 56.27 1qni s HIS 428 Cb 0.00 0.15 0.02 0.00 -1.18 0.00 0.00 32.58 31.57 1qni s HIS 428 CO 0.00 -0.22 0.24 -0.51 -0.65 0.00 0.00 174.74 173.61 1qni s ASP 429 N 0.23 5.91 -0.41 9.88 1.11 -1.26 -0.51 116.67 131.62 1qni s ASP 429 Ca -0.00 -0.83 -0.12 0.00 0.18 0.00 0.00 52.55 51.78 1qni s ASP 429 Cb -0.03 -2.09 0.05 0.00 1.07 0.00 0.00 42.92 41.92 1qni s ASP 429 CO 0.00 -0.37 0.27 -0.83 1.18 0.00 0.00 175.17 175.42 1qni s GLY 430 N 1.63 1.97 0.23 0.21 0.00 0.11 -4.96 107.32 106.52 1qni s GLY 430 Ca 0.04 -1.90 -0.30 0.00 0.00 0.00 0.00 44.72 42.56 1qni s GLY 430 CO 0.08 0.92 1.29 2.56 0.00 0.00 0.00 173.10 177.96 1qni s PRO 431 N 1.55 4.40 0.01 2.90 0.04 -1.26 -0.89 135.00 141.76 1qni s PRO 431 Ca 0.03 2.07 -0.02 0.00 0.04 0.00 0.00 61.00 63.12 1qni s PRO 431 Cb -0.21 -3.17 -0.01 0.00 0.04 0.00 0.00 34.50 31.15 1qni s PRO 431 CO 0.06 -0.20 0.02 0.99 0.04 0.00 0.00 177.00 177.91 1qni s THR 432 N -0.25 0.08 0.52 1.26 2.01 -0.81 -4.93 115.64 113.51 1qni s THR 432 Ca 0.54 -0.68 -0.00 0.00 0.31 0.00 0.00 61.69 61.86 1qni s THR 432 Cb -0.37 -0.25 0.02 0.00 0.01 0.00 0.00 72.50 71.90 1qni s THR 432 CO 0.41 -0.37 0.75 -0.47 -0.69 0.00 0.00 174.62 174.26 1qni s TYR 433 N -1.14 3.07 -0.43 4.92 5.04 -1.26 0.85 117.35 128.41 1qni s TYR 433 Ca -0.12 0.20 -0.01 0.00 -2.44 0.00 0.00 57.07 54.69 1qni s TYR 433 Cb -0.08 -2.57 0.00 0.00 0.35 0.00 0.00 41.96 39.66 1qni s TYR 433 CO -0.00 -0.66 0.32 0.00 -1.34 0.00 0.00 175.55 173.87 1qni n ALA 434 N -2.28 -1.95 -0.39 3.97 0.00 -1.26 -4.13 120.51 114.48 1qni n ALA 434 Ca 0.04 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.36 1qni n ALA 434 Cb 0.59 -0.42 0.00 0.00 0.00 0.00 0.00 19.45 19.62 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 -1.54 0.00 -2.61 0.00 2.13 -1.26 -4.09 120.64 113.28 1qni n GLU 435 Ca -0.17 0.00 -0.33 0.00 0.66 0.00 0.00 57.16 57.33 1qni n GLU 435 Cb 0.37 0.00 -0.05 0.00 0.27 0.00 0.00 31.44 32.03 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 4.08 0.00 5.31 0.04 -1.26 -3.15 135.00 140.01 1qni s PRO 436 Ca 0.00 1.05 0.00 0.00 0.04 0.00 0.00 61.00 62.09 1qni s PRO 436 Cb 0.00 -2.15 0.00 0.00 0.04 0.00 0.00 34.50 32.39 1qni s PRO 436 CO 0.00 -0.16 0.00 0.72 0.04 0.00 0.00 177.00 177.60 1qni n HIS 437 N -1.10 0.00 -3.51 0.56 8.25 -1.26 -4.92 115.22 113.24 1qni n HIS 437 Ca 0.07 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.33 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 -0.23 5.25 0.14 0.41 -1.08 -0.67 -4.20 116.67 116.29 1qni s ASP 438 Ca 0.00 -0.61 -0.13 0.00 -0.52 0.00 0.00 52.55 51.29 1qni s ASP 438 Cb 0.00 -0.70 0.01 0.00 -1.46 0.00 0.00 42.92 40.78 1qni s ASP 438 CO 0.00 -0.60 0.34 0.00 0.52 0.00 0.00 175.17 175.43 1qni s ILE 440 N -3.87 0.58 -0.02 0.00 2.07 -0.88 -4.92 121.20 114.18 1qni s ILE 440 Ca 0.08 -0.14 -0.09 0.00 -1.41 0.00 0.00 60.65 59.08 1qni s ILE 440 Cb 0.02 -0.61 -0.05 0.00 0.13 0.00 0.00 42.46 41.96 1qni s ILE 440 CO -0.08 0.24 0.29 -0.76 -1.91 0.00 0.00 174.94 172.72 1qni s LEU 441 N 0.96 4.40 0.01 8.50 1.43 -1.26 -1.42 118.68 131.29 1qni s LEU 441 Ca -0.10 0.66 -0.02 0.00 -1.03 0.00 0.00 54.13 53.64 1qni s LEU 441 Cb -0.14 -2.54 -0.01 0.00 0.03 0.00 0.00 46.19 43.53 1qni s LEU 441 CO 0.00 0.30 0.03 0.68 0.23 0.00 0.00 176.35 177.59 1qni s VAL 442 N -1.19 0.08 0.64 -1.59 -7.23 -0.58 -4.09 120.40 106.43 1qni s VAL 442 Ca 0.24 -0.64 -0.17 0.00 -1.81 0.00 0.00 61.98 59.60 1qni s VAL 442 Cb -0.14 -0.26 -0.01 0.00 0.56 0.00 0.00 36.38 36.53 1qni s VAL 442 CO 0.13 -0.35 1.18 -0.13 -0.31 0.00 0.00 175.10 175.62 1qni s ARG 443 N -1.08 2.77 0.44 4.82 0.52 -1.26 0.74 118.95 125.89 1qni s ARG 443 Ca -0.12 1.70 0.17 0.00 -0.52 0.00 0.00 55.73 56.96 1qni s ARG 443 Cb -0.07 -1.92 1.09 0.00 0.52 0.00 0.00 34.95 34.57 1qni s ARG 443 CO -0.00 -1.33 1.92 -0.09 0.02 0.00 0.00 175.30 175.81 1qni h ARG 444 N 0.45 0.37 -0.02 3.54 2.43 -1.67 -1.28 114.38 118.20 1qni h ARG 444 Ca -0.49 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.66 1qni h ARG 444 Cb 1.28 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.75 1qni h ARG 444 CO 0.54 0.24 0.00 -0.40 -1.51 0.00 0.00 179.97 178.84 1qni n ASP 445 N -4.47 1.06 -0.42 -3.80 5.68 -1.26 -3.69 116.55 109.65 1qni n ASP 445 Ca 0.15 -1.37 0.13 0.00 -0.50 0.00 0.00 54.79 53.20 1qni n ASP 445 Cb 0.56 -0.00 0.38 0.00 -1.14 0.00 0.00 41.12 40.92 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 -0.17 1.31 -5.00 0.11 6.02 -0.48 -4.82 117.38 114.36 1qni n GLN 446 Ca 0.20 -0.84 -0.32 0.00 -0.01 0.00 0.00 57.00 56.04 1qni n GLN 446 Cb 0.28 -1.48 -0.17 0.00 1.02 0.00 0.00 30.24 29.89 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 -2.27 2.01 -0.38 5.09 -1.09 -1.24 -3.62 121.20 119.71 1qni s ILE 447 Ca 0.29 -0.98 -0.02 0.00 -2.23 0.00 0.00 60.65 57.72 1qni s ILE 447 Cb 0.20 -1.76 0.10 0.00 -1.58 0.00 0.00 42.46 39.42 1qni s ILE 447 CO 0.44 0.55 0.15 -0.54 -1.23 0.00 0.00 174.94 174.30 1qni s LYS 448 N 0.53 2.01 0.09 2.79 1.02 -1.26 -5.03 119.74 119.88 1qni s LYS 448 Ca -0.15 -1.73 -0.13 0.00 0.02 0.00 0.00 55.97 53.99 1qni s LYS 448 Cb -0.17 -3.46 -0.06 0.00 -0.52 0.00 0.00 37.83 33.62 1qni s LYS 448 CO 0.05 -0.97 0.47 0.99 -0.92 0.00 0.00 175.35 174.96 1qni s THR 449 N 1.13 4.97 0.21 2.17 2.01 -1.26 -4.37 115.64 120.50 1qni s THR 449 Ca 0.06 0.70 -0.05 0.00 0.31 0.00 0.00 61.69 62.72 1qni s THR 449 Cb -0.22 -3.70 -0.05 0.00 0.01 0.00 0.00 72.50 68.53 1qni s THR 449 CO -0.04 0.34 0.45 -0.54 -0.69 0.00 0.00 174.62 174.14 1qni s LYS 450 N -1.74 3.63 -0.12 4.92 1.02 -0.04 -5.03 119.74 122.39 1qni s LYS 450 Ca 0.33 -0.05 0.15 0.00 0.02 0.00 0.00 55.97 56.41 1qni s LYS 450 Cb -0.15 -2.76 -0.21 0.00 -0.52 0.00 0.00 37.83 34.19 1qni s LYS 450 CO 0.18 0.36 0.13 1.17 -0.92 0.00 0.00 175.35 176.27 1qni n LYS 451 N -0.37 1.21 -4.14 1.68 3.00 -1.26 -4.86 118.16 113.42 1qni n LYS 451 Ca -0.02 -0.04 -0.09 0.00 -0.00 0.00 0.00 58.31 58.15 1qni n LYS 451 Cb 0.53 -1.40 -0.10 0.00 0.00 0.00 0.00 35.03 34.06 1qni n LYS 451 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.40 178.36 1qni s ILE 452 N -2.58 0.53 0.53 3.15 -4.36 -1.26 -4.72 121.20 112.49 1qni s ILE 452 Ca -0.07 -1.87 -0.09 0.00 -0.26 0.00 0.00 60.65 58.36 1qni s ILE 452 Cb 0.06 -1.60 -0.04 0.00 1.25 0.00 0.00 42.46 42.13 1qni s ILE 452 CO 0.65 -0.90 0.89 -0.31 0.24 0.00 0.00 174.94 175.51 1qni s TYR 453 N -3.66 3.57 -0.14 1.37 1.51 -0.89 -5.06 117.35 114.05 1qni s TYR 453 Ca 0.10 1.06 -0.07 0.00 -1.01 0.00 0.00 57.07 57.15 1qni s TYR 453 Cb 0.06 -2.51 -0.04 0.00 -0.11 0.00 0.00 41.96 39.36 1qni s TYR 453 CO -0.06 -0.43 0.12 -1.21 -1.11 0.00 0.00 175.55 172.86 1qni s GLU 454 N -4.78 3.62 0.00 -0.62 0.41 -1.26 -4.78 118.70 111.30 1qni s GLU 454 Ca 0.51 -0.20 0.03 0.00 -0.41 0.00 0.00 54.97 54.91 1qni s GLU 454 Cb -0.11 -3.21 0.16 0.00 -1.78 0.00 0.00 34.13 29.20 1qni s GLU 454 CO 0.46 0.61 0.83 0.54 -0.49 0.00 0.00 175.26 177.21 1qni n ARG 455 N 2.50 0.06 -0.19 1.61 5.12 -1.26 -0.73 116.66 123.77 1qni n ARG 455 Ca -0.19 0.17 0.05 0.00 -1.93 0.00 0.00 57.85 55.96 1qni n ARG 455 Cb 0.54 -1.50 0.15 0.00 -1.16 0.00 0.00 32.46 30.49 1qni n ARG 455 CO 0.00 0.00 0.00 0.27 -1.93 0.00 0.00 177.63 175.97 1qni n ASN 456 N -1.19 2.95 -4.74 0.55 2.04 -1.26 -5.03 115.26 108.57 1qni n ASN 456 Ca 0.02 -2.12 -0.42 0.00 -0.44 0.00 0.00 54.58 51.62 1qni n ASN 456 Cb 0.02 -0.25 -0.02 0.00 -2.53 0.00 0.00 39.78 37.00 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 -1.12 6.35 0.55 0.53 -1.08 0.09 -4.90 116.67 117.09 1qni s ASP 457 Ca 0.23 2.96 0.37 0.00 -0.52 0.00 0.00 52.55 55.59 1qni s ASP 457 Cb 0.14 -2.63 1.91 0.00 -1.46 0.00 0.00 42.92 40.88 1qni s ASP 457 CO 0.14 -0.95 2.12 -0.65 0.52 0.00 0.00 175.17 176.35 1qni h PRO 458 N 5.29 0.00 0.00 4.34 0.11 -1.96 -2.96 132.00 136.83 1qni h PRO 458 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 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 0.83 0.00 0.00 0.98 -0.21 0.00 0.00 178.00 179.60 1qni n TYR 459 N -2.86 0.46 -2.71 0.65 9.36 -1.26 -2.93 117.16 117.87 1qni n TYR 459 Ca -0.02 0.20 -0.00 0.00 3.32 0.00 0.00 57.90 61.40 1qni n TYR 459 Cb 0.11 -0.82 0.06 0.00 -0.63 0.00 0.00 39.34 38.06 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 -1.94 0.25 -0.05 2.98 1.16 -1.12 -4.90 117.46 113.84 1qni n PHE 460 Ca 0.01 -1.74 -0.15 0.00 -1.87 0.00 0.00 57.45 53.71 1qni n PHE 460 Cb 0.13 0.24 -0.04 0.00 -1.61 0.00 0.00 39.48 38.21 1qni n PHE 460 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1qni h ALA 461 N 1.88 0.45 0.00 1.98 0.00 -1.60 -2.95 119.26 119.03 1qni h ALA 461 Ca -0.25 -0.54 -0.02 0.00 0.00 0.00 0.00 54.91 54.11 1qni h ALA 461 Cb 1.37 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 19.09 1qni h ALA 461 CO 0.06 0.69 -0.08 0.66 0.00 0.00 0.00 179.25 180.58 1qni h SER 462 N 0.61 0.00 0.45 0.00 4.64 -1.91 -0.99 113.55 116.36 1qni h SER 462 Ca -0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.29 1qni h SER 462 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 1qni h SER 462 CO 0.13 0.08 -0.22 0.00 -0.87 0.00 0.00 176.83 175.95 1qni h ARG 464 N -1.04 0.00 -0.10 0.00 0.11 -1.40 0.16 114.38 112.11 1qni h ARG 464 Ca -0.06 0.00 -0.18 0.00 0.10 0.00 0.00 59.98 59.84 1qni h ARG 464 Cb 0.56 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.64 1qni h ARG 464 CO 0.10 0.02 -0.69 0.00 0.10 0.00 0.00 179.97 179.50 1qni h ALA 465 N 1.98 0.62 0.00 0.08 0.00 -1.10 0.62 119.26 121.45 1qni h ALA 465 Ca -0.00 -0.58 -0.16 0.00 0.00 0.00 0.00 54.91 54.17 1qni h ALA 465 Cb 0.10 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1qni h ALA 465 CO 0.00 0.74 -0.75 0.37 0.00 0.00 0.00 179.25 179.62 1qni h GLN 466 N 0.31 0.00 -0.35 0.00 5.75 -0.56 -2.98 115.11 117.28 1qni h GLN 466 Ca -0.02 0.00 -0.16 0.00 -0.15 0.00 0.00 58.65 58.32 1qni h GLN 466 Cb 1.26 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 29.80 1qni h GLN 466 CO 0.12 0.75 -0.39 0.00 -2.65 0.00 0.00 178.83 176.65 1qni h ALA 467 N 1.25 0.52 -0.11 3.38 0.00 -0.51 -2.44 119.26 121.34 1qni h ALA 467 