#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 2.44 -0.28 0.00 0.09 -1.26 -4.65 115.29 111.63 1qni s HIS 11 Ca 0.00 -0.57 0.02 0.00 -0.00 0.00 0.00 55.06 54.51 1qni s HIS 11 Cb 0.00 -1.57 0.06 0.00 -0.00 0.00 0.00 32.58 31.07 1qni s HIS 11 CO 0.00 -0.12 -0.07 0.08 -0.00 0.00 0.00 174.74 174.64 1qni s VAL 12 N -0.35 2.36 0.60 -0.90 1.01 -1.26 -5.02 120.40 116.83 1qni s VAL 12 Ca 0.02 -1.68 -0.09 0.00 0.00 0.00 0.00 61.98 60.24 1qni s VAL 12 Cb -0.12 -2.43 -0.02 0.00 0.00 0.00 0.00 36.38 33.81 1qni s VAL 12 CO 0.02 -0.12 0.96 0.00 0.00 0.00 0.00 175.10 175.96 1qni s ALA 13 N 1.11 3.17 0.09 5.51 0.00 -1.26 -4.94 121.76 125.44 1qni s ALA 13 Ca -0.06 -0.37 -0.34 0.00 0.00 0.00 0.00 51.96 51.20 1qni s ALA 13 Cb -0.20 -2.86 -0.13 0.00 0.00 0.00 0.00 23.12 19.94 1qni s ALA 13 CO -0.05 -0.73 1.68 -2.30 0.00 0.00 0.00 175.76 174.36 1qni n PRO 14 N -2.66 2.23 0.00 0.00 -0.02 -1.26 -0.90 135.00 132.39 1qni n PRO 14 Ca 0.05 0.81 0.00 0.00 -2.02 0.00 0.00 63.50 62.34 1qni n PRO 14 Cb 0.56 -2.61 0.00 0.00 -0.02 0.00 0.00 33.50 31.43 1qni n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1qni n GLY 15 N 3.76 2.83 3.96 -1.23 0.00 -1.26 -5.06 105.19 108.19 1qni n GLY 15 Ca 0.18 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.99 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 -0.91 3.39 0.17 1.61 2.02 -0.08 -5.12 118.70 119.77 1qni s GLU 16 Ca 0.00 -0.65 0.10 0.00 0.02 0.00 0.00 54.97 54.44 1qni s GLU 16 Cb 0.00 -2.79 -0.04 0.00 0.10 0.00 0.00 34.13 31.40 1qni s GLU 16 CO 0.00 0.25 -0.18 -0.51 0.02 0.00 0.00 175.26 174.84 1qni s LEU 17 N -4.14 2.65 1.11 1.80 1.43 -1.26 -4.80 118.68 115.46 1qni s LEU 17 Ca 0.38 -0.71 -0.14 0.00 -1.03 0.00 0.00 54.13 52.63 1qni s LEU 17 Cb -0.09 -1.40 0.24 0.00 0.03 0.00 0.00 46.19 44.97 1qni s LEU 17 CO 0.32 0.13 1.07 -1.81 0.23 0.00 0.00 176.35 176.29 1qni s ASP 18 N -2.58 1.64 -0.09 2.29 1.11 -1.26 -4.99 116.67 112.78 1qni s ASP 18 Ca 0.21 1.12 0.16 0.00 0.18 0.00 0.00 52.55 54.22 1qni s ASP 18 Cb -0.09 -1.74 -0.23 0.00 1.07 0.00 0.00 42.92 41.94 1qni s ASP 18 CO 0.11 -3.74 0.21 -0.62 1.18 0.00 0.00 175.17 172.32 1qni n GLU 19 N -4.57 0.98 -4.24 8.23 1.02 -0.04 -4.94 120.64 117.09 1qni n GLU 19 Ca 0.06 -0.08 -0.20 0.00 -0.02 0.00 0.00 57.16 56.92 1qni n GLU 19 Cb 0.57 -1.40 -0.12 0.00 -0.02 0.00 0.00 31.44 30.47 1qni n GLU 19 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 1qni s TYR 20 N -2.77 1.48 0.03 -0.32 1.51 -0.61 -1.71 117.35 114.95 1qni s TYR 20 Ca -0.07 -0.48 -0.10 0.00 -1.01 0.00 0.00 57.07 55.41 1qni s TYR 20 Cb 0.08 -0.80 -0.05 0.00 -0.11 0.00 0.00 41.96 41.08 1qni s TYR 20 CO 0.68 0.15 0.35 0.71 -1.11 0.00 0.00 175.55 176.32 1qni s TYR 21 N -1.61 3.62 -0.21 2.71 2.02 -0.15 -1.02 117.35 122.70 1qni s TYR 21 Ca 0.05 0.76 0.00 0.00 -0.37 0.00 0.00 57.07 57.52 1qni s TYR 21 Cb -0.08 -2.13 0.05 0.00 -0.40 0.00 0.00 41.96 39.40 1qni s TYR 21 CO 0.03 0.59 -0.07 0.20 -1.57 0.00 0.00 175.55 174.74 1qni s GLY 22 N -1.52 1.21 -0.60 0.71 0.00 0.17 -2.04 107.32 105.25 1qni s GLY 22 Ca 0.28 -1.21 -0.17 0.00 0.00 0.00 0.00 44.72 43.62 1qni s GLY 22 CO 0.15 0.88 0.64 -1.36 0.00 0.00 0.00 173.10 173.41 1qni s PHE 23 N 1.45 3.15 0.05 1.90 0.08 -0.53 0.85 117.98 124.93 1qni s PHE 23 Ca -0.03 -1.18 -0.23 0.00 0.12 0.00 0.00 56.93 55.62 1qni s PHE 23 Cb -0.17 -3.93 -0.06 0.00 -0.57 0.00 0.00 43.02 38.29 1qni s PHE 23 CO -0.07 -1.17 0.67 -1.58 -0.10 0.00 0.00 175.22 172.97 1qni s TRP 24 N 2.08 3.76 0.66 0.36 0.23 0.24 -2.63 118.94 123.65 1qni s TRP 24 Ca 0.09 1.37 -0.13 0.00 -2.03 0.00 0.00 56.10 55.40 1qni s TRP 24 Cb -0.25 -2.68 -0.00 0.00 0.03 0.00 0.00 33.47 30.56 1qni s TRP 24 CO 0.03 0.39 1.07 -1.54 0.96 0.00 0.00 176.95 177.87 1qni s SER 25 N -0.44 5.35 0.00 2.95 1.04 -1.08 0.03 113.70 121.56 1qni s SER 25 Ca 0.34 1.79 0.18 0.00 0.48 0.00 0.00 55.95 58.74 1qni s SER 25 Cb -0.20 -2.52 0.13 0.00 0.10 0.00 0.00 66.02 63.53 1qni s SER 25 CO 0.21 -1.46 1.06 0.61 0.98 0.00 0.00 173.24 174.64 1qni n GLY 26 N -1.24 0.36 7.00 7.32 0.00 -0.26 -4.40 105.19 113.97 1qni n GLY 26 Ca 0.09 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.59 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 1.03 1.51 0.67 -0.02 0.00 -0.44 -2.41 105.19 105.53 1qni n GLY 27 Ca 0.10 -0.66 0.02 0.00 0.00 0.00 0.00 46.02 45.48 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 9.94 0.41 0.01 1.61 1.44 -1.26 -0.21 115.22 127.17 1qni n HIS 28 Ca 0.00 -0.15 -0.06 0.00 -2.01 0.00 0.00 57.72 55.50 1qni n HIS 28 Cb 0.00 -0.14 -0.12 0.00 0.12 0.00 0.00 29.99 29.86 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 0.97 0.00 0.00 -1.40 -0.00 -1.63 -3.41 115.11 109.63 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 0.66 0.00 0.00 0.00 0.00 0.00 0.00 27.48 28.14 1qni h GLN 29 CO 0.08 0.51 0.00 0.41 0.00 0.00 0.00 178.83 179.83 1qni n GLY 30 N 1.47 3.18 4.02 2.39 0.00 -1.13 -4.53 105.19 110.59 1qni n GLY 30 Ca -0.12 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.70 1qni n GLY 30 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1qni s GLU 31 N -0.61 2.22 -0.12 1.61 -1.05 -1.26 -1.70 118.70 117.79 1qni s GLU 31 Ca 0.00 -1.44 0.02 0.00 -0.15 0.00 0.00 54.97 53.40 1qni s GLU 31 Cb 0.00 -2.58 -0.01 0.00 -0.44 0.00 0.00 34.13 31.11 1qni s GLU 31 CO 0.00 -0.93 -0.19 0.08 0.95 0.00 0.00 175.26 175.17 1qni s VAL 32 N -2.75 2.53 -0.13 1.83 1.01 -0.38 -1.10 120.40 121.41 1qni s VAL 32 Ca 0.62 -0.85 -0.04 0.00 0.00 0.00 0.00 61.98 61.71 1qni s VAL 32 Cb -0.06 -2.02 -0.04 0.00 0.00 0.00 0.00 36.38 34.26 1qni s VAL 32 CO 0.40 0.54 0.03 -0.13 0.00 0.00 0.00 175.10 175.94 1qni s ARG 33 N 0.38 3.47 -0.22 2.72 0.52 0.10 -0.19 118.95 125.73 1qni s ARG 33 Ca -0.15 -0.38 -0.08 0.00 -0.52 0.00 0.00 55.73 54.61 1qni s ARG 33 Cb -0.17 -2.99 -0.04 0.00 0.52 0.00 0.00 34.95 32.27 1qni s ARG 33 CO 0.07 0.50 0.08 0.08 0.02 0.00 0.00 175.30 176.04 1qni s VAL 34 N -0.29 