Ca -0.01 -0.46 0.02 0.00 0.00 0.00 0.00 54.91 54.46 1qni h ALA 467 Cb 1.54 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 19.21 1qni h ALA 467 CO 0.10 0.63 0.01 1.49 0.00 0.00 0.00 179.25 181.48 1qni h GLU 468 N 0.69 0.06 0.00 0.00 4.57 -0.86 0.16 114.58 119.20 1qni h GLU 468 Ca 0.05 -0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.21 1qni h GLU 468 Cb 0.99 -0.01 -0.00 0.00 -0.16 0.00 0.00 28.75 29.56 1qni h GLU 468 CO 0.10 0.04 -0.07 0.87 -1.18 0.00 0.00 179.01 178.77 1qni h LYS 469 N 0.06 0.00 -0.01 1.92 1.57 -1.46 0.41 116.57 119.06 1qni h LYS 469 Ca 0.05 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 1qni h LYS 469 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.36 1qni h LYS 469 CO -0.08 0.07 -0.31 -0.25 -0.57 0.00 0.00 179.45 178.32 1qni n ASP 470 N -3.86 1.34 -2.92 0.86 8.00 -0.67 -4.96 116.55 114.34 1qni n ASP 470 Ca -0.02 -1.10 -0.16 0.00 0.71 0.00 0.00 54.79 54.22 1qni n ASP 470 Cb 0.16 0.22 0.07 0.00 -0.02 0.00 0.00 41.12 41.55 1qni n ASP 470 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1qni n GLY 471 N 1.36 -0.20 3.37 0.44 0.00 0.36 -5.03 105.19 105.48 1qni n GLY 471 Ca 0.12 0.01 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 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 -3.27 2.18 -0.45 1.61 -7.23 0.01 -5.02 120.40 108.23 1qni s VAL 472 Ca 0.20 -1.63 -0.10 0.00 -1.81 0.00 0.00 61.98 58.64 1qni s VAL 472 Cb -0.09 -1.91 0.10 0.00 0.56 0.00 0.00 36.38 35.04 1qni s VAL 472 CO 0.57 0.16 0.32 -0.89 -0.31 0.00 0.00 175.10 174.96 1qni s THR 473 N -0.99 4.37 0.40 5.32 2.01 -1.26 -4.42 115.64 121.07 1qni s THR 473 Ca 0.13 -1.54 0.18 0.00 0.31 0.00 0.00 61.69 60.77 1qni s THR 473 Cb -0.10 -3.76 0.39 0.00 0.01 0.00 0.00 72.50 69.04 1qni s THR 473 CO 0.05 -0.65 1.80 -0.07 -0.69 0.00 0.00 174.62 175.05 1qni h LEU 474 N 8.49 0.44 -1.52 4.42 3.38 -1.95 0.30 115.31 128.87 1qni h LEU 474 Ca -0.23 0.07 -0.05 0.00 0.09 0.00 0.00 57.88 57.76 1qni h LEU 474 Cb 1.08 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.82 1qni h LEU 474 CO 0.83 0.12 -0.25 -0.33 0.09 0.00 0.00 178.44 178.90 1qni h GLU 475 N 0.41 0.00 0.00 1.13 3.07 -1.96 -3.39 114.58 113.84 1qni h GLU 475 Ca 0.56 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.42 1qni h GLU 475 Cb 1.40 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.31 1qni h GLU 475 CO -0.26 0.25 -0.44 -1.13 -1.40 0.00 0.00 179.01 176.03 1qni n SER 476 N -3.94 2.19 -4.76 1.42 3.41 -0.55 -4.98 113.62 106.41 1qni n SER 476 Ca -0.02 0.00 -0.33 0.00 -0.26 0.00 0.00 58.87 58.26 1qni n SER 476 Cb 0.33 0.35 0.06 0.00 -0.26 0.00 0.00 64.21 64.68 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 -1.29 4.91 -0.42 4.04 1.11 0.95 -4.97 116.67 120.99 1qni s ASP 477 Ca 0.00 2.05 0.08 0.00 0.18 0.00 0.00 52.55 54.85 1qni s ASP 477 Cb 0.00 -2.56 0.27 0.00 1.07 0.00 0.00 42.92 41.70 1qni s ASP 477 CO 0.00 -1.77 0.72 0.59 1.18 0.00 0.00 175.17 175.89 1qni n ASN 478 N -2.54 -0.93 -4.97 0.27 3.02 -1.25 -4.27 115.26 104.58 1qni n ASN 478 Ca 0.11 -3.02 -0.22 0.00 -0.03 0.00 0.00 54.58 51.42 1qni n ASN 478 Cb 0.52 0.37 0.03 0.00 -0.61 0.00 0.00 39.78 40.08 1qni n ASN 478 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1qni s LYS 479 N -0.63 2.33 -0.37 3.52 1.02 -0.98 -4.94 119.74 119.69 1qni s LYS 479 Ca 0.34 -1.76 0.02 0.00 0.02 0.00 0.00 55.97 54.58 1qni s LYS 479 Cb 0.22 -2.42 0.15 0.00 -0.52 0.00 0.00 37.83 35.26 1qni s LYS 479 CO -0.14 -0.69 0.31 0.08 -0.92 0.00 0.00 175.35 173.98 1qni s VAL 480 N -2.68 -0.06 0.02 3.17 1.01 -1.26 -1.33 120.40 119.27 1qni s VAL 480 Ca 0.50 -1.53 -0.26 0.00 0.00 0.00 0.00 61.98 60.69 1qni s VAL 480 Cb -0.04 -0.92 -0.05 0.00 0.00 0.00 0.00 36.38 35.37 1qni s VAL 480 CO 0.31 -0.84 0.80 -0.63 0.00 0.00 0.00 175.10 174.74 1qni s ILE 481 N 1.06 4.80 -0.14 2.22 1.01 -0.67 -4.95 121.20 124.54 1qni s ILE 481 Ca 0.20 1.69 -0.03 0.00 0.00 0.00 0.00 60.65 62.51 1qni s ILE 481 Cb -0.16 -4.15 -0.03 0.00 0.01 0.00 0.00 42.46 38.14 1qni s ILE 481 CO -0.03 0.31 -0.03 -0.13 0.00 0.00 0.00 174.94 175.05 1qni s ARG 482 N 0.28 3.47 -0.46 2.79 0.52 -1.26 -1.25 118.95 123.03 1qni s ARG 482 Ca 0.41 -0.50 0.07 0.00 -0.52 0.00 0.00 55.73 55.19 1qni s ARG 482 Cb -0.20 -2.86 0.24 0.00 0.52 0.00 0.00 34.95 32.65 1qni s ARG 482 CO 0.23 0.36 0.57 -3.47 0.02 0.00 0.00 175.30 173.01 1qni n ASP 483 N 3.18 1.16 0.00 0.23 -0.08 0.42 -5.02 116.55 116.45 1qni n ASP 483 Ca -0.18 -2.89 0.00 0.00 -1.51 0.00 0.00 54.79 50.21 1qni n ASP 483 Cb 0.53 -0.65 0.00 0.00 2.34 0.00 0.00 41.12 43.34 1qni n ASP 483 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1qni n GLY 484 N 1.33 2.46 0.02 0.27 0.00 -1.26 -2.04 105.19 105.98 1qni n GLY 484 Ca 0.24 -0.16 0.13 0.00 0.00 0.00 0.00 46.02 46.23 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 9.66 0.40 -4.87 1.61 3.02 -1.26 -4.84 115.26 118.98 1qni n ASN 485 Ca 0.00 0.15 -0.35 0.00 -0.03 0.00 0.00 54.58 54.36 1qni n ASN 485 Cb 0.00 -0.13 -0.05 0.00 -0.61 0.00 0.00 39.78 38.99 1qni n ASN 485 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1qni s LYS 486 N -3.04 3.69 -0.17 3.52 1.02 -0.87 -0.69 119.74 123.21 1qni s LYS 486 Ca 0.11 0.08 -0.04 0.00 0.02 0.00 0.00 55.97 56.14 1qni s LYS 486 Cb 0.17 -3.04 0.06 0.00 -0.52 0.00 0.00 37.83 34.50 1qni s LYS 486 CO 0.64 0.60 0.07 0.08 -0.92 0.00 0.00 175.35 175.81 1qni s VAL 487 N -1.35 0.13 -0.41 3.17 1.01 -0.85 -0.44 120.40 121.67 1qni s VAL 487 Ca 0.30 -0.26 -0.14 0.00 0.00 0.00 0.00 61.98 61.89 1qni s VAL 487 Cb -0.14 -0.71 0.03 0.00 0.00 0.00 0.00 36.38 35.56 1qni s VAL 487 CO 0.17 -0.22 0.28 -0.13 0.00 0.00 0.00 175.10 175.20 1qni s ARG 488 N 2.04 2.91 -0.22 2.72 0.52 -0.38 -0.61 118.95 125.94 1qni s ARG 488 Ca 0.01 -1.08 -0.13 0.00 -0.52 0.00 0.00 55.73 54.01 1qni s ARG 488 Cb -0.16 -3.92 -0.05 0.00 0.52 0.00 0.00 34.95 31.35 1qni s ARG 488 CO -0.08 -0.77 0.25 0.08 0.02 0.00 0.00 175.30 174.80 1qni s VAL 489 N 1.63 5.30 -0.24 3.52 1.01 -0.22 -1.67 120.40 129.74 1qni s VAL 489 Ca 0.04 0.40 -0.02 0.00 0.00 0.00 0.00 61.98 62.40 1qni s VAL 489 Cb -0.20 -3.59 0.01 0.00 0.00 0.00 0.00 36.38 32.61 1qni s VAL 489 CO 0.09 0.32 -0.06 -0.31 0.00 0.00 0.00 175.10 175.14 1qni s TYR 490 N 1.04 3.01 0.43 5.22 1.51 -0.45 -0.22 117.35 127.89 1qni s TYR 490 Ca 0.12 -1.33 0.07 0.00 -1.01 0.00 0.00 57.07 54.93 1qni s TYR 490 Cb -0.14 -2.08 -0.05 0.00 -0.11 0.00 0.00 41.96 39.59 1qni s TYR 490 CO 0.05 -0.67 0.15 -1.64 -1.11 0.00 0.00 175.55 172.33 1qni s MET 491 N 1.38 2.18 0.15 -0.62 -1.94 -0.39 -2.31 119.30 117.75 1qni s MET 491 Ca 0.03 -1.93 0.04 0.00 -1.71 0.00 0.00 55.69 52.12 1qni s MET 491 Cb -0.16 -1.90 -0.04 0.00 2.01 0.00 0.00 34.83 34.74 1qni s MET 491 CO -0.04 -0.15 -0.10 -0.08 -0.01 0.00 0.00 175.02 174.64 1qni s THR 492 N -2.65 1.17 -0.03 2.05 -1.32 -1.26 -2.56 115.64 111.04 1qni s THR 492 Ca 0.38 -2.05 -0.05 0.00 -1.21 0.00 0.00 61.69 58.75 1qni s THR 492 Cb 0.05 -1.84 0.01 0.00 -1.51 0.00 0.00 72.50 69.20 1qni s THR 492 CO 0.21 -0.74 0.12 -0.94 -2.21 0.00 0.00 174.62 171.05 1qni s SER 493 N -3.15 -0.05 -0.10 8.08 1.04 0.86 0.89 113.70 121.27 1qni s SER 493 Ca 0.16 0.06 -0.30 0.00 0.48 0.00 0.00 55.95 56.35 1qni s SER 493 Cb 0.02 0.23 0.11 0.00 0.10 0.00 0.00 66.02 66.49 1qni s SER 493 CO 0.01 -0.16 0.94 0.68 0.98 0.00 0.00 173.24 175.68 1qni s VAL 494 N -0.48 0.00 0.00 5.02 -7.23 -0.96 -1.16 120.40 115.60 1qni s VAL 494 Ca -0.06 0.00 0.00 0.00 -1.81 0.00 0.00 61.98 60.11 1qni s VAL 494 Cb -0.04 -1.00 0.00 0.00 0.56 0.00 0.00 36.38 35.90 1qni s VAL 494 CO 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 175.10 174.79 1qni n ALA 495 N 0.40 0.00 -0.82 1.32 0.00 -1.26 -1.81 120.51 118.34 1qni n ALA 495 Ca -0.10 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.25 1qni n ALA 495 Cb 0.59 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.98 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 -0.19 1.59 -3.75 0.00 -0.04 -1.26 -4.84 135.00 126.50 1qni n PRO 496 Ca 0.00 -0.76 -0.13 0.00 -0.04 0.00 0.00 63.50 62.57 1qni n PRO 496 Cb 0.00 -1.55 -0.10 0.00 -0.04 0.00 0.00 33.50 31.82 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 0.02 0.54 0.39 0.54 -0.21 -0.75 -3.78 119.66 116.40 1qni s GLN 497 Ca 0.34 0.17 -0.04 0.00 0.02 0.00 0.00 55.36 55.85 1qni s GLN 497 Cb 0.18 0.25 -0.04 0.00 1.00 0.00 0.00 33.01 34.40 1qni s GLN 497 CO -0.02 -0.11 0.66 0.71 -2.12 0.00 0.00 175.29 174.40 1qni s TYR 498 N -0.53 3.51 -1.30 0.91 1.51 -1.26 -2.26 117.35 117.93 1qni s TYR 498 Ca -0.06 0.66 0.01 0.00 -1.01 0.00 0.00 57.07 56.66 1qni s TYR 498 Cb -0.04 -2.15 0.03 0.00 -0.11 0.00 0.00 41.96 39.70 1qni s TYR 498 CO 0.02 -0.03 0.71 0.41 -1.11 0.00 0.00 175.55 175.55 1qni n GLY 499 N -1.68 0.79 3.61 0.71 0.00 0.26 -4.65 105.19 104.23 1qni n GLY 499 Ca -0.01 -0.04 -0.03 0.00 0.00 0.00 0.00 46.02 45.94 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 -1.36 0.44 -0.14 1.61 -2.45 -1.26 -4.78 119.30 111.36 1qni s MET 500 Ca 0.02 0.83 0.18 0.00 -1.25 0.00 0.00 55.69 55.47 1qni s MET 500 Cb 0.02 0.19 0.31 0.00 1.25 0.00 0.00 34.83 36.59 1qni s MET 500 CO 0.01 -0.10 1.16 0.25 1.05 0.00 0.00 175.02 177.39 1qni n THR 501 N 4.10 1.94 -3.64 10.11 -2.24 -1.26 -4.85 114.28 118.44 1qni n THR 501 Ca -0.17 -2.43 -0.03 0.00 -2.27 0.00 0.00 64.05 59.15 1qni n THR 501 Cb 0.57 -0.24 -0.07 0.00 -2.10 0.00 0.00 70.33 68.49 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 -2.94 -0.29 -0.06 3.42 -1.08 -1.26 -2.07 116.67 112.41 1qni s ASP 502 Ca 0.33 0.50 -0.31 0.00 -0.52 0.00 0.00 52.55 52.55 1qni s ASP 502 Cb 0.29 0.79 0.07 0.00 -1.46 0.00 0.00 42.92 42.62 1qni s ASP 502 CO 0.01 -0.08 0.70 0.72 0.52 0.00 0.00 175.17 177.04 1qni s PHE 503 N 0.63 -0.64 0.01 -5.34 -0.71 -1.11 -4.98 117.98 105.84 1qni s PHE 503 Ca -0.01 1.10 0.04 0.00 -1.04 0.00 0.00 56.93 57.02 1qni s PHE 503 Cb -0.04 0.41 -0.03 0.00 -1.21 0.00 0.00 43.02 42.15 1qni s PHE 503 CO -0.12 -0.59 -0.09 0.15 -1.34 0.00 0.00 175.22 173.23 1qni s LYS 504 N -1.18 2.46 0.09 1.99 1.02 -1.26 -0.86 119.74 121.99 1qni s LYS 504 Ca -0.10 -0.77 -0.06 0.00 0.02 0.00 0.00 55.97 55.06 1qni s LYS 504 Cb -0.00 -2.44 -0.02 0.00 -0.52 0.00 0.00 37.83 34.86 1qni s LYS 504 CO 0.09 0.59 0.12 0.14 -0.92 0.00 0.00 175.35 175.38 1qni s VAL 505 N -0.97 0.15 0.01 3.17 -7.23 0.14 -4.96 120.40 110.72 1qni s VAL 505 Ca 0.16 -1.46 -0.02 0.00 -1.81 0.00 0.00 61.98 58.85 1qni s VAL 505 Cb -0.11 -1.52 -0.04 0.00 0.56 0.00 0.00 36.38 35.27 1qni s VAL 505 CO 0.07 -0.70 0.19 -0.54 -0.31 0.00 0.00 175.10 173.81 1qni s LYS 506 N -3.91 3.43 0.13 4.82 1.02 -1.26 -1.47 119.74 122.50 1qni s LYS 506 Ca 0.09 -0.36 -0.34 0.00 0.02 0.00 0.00 55.97 55.38 1qni s LYS 506 Cb 0.06 -3.08 -0.17 0.00 -0.52 0.00 0.00 37.83 34.13 1qni s LYS 506 CO -0.08 0.66 1.17 -1.91 -0.92 0.00 0.00 175.35 174.27 1qni n GLU 507 N 0.78 0.98 -0.63 1.68 2.13 -0.39 -1.09 120.64 124.10 1qni n GLU 507 Ca -0.09 0.35 0.00 0.00 0.66 0.00 0.00 57.16 58.08 1qni n GLU 507 Cb 0.52 -1.87 0.00 0.00 0.27 0.00 0.00 31.44 30.36 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 2.10 1.02 3.77 8.31 0.00 -0.82 -4.70 105.19 114.87 1qni n GLY 508 Ca 0.17 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 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 -3.06 6.39 -0.92 1.61 1.11 -0.25 -4.66 116.67 116.90 1qni s ASP 509 Ca 0.00 2.37 -0.17 0.00 0.18 0.00 0.00 52.55 54.93 1qni s ASP 509 Cb 0.00 -2.61 0.16 0.00 1.07 0.00 0.00 42.92 41.54 1qni s ASP 509 CO 0.00 -0.77 1.04 -0.70 1.18 0.00 0.00 175.17 175.92 1qni s GLU 510 N -2.41 3.65 0.11 8.23 2.12 0.13 -0.95 118.70 129.58 1qni s GLU 510 Ca 0.59 -2.06 -0.30 0.00 0.36 0.00 0.00 54.97 53.56 1qni s GLU 510 Cb -0.31 -4.77 -0.06 0.00 0.26 0.00 0.00 34.13 29.25 1qni s GLU 510 CO 0.38 -1.61 0.99 0.08 -0.54 0.00 0.00 175.26 174.56 1qni s VAL 511 N 1.76 4.41 -0.25 3.70 1.01 0.09 -2.01 120.40 129.10 1qni s VAL 511 Ca 0.29 1.98 0.00 0.00 0.00 0.00 0.00 61.98 64.25 1qni s VAL 511 Cb -0.06 -4.27 0.07 0.00 0.00 0.00 0.00 36.38 32.12 1qni s VAL 511 CO -0.09 0.30 0.00 -0.89 0.00 0.00 0.00 175.10 174.42 1qni s THR 512 N 0.05 1.32 -0.24 3.92 2.01 0.22 -0.35 115.64 122.58 1qni s THR 512 Ca 0.48 -1.27 -0.14 0.00 0.31 0.00 0.00 61.69 61.07 1qni s THR 512 Cb -0.24 -1.74 -0.04 0.00 0.01 0.00 0.00 72.50 70.48 1qni s THR 512 CO 0.30 -0.28 0.30 -0.69 -0.69 0.00 0.00 174.62 173.56 1qni s VAL 513 N 1.46 5.25 -0.11 3.82 1.01 -0.72 -1.05 120.40 130.06 1qni s VAL 513 Ca -0.00 0.47 -0.03 0.00 0.00 0.00 0.00 61.98 62.42 1qni s VAL 513 Cb -0.18 -3.64 -0.03 0.00 0.00 0.00 0.00 36.38 32.53 1qni s VAL 513 CO -0.10 0.25 -0.00 -0.31 0.00 0.00 0.00 175.10 174.94 1qni s TYR 514 N 1.49 3.14 -0.07 5.22 1.51 0.69 -2.09 117.35 127.25 1qni s TYR 514 Ca 0.13 0.10 0.01 0.00 -1.01 0.00 0.00 57.07 56.31 1qni s TYR 514 Cb -0.15 -1.84 0.02 0.00 -0.11 0.00 0.00 41.96 39.88 1qni s TYR 514 CO 0.08 0.36 -0.10 0.42 -1.11 0.00 0.00 175.55 175.20 1qni s ILE 515 N -0.56 1.00 -0.16 2.71 -1.09 -0.82 -1.27 121.20 121.02 1qni s ILE 515 Ca 0.09 -0.37 -0.00 0.00 -2.23 0.00 0.00 60.65 58.15 1qni s ILE 515 Cb -0.12 -0.95 -0.00 0.00 -1.58 0.00 0.00 42.46 39.81 1qni s ILE 515 CO 0.02 0.33 -0.14 -0.89 -1.23 0.00 0.00 174.94 173.03 1qni s THR 516 N 0.96 2.74 -0.28 2.92 2.01 -1.06 -2.44 115.64 120.49 1qni s THR 516 Ca -0.09 -0.74 -0.23 0.00 0.31 0.00 0.00 61.69 60.94 1qni s THR 516 Cb -0.15 -2.16 -0.01 0.00 0.01 0.00 0.00 72.50 70.19 1qni s THR 516 CO 0.00 0.51 0.74 0.21 -0.69 0.00 0.00 174.62 175.39 1qni s ASN 517 N 0.83 6.66 0.04 3.53 3.84 -0.82 -0.10 114.94 128.92 1qni s ASN 517 Ca -0.05 0.72 0.22 0.00 0.21 0.00 0.00 52.86 53.96 1qni s ASN 517 Cb -0.15 -2.39 -0.07 0.00 -0.55 0.00 0.00 41.25 38.09 1qni s ASN 517 CO -0.00 -0.52 0.89 0.18 -2.79 0.00 0.00 177.10 174.86 1qni n LEU 518 N 6.01 0.55 -4.43 3.21 4.77 -0.31 -1.08 117.00 125.73 1qni n LEU 518 Ca 0.02 -0.04 -0.35 0.00 -0.03 0.00 0.00 56.01 55.62 1qni n LEU 518 Cb 0.48 -0.06 0.08 0.00 -2.33 0.00 0.00 43.42 41.60 1qni n LEU 518 CO 0.47 0.04 -0.05 0.47 -1.33 0.00 0.00 177.39 176.99 1qni n ASP 519 N -2.04 -1.72 0.00 -1.43 8.00 -1.25 -4.72 116.55 113.39 1qni n ASP 519 Ca 0.01 0.49 0.00 0.00 0.71 0.00 0.00 54.79 55.99 1qni n ASP 519 Cb 0.46 -1.19 0.00 0.00 -0.02 0.00 0.00 41.12 40.37 1qni n ASP 519 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 1qni n MET 520 N -0.90 3.74 -2.21 -1.24 2.81 -1.26 -3.58 117.12 114.48 1qni n MET 520 Ca 0.08 0.00 -0.41 0.00 -1.81 0.00 0.00 57.70 55.57 1qni n MET 520 Cb 0.51 -0.65 -0.03 0.00 -0.71 0.00 0.00 33.22 32.35 1qni n MET 520 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 1qni s VAL 521 N -1.24 2.98 0.56 2.03 1.01 -1.26 -4.98 120.40 119.50 1qni s VAL 521 Ca 0.00 0.94 -0.20 0.00 0.00 0.00 0.00 61.98 62.72 1qni s VAL 521 Cb 0.00 -3.60 -0.05 0.00 0.00 0.00 0.00 36.38 32.73 1qni s VAL 521 CO 0.00 0.20 1.17 -1.61 0.00 0.00 0.00 175.10 174.87 1qni s GLU 522 N -1.30 3.23 0.00 2.72 2.02 -1.26 -2.83 118.70 121.29 1qni s GLU 522 Ca 0.50 1.74 0.00 0.00 0.02 0.00 0.00 54.97 57.23 1qni s GLU 522 Cb -0.37 -2.02 0.00 0.00 0.10 0.00 0.00 34.13 31.83 1qni s GLU 522 CO 0.47 -0.98 0.00 -3.47 0.02 0.00 0.00 175.26 171.30 1qni n ASP 523 N -1.33 0.00 -4.53 -0.19 2.03 -1.26 -4.92 116.55 106.36 1qni n ASP 523 Ca 0.12 0.00 -0.43 0.00 0.52 0.00 0.00 54.79 55.00 1qni n ASP 523 Cb 0.50 -0.56 -0.01 0.00 -0.72 0.00 0.00 41.12 40.32 1qni n ASP 523 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1qni s VAL 524 N -2.65 4.35 -0.09 5.18 1.01 -1.13 -4.96 120.40 122.11 1qni s VAL 524 Ca 0.00 -1.65 -0.07 0.00 0.00 0.00 0.00 61.98 60.26 1qni s VAL 524 Cb 0.00 -5.02 -0.04 0.00 0.00 0.00 0.00 36.38 31.32 1qni s VAL 524 CO 0.00 -1.83 0.17 -0.89 0.00 0.00 0.00 175.10 172.56 1qni s THR 525 N 3.65 5.45 0.19 3.92 2.01 -1.26 -3.83 115.64 125.77 1qni s THR 525 Ca 0.45 0.22 0.10 0.00 0.31 0.00 0.00 61.69 62.77 1qni s THR 525 Cb -0.00 -3.45 -0.04 0.00 0.01 0.00 0.00 72.50 69.01 1qni s THR 525 CO -0.02 0.57 -0.13 -1.00 -0.69 0.00 0.00 174.62 173.35 1qni s HIS 526 N -1.08 2.54 0.06 4.92 3.76 0.15 -4.51 115.29 121.12 1qni s HIS 526 Ca 0.18 -0.26 0.00 0.00 -0.15 0.00 0.00 55.06 54.83 1qni s HIS 526 Cb -0.13 -1.23 -0.00 0.00 1.11 0.00 0.00 32.58 32.33 1qni s HIS 526 CO 0.07 0.53 0.01 0.41 -0.85 0.00 0.00 174.74 174.90 1qni n GLY 527 N 0.01 4.09 3.38 -2.22 0.00 -1.26 0.42 105.19 109.61 1qni n GLY 527 Ca -0.11 -2.15 0.02 0.00 0.00 0.00 0.00 46.02 43.78 1qni n GLY 527 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1qni s PHE 528 N -1.37 -1.05 -0.07 1.61 5.36 -1.12 -4.49 117.98 116.85 1qni s PHE 528 Ca 0.01 1.53 0.01 0.00 -0.96 0.00 0.00 56.93 57.52 1qni s PHE 528 Cb 0.00 0.52 0.02 0.00 -0.34 0.00 0.00 43.02 43.23 1qni s PHE 528 CO 0.01 -0.54 -0.07 0.00 -1.46 0.00 0.00 175.22 173.16 1qni s MET 530 N 1.23 3.01 0.15 0.00 1.75 -1.22 -1.49 119.30 122.72 1qni s MET 530 Ca -0.05 -1.34 -0.32 0.00 -1.25 0.00 0.00 55.69 52.73 1qni s MET 530 Cb -0.14 -4.16 -0.17 0.00 2.84 0.00 0.00 34.83 33.20 1qni s MET 530 CO -0.02 -1.13 0.80 0.28 -0.65 0.00 0.00 175.02 174.31 1qni n VAL 531 N 5.29 1.30 -1.72 10.11 0.31 -0.87 -1.56 118.33 131.19 1qni n VAL 531 Ca -0.12 -0.32 -0.17 0.00 -0.01 0.00 0.00 64.34 63.71 1qni n VAL 531 Cb 0.43 -0.21 -0.06 0.00 -0.91 0.00 0.00 33.84 33.09 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 1.81 -4.73 -0.02 4.52 4.13 -1.26 -4.82 115.26 114.89 1qni n ASN 532 Ca 0.17 0.35 0.01 0.00 1.68 0.00 0.00 54.58 56.79 1qni n ASN 532 Cb 0.21 -4.18 0.02 0.00 -1.54 0.00 0.00 39.78 34.28 1qni n ASN 532 CO 0.00 0.00 0.00 1.41 0.28 0.00 0.00 177.26 178.95 1qni n HIS 533 N -2.53 0.00 -3.83 3.10 8.25 -0.60 -4.98 115.22 114.63 1qni n HIS 533 Ca -0.18 -0.48 -0.25 0.00 -0.26 0.00 0.00 57.72 56.55 1qni n HIS 533 Cb 0.59 -0.05 0.00 0.00 1.12 0.00 0.00 29.99 31.65 1qni n HIS 533 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1qni n GLY 534 N -0.53 -0.34 2.98 -1.41 0.00 -1.26 -4.95 105.19 99.68 1qni n GLY 534 Ca 0.02 0.18 -0.14 0.00 0.00 0.00 0.00 46.02 46.08 1qni n GLY 534 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1qni s VAL 535 N -3.80 0.37 -0.25 1.61 1.01 -1.26 -5.07 120.40 113.00 1qni s VAL 535 Ca 0.06 -0.47 -0.27 0.00 0.00 0.00 0.00 61.98 61.30 1qni s VAL 535 Cb -0.02 -0.36 0.14 0.00 0.00 0.00 0.00 36.38 36.14 1qni s VAL 535 CO 0.86 -0.08 1.12 -0.55 0.00 0.00 0.00 175.10 176.46 1qni s SER 536 N -0.59 -0.32 0.17 3.32 0.15 -1.25 -3.38 113.70 111.81 1qni s SER 536 Ca -0.03 0.52 -0.19 0.00 0.70 0.00 0.00 55.95 56.95 1qni s SER 536 Cb -0.04 0.49 0.04 0.00 -1.71 0.00 0.00 66.02 64.80 1qni s SER 536 CO -0.00 -0.18 0.54 0.00 1.20 0.00 0.00 173.24 174.80 1qni s MET 537 N -0.33 1.30 -0.10 5.44 0.23 -0.99 -3.86 119.30 120.99 1qni s MET 537 Ca 0.03 -0.69 -0.04 0.00 -1.03 0.00 0.00 55.69 53.96 1qni s MET 537 Cb -0.03 0.54 -0.04 0.00 -1.53 0.00 0.00 34.83 33.77 1qni s MET 537 CO -0.06 -0.55 0.05 -2.00 -2.03 0.00 0.00 175.02 170.43 1qni s GLU 538 N -3.81 3.21 -0.32 3.16 2.12 -0.72 -2.81 118.70 119.53 1qni s GLU 538 Ca 0.05 -0.31 -0.02 0.00 0.36 0.00 0.00 54.97 55.06 1qni s GLU 538 Cb -0.01 -2.96 0.11 0.00 0.26 0.00 0.00 34.13 31.53 1qni s GLU 538 CO -0.08 0.70 0.14 0.42 -0.54 0.00 0.00 175.26 175.90 1qni s ILE 539 N -0.85 0.48 0.65 -3.70 1.09 0.17 -4.69 121.20 114.35 1qni s ILE 539 Ca 0.13 -1.32 -0.04 0.00 -1.10 0.00 0.00 60.65 58.32 1qni s ILE 539 Cb -0.12 -1.37 0.05 0.00 -1.06 0.00 0.00 42.46 39.97 1qni s ILE 539 CO 0.03 -0.76 0.93 -0.44 -0.10 0.00 0.00 174.94 174.60 1qni s SER 540 N 1.60 4.94 -0.45 3.58 0.01 -1.26 0.32 113.70 122.44 1qni s SER 540 Ca 0.11 0.26 -0.45 0.00 1.31 0.00 0.00 55.95 57.18 1qni s SER 540 Cb -0.18 -0.98 -0.19 0.00 0.21 0.00 0.00 66.02 64.88 1qni s SER 540 CO -0.23 -1.46 1.67 -2.65 0.41 0.00 0.00 173.24 170.98 1qni n PRO 541 N -2.72 0.28 -1.11 12.44 -0.02 -1.25 -1.03 135.00 141.58 1qni n PRO 541 Ca 0.08 0.10 -0.04 0.00 -2.02 0.00 0.00 63.50 61.63 1qni n PRO 541 Cb 0.60 -1.65 -0.02 0.00 -0.02 0.00 0.00 33.50 32.41 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 4.56 -1.03 -3.75 -0.52 1.13 -0.24 -2.09 117.38 115.44 1qni n GLN 542 Ca 0.31 0.49 -0.24 0.00 -1.94 0.00 0.00 57.00 55.62 1qni n GLN 542 Cb -0.01 -4.38 -0.02 0.00 0.11 0.00 0.00 30.24 25.93 1qni n GLN 542 CO 0.00 0.00 0.00 -1.14 -1.44 0.00 0.00 177.06 174.48 1qni s GLN 543 N -1.74 3.47 -0.06 -1.09 0.74 -0.20 -4.61 119.66 116.17 1qni s GLN 543 Ca 0.00 -0.52 0.03 0.00 0.05 0.00 0.00 55.36 54.92 1qni s GLN 543 Cb 0.00 -2.83 0.01 0.00 1.10 0.00 0.00 33.01 31.28 1qni s GLN 543 CO 0.00 0.37 -0.14 0.99 -0.55 0.00 0.00 175.29 175.96 1qni s THR 544 N -1.99 1.22 -0.01 -0.34 2.01 -1.26 -1.94 115.64 113.33 1qni s THR 544 Ca 0.37 -0.54 0.00 0.00 0.31 0.00 0.00 61.69 61.82 1qni s THR 544 Cb -0.10 -1.09 0.01 0.00 0.01 0.00 0.00 72.50 71.33 1qni s THR 544 CO 0.31 0.37 0.01 0.00 -0.69 0.00 0.00 174.62 174.61 1qni s ALA 545 N 0.51 0.04 0.27 7.40 0.00 -1.02 -4.71 121.76 124.25 1qni s ALA 545 Ca -0.12 0.09 0.11 0.00 0.00 0.00 0.00 51.96 52.03 1qni s ALA 545 Cb -0.15 -0.08 -0.05 0.00 0.00 0.00 0.00 23.12 22.84 1qni s ALA 545 CO 0.04 -0.03 -0.12 -1.54 0.00 0.00 0.00 175.76 174.10 1qni s SER 546 N 0.33 3.97 -0.21 0.00 1.04 -1.26 -1.94 113.70 115.63 1qni s SER 546 Ca -0.03 -0.86 -0.10 0.00 0.48 0.00 0.00 55.95 55.45 1qni s SER 546 Cb -0.04 -0.52 0.08 0.00 0.10 0.00 0.00 66.02 65.64 1qni s SER 546 CO -0.01 0.03 0.49 0.54 0.98 0.00 0.00 173.24 175.27 1qni s VAL 547 N -2.36 -0.33 0.07 5.02 0.11 -0.89 -2.31 120.40 119.71 1qni s VAL 547 Ca 0.30 0.09 0.03 0.00 -2.93 0.00 0.00 61.98 59.47 1qni s VAL 547 Cb -0.06 -0.74 -0.04 0.00 -1.53 0.00 0.00 36.38 34.01 1qni s VAL 547 CO 0.17 0.04 0.06 0.28 -3.33 0.00 0.00 175.10 172.32 1qni s THR 548 N 2.00 4.45 0.20 5.04 -1.32 -1.26 -1.76 115.64 122.99 1qni s THR 548 Ca -0.07 -0.74 -0.21 0.00 -1.21 0.00 0.00 61.69 59.45 1qni s THR 548 Cb -0.09 -3.12 0.05 0.00 -1.51 0.00 0.00 72.50 67.83 1qni s THR 548 CO -0.15 0.17 0.62 0.72 -2.21 0.00 0.00 174.62 173.77 1qni s PHE 549 N -1.33 -0.36 -0.12 9.09 -0.12 0.53 -4.99 117.98 120.67 1qni s PHE 549 Ca 0.27 0.05 -0.15 0.00 -0.05 0.00 0.00 56.93 57.06 1qni s PHE 549 Cb -0.12 0.58 -0.05 0.00 -0.63 0.00 0.00 43.02 42.80 1qni s PHE 549 CO 0.20 -0.98 0.35 0.99 -0.05 0.00 0.00 175.22 175.73 1qni s THR 550 N -3.82 5.24 0.04 -4.49 2.01 -1.26 -0.74 115.64 112.63 1qni s THR 550 Ca 0.05 0.68 -0.30 0.00 0.31 0.00 0.00 61.69 62.43 1qni s THR 550 Cb -0.02 -3.68 -0.08 0.00 0.01 0.00 0.00 72.50 68.73 1qni s THR 550 CO -0.05 0.41 1.68 0.00 -0.69 0.00 0.00 174.62 175.97 1qni s ALA 551 N 0.21 3.66 1.00 7.40 0.00 -0.12 -4.93 121.76 128.98 1qni s ALA 551 Ca 0.20 1.17 0.00 0.00 0.00 0.00 0.00 51.96 53.33 1qni s ALA 551 Cb -0.14 -3.72 0.00 0.00 0.00 0.00 0.00 23.12 19.26 1qni s ALA 551 CO 0.07 -1.20 0.00 0.41 0.00 0.00 0.00 175.76 175.04 1qni n GLY 552 N 4.07 -2.39 3.75 0.00 0.00 -1.26 -1.94 105.19 107.43 1qni n GLY 552 Ca 0.16 -1.23 -0.31 0.00 0.00 0.00 0.00 46.02 44.64 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 2.14 0.33 1.61 -2.85 -1.26 -4.14 119.74 115.57 1qni s LYS 553 Ca 0.00 1.26 -0.29 0.00 -1.00 0.00 0.00 55.97 55.94 1qni s LYS 553 Cb 0.00 -1.88 -0.11 0.00 -2.06 0.00 0.00 37.83 33.78 1qni s LYS 553 CO 0.00 -1.74 1.56 -1.25 0.10 0.00 0.00 175.35 174.02 1qni s PRO 554 N -4.75 4.10 0.00 1.78 0.04 -1.26 -4.90 135.00 130.01 1qni s PRO 554 Ca 0.63 2.60 0.00 0.00 0.04 0.00 0.00 61.00 64.27 1qni s PRO 554 Cb -0.19 -2.99 0.00 0.00 0.04 0.00 0.00 34.50 31.36 1qni s PRO 554 CO 0.54 -0.61 0.00 0.41 0.04 0.00 0.00 177.00 177.38 1qni n GLY 555 N 1.43 -0.62 3.76 0.56 0.00 0.42 -5.00 105.19 105.73 1qni n GLY 555 Ca 0.05 -1.34 -0.37 0.00 0.00 0.00 0.00 46.02 44.36 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 -2.86 5.25 -0.30 1.61 1.01 -1.26 -2.11 120.40 121.73 1qni s VAL 556 Ca 0.00 0.66 -0.02 0.00 0.00 0.00 0.00 61.98 62.62 1qni s VAL 556 Cb 0.00 -3.67 0.10 0.00 0.00 0.00 0.00 36.38 32.81 1qni s VAL 556 CO 0.00 0.43 0.11 -0.31 0.00 0.00 0.00 175.10 175.33 1qni s TYR 557 N 0.10 1.25 0.63 5.22 2.02 -0.33 -5.00 117.35 121.24 1qni s TYR 557 Ca 0.20 -1.44 -0.17 0.00 -0.37 0.00 0.00 57.07 55.28 1qni s TYR 557 Cb -0.14 -1.44 -0.02 0.00 -0.40 0.00 0.00 41.96 39.96 1qni s TYR 557 CO 0.07 -0.86 1.17 -1.58 -1.57 0.00 0.00 175.55 172.79 1qni s TRP 558 N 1.78 2.41 -0.03 2.71 0.52 -1.26 -0.54 118.94 124.53 1qni s TRP 558 Ca 0.09 1.54 0.01 0.00 0.02 0.00 0.00 56.10 57.77 1qni s TRP 558 Cb -0.17 -3.38 0.02 0.00 -1.15 0.00 0.00 33.47 28.79 1qni s TRP 558 CO -0.29 -2.08 -0.02 1.52 0.02 0.00 0.00 176.95 176.10 1qni s TYR 559 N -1.86 0.45 0.34 -1.98 -0.85 -0.98 -2.05 117.35 110.42 1qni s TYR 559 Ca 0.74 -0.07 0.03 0.00 -0.52 0.00 0.00 57.07 57.25 1qni s TYR 559 Cb -0.27 -0.45 -0.04 0.00 0.38 0.00 0.00 41.96 41.58 1qni s TYR 559 CO 0.36 -0.12 0.13 1.52 -1.52 0.00 0.00 175.55 175.93 1qni s TYR 560 N 0.76 1.71 -0.18 -3.49 1.13 -0.56 -1.21 117.35 115.51 1qni s TYR 560 Ca -0.08 -1.28 -0.15 0.00 -1.41 0.00 0.00 57.07 54.14 1qni s TYR 560 Cb -0.12 -1.01 -0.04 0.00 -1.10 0.00 0.00 41.96 39.69 1qni s TYR 560 CO -0.01 -0.37 0.37 0.00 -2.51 0.00 0.00 175.55 173.03 1qni n ASN 562 N 4.05 1.32 -4.41 0.00 2.04 -1.26 -4.81 115.26 112.18 1qni n ASN 562 Ca -0.09 -1.11 -0.44 0.00 -0.44 0.00 0.00 54.58 52.49 1qni n ASN 562 Cb 0.51 0.71 -0.05 0.00 -2.53 0.00 0.00 39.78 38.42 1qni n ASN 562 CO 0.00 0.00 0.00 0.26 -0.44 0.00 0.00 177.26 177.08 1qni s TRP 563 N -2.79 2.96 -0.38 -2.53 0.51 -1.26 -4.96 118.94 110.49 1qni s TRP 563 Ca 0.13 -0.73 -0.37 0.00 -2.12 0.00 0.00 56.10 53.00 1qni s TRP 563 Cb 0.17 -3.91 -0.13 0.00 -0.81 0.00 0.00 33.47 28.79 1qni s TRP 563 CO 0.73 -1.26 2.17 0.34 -0.51 0.00 0.00 176.95 178.42 1qni n PHE 564 N 6.52 1.52 0.00 -1.98 -0.00 -1.26 -4.63 117.46 117.62 1qni n PHE 564 Ca -0.07 0.39 0.00 0.00 -0.00 0.00 0.00 57.45 57.76 1qni n PHE 564 Cb 0.44 -2.48 0.00 0.00 -0.00 0.00 0.00 39.48 37.44 1qni n PHE 564 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1qni s HIS 566 N -1.00 -0.29 0.32 0.00 5.65 -1.26 -4.93 115.29 113.77 1qni s HIS 566 Ca 0.00 0.03 0.38 0.00 0.25 0.00 0.00 55.06 55.72 1qni s HIS 566 Cb 0.00 0.60 1.82 0.00 -1.18 0.00 0.00 32.58 33.83 1qni s HIS 566 CO 0.00 -0.81 2.14 0.00 -0.65 0.00 0.00 174.74 175.42 1qni h ALA 567 N 2.00 1.00 -0.60 1.58 0.00 -2.01 -1.31 119.26 119.92 1qni h ALA 567 Ca -0.25 0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.58 1qni h ALA 567 Cb 1.25 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.99 1qni h ALA 567 CO 0.29 0.00 0.10 1.28 0.00 0.00 0.00 179.25 180.92 1qni n LEU 568 N -3.02 5.65 -0.26 0.00 4.77 -1.26 -4.68 117.00 118.21 1qni n LEU 568 Ca -0.01 -3.08 0.05 0.00 -0.03 0.00 0.00 56.01 52.95 1qni n LEU 568 Cb 0.19 -0.69 0.16 0.00 -2.33 0.00 0.00 43.42 40.75 1qni n LEU 568 CO 0.23 0.72 0.84 -0.74 -1.33 0.00 0.00 177.39 177.11 1qni h HIS 569 N 3.20 -0.00 -0.02 -1.77 2.76 -1.59 0.24 115.15 117.97 1qni h HIS 569 Ca 0.10 0.05 0.01 0.00 -2.20 0.00 0.00 60.37 58.34 1qni h HIS 569 Cb 2.06 0.12 -0.00 0.00 1.55 0.00 0.00 27.41 31.14 1qni h HIS 569 CO 1.11 -0.22 0.06 0.52 -1.30 0.00 0.00 177.93 178.10 1qni h MET 570 N 0.12 0.00 0.00 5.26 2.86 -1.85 -1.74 114.93 119.58 1qni h MET 570 Ca 0.42 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 58.06 1qni h MET 570 Cb 0.74 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.40 1qni h MET 570 CO -0.65 0.00 -0.90 0.39 1.06 0.00 0.00 176.91 176.82 1qni n GLU 571 N -3.33 0.15 -2.14 1.72 4.71 0.82 -4.78 120.64 117.79 1qni n GLU 571 Ca -0.02 -0.00 -0.31 0.00 -0.01 0.00 0.00 57.16 56.81 1qni n GLU 571 Cb 0.14 -1.55 -0.04 0.00 -1.01 0.00 0.00 31.44 28.98 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 -3.11 2.73 0.00 3.49 1.75 -0.66 -4.84 119.30 118.67 1qni s MET 572 Ca 0.06 -0.29 0.00 0.00 -1.25 0.00 0.00 55.69 54.22 1qni s MET 572 Cb 0.16 -4.99 0.00 0.00 2.84 0.00 0.00 34.83 32.84 1qni s MET 572 CO 0.79 -3.08 0.00 1.33 -0.65 0.00 0.00 175.02 173.41 1qni n VAL 573 N 7.60 0.00 -3.80 10.11 0.24 -1.26 -2.64 118.33 128.57 1qni n VAL 573 Ca 0.35 0.00 -0.01 0.00 -2.04 0.00 0.00 64.34 62.64 1qni n VAL 573 Cb 0.48 0.00 0.01 0.00 -1.47 0.00 0.00 33.84 32.87 1qni n VAL 573 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1qni n GLY 574 N 0.00 0.70 3.01 7.63 0.00 -0.35 -4.69 105.19 111.49 1qni n GLY 574 Ca 0.00 -1.04 -0.13 0.00 0.00 0.00 0.00 46.02 44.85 1qni n GLY 574 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1qni s ARG 575 N -2.03 0.17 -0.21 1.61 0.52 -0.88 -2.31 118.95 115.82 1qni s ARG 575 Ca 0.16 0.58 -0.11 0.00 -0.52 0.00 0.00 55.73 55.84 1qni s ARG 575 Cb -0.01 -0.12 -0.05 0.00 0.52 0.00 0.00 34.95 35.29 1qni s ARG 575 CO 0.02 -0.21 0.18 1.41 0.02 0.00 0.00 175.30 176.72 1qni s MET 576 N 1.64 4.14 -0.35 3.54 -2.45 0.30 -2.75 119.30 123.37 1qni s MET 576 Ca -0.06 -0.18 -0.09 0.00 -1.25 0.00 0.00 55.69 54.11 1qni s MET 576 Cb -0.11 -3.48 0.03 0.00 1.25 0.00 0.00 34.83 32.52 1qni s MET 576 CO -0.08 0.16 0.16 -0.51 1.05 0.00 0.00 175.02 175.80 1qni s LEU 577 N 0.75 4.47 -0.30 4.11 1.43 -0.04 -1.19 118.68 127.91 1qni s LEU 577 Ca 0.09 -1.00 -0.09 0.00 -1.03 0.00 0.00 54.13 52.10 1qni s LEU 577 Cb -0.13 -1.95 -0.01 0.00 0.03 0.00 0.00 46.19 44.13 1qni s LEU 577 CO 0.02 -0.34 0.14 -0.69 0.23 0.00 0.00 176.35 175.71 1qni s VAL 578 N 1.50 4.55 0.27 -1.59 1.01 -0.90 -0.68 120.40 124.56 1qni s VAL 578 Ca 0.01 -0.36 0.07 0.00 0.00 0.00 0.00 61.98 61.69 1qni s VAL 578 Cb -0.19 -3.28 -0.03 0.00 0.00 0.00 0.00 36.38 32.88 1qni s VAL 578 CO 0.05 0.13 0.26 -1.83 0.00 0.00 0.00 175.10 173.70 1qni s GLU 579 N 1.61 2.97 0.29 2.72 -1.05 -0.54 -0.44 118.70 124.27 1qni s GLU 579 Ca 0.05 -1.06 -0.30 0.00 -0.15 0.00 0.00 54.97 53.51 1qni s GLU 579 Cb -0.17 -2.61 -0.11 0.00 -0.44 0.00 0.00 34.13 30.80 1qni s GLU 579 CO 0.06 0.32 1.60 0.00 0.95 0.00 0.00 175.26 178.19 1qni s ALA 580 N -2.15 3.75 -2.00 -0.84 0.00 -1.26 -1.26 121.76 118.00 1qni s ALA 580 Ca 0.35 1.58 0.20 0.00 0.00 0.00 0.00 51.96 54.10 1qni s ALA 580 Cb -0.08 -3.65 1.19 0.00 0.00 0.00 0.00 23.12 20.58 1qni s ALA 580 CO 0.26 -0.99 1.58 0.00 0.00 0.00 0.00 175.76 176.60