4.66 0.27 3.52 1.01 0.83 0.83 120.40 131.24 1qni s VAL 34 Ca 0.07 -0.07 0.09 0.00 0.00 0.00 0.00 61.98 62.07 1qni s VAL 34 Cb -0.12 -3.14 -0.05 0.00 0.00 0.00 0.00 36.38 33.06 1qni s VAL 34 CO 0.02 0.39 -0.13 -0.76 0.00 0.00 0.00 175.10 174.62 1qni s LEU 35 N 0.98 2.58 -0.16 3.92 1.43 0.25 -0.24 118.68 127.43 1qni s LEU 35 Ca 0.04 -1.10 -0.07 0.00 -1.03 0.00 0.00 54.13 51.97 1qni s LEU 35 Cb -0.14 -0.85 -0.04 0.00 0.03 0.00 0.00 46.19 45.19 1qni s LEU 35 CO 0.03 -0.16 0.09 -0.83 0.23 0.00 0.00 176.35 175.71 1qni s GLY 36 N -3.46 1.99 -0.05 -3.19 0.00 -0.16 0.42 107.32 102.87 1qni s GLY 36 Ca 0.28 -0.71 0.05 0.00 0.00 0.00 0.00 44.72 44.33 1qni s GLY 36 CO 0.12 -0.09 -0.17 0.14 0.00 0.00 0.00 173.10 173.10 1qni s VAL 37 N -0.08 2.79 -2.02 1.40 1.01 -0.19 0.13 120.40 123.43 1qni s VAL 37 Ca 0.08 -0.82 0.08 0.00 0.00 0.00 0.00 61.98 61.32 1qni s VAL 37 Cb -0.12 -2.07 0.23 0.00 0.00 0.00 0.00 36.38 34.43 1qni s VAL 37 CO 0.01 0.58 1.21 -0.81 0.00 0.00 0.00 175.10 176.09 1qni n PRO 38 N 2.43 1.54 0.20 2.72 -0.04 -1.26 -0.86 135.00 139.73 1qni n PRO 38 Ca -0.17 -0.84 0.05 0.00 -0.04 0.00 0.00 63.50 62.50 1qni n PRO 38 Cb 0.52 -1.20 0.42 0.00 -0.04 0.00 0.00 33.50 33.20 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 1.39 0.00 -1.30 3.54 4.64 -1.78 -3.47 113.55 116.57 1qni h SER 39 Ca 0.00 0.00 -0.28 0.00 -0.47 0.00 0.00 61.79 61.04 1qni h SER 39 Cb 0.32 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.34 1qni h SER 39 CO 0.00 0.33 -0.30 0.23 -0.87 0.00 0.00 176.83 176.22 1qni n MET 40 N -3.87 -1.02 -3.57 4.77 2.81 0.34 -5.00 117.12 111.59 1qni n MET 40 Ca -0.01 0.82 -0.33 0.00 -1.81 0.00 0.00 57.70 56.36 1qni n MET 40 Cb 0.40 -4.99 -0.05 0.00 -0.71 0.00 0.00 33.22 27.88 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 -3.92 3.74 -0.46 0.03 0.52 -1.21 -4.84 118.95 112.81 1qni s ARG 41 Ca 0.00 0.13 -0.26 0.00 -0.52 0.00 0.00 55.73 55.07 1qni s ARG 41 Cb 0.00 -2.89 0.03 0.00 0.52 0.00 0.00 34.95 32.61 1qni s ARG 41 CO 0.00 0.49 0.98 -2.00 0.02 0.00 0.00 175.30 174.79 1qni s GLU 42 N -2.29 3.59 0.08 3.54 2.12 -1.26 -0.99 118.70 123.49 1qni s GLU 42 Ca 0.38 0.28 0.13 0.00 0.36 0.00 0.00 54.97 56.11 1qni s GLU 42 Cb -0.13 -3.92 -0.15 0.00 0.26 0.00 0.00 34.13 30.19 1qni s GLU 42 CO 0.21 -1.26 0.99 -0.07 -0.54 0.00 0.00 175.26 174.59 1qni h LEU 43 N 10.73 0.00 -7.00 2.70 3.38 -0.94 -3.49 115.31 120.70 1qni h LEU 43 Ca -0.24 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 -0.21 0.00 0.09 0.00 0.00 40.66 41.62 1qni h LEU 43 CO 1.05 0.82 0.39 -0.32 0.09 0.00 0.00 178.44 180.47 1qni s MET 44 N -2.77 0.81 -0.19 1.13 0.00 -0.91 -5.00 119.30 112.38 1qni s MET 44 Ca -0.01 0.14 -0.02 0.00 0.00 0.00 0.00 55.69 55.80 1qni s MET 44 Cb 0.09 0.38 -0.00 0.00 0.00 0.00 0.00 34.83 35.30 1qni s MET 44 CO 0.81 -0.26 -0.11 1.03 0.00 0.00 0.00 175.02 176.49 1qni s ARG 45 N -1.35 3.25 -0.41 4.11 0.52 -1.26 -0.12 118.95 123.70 1qni s ARG 45 Ca -0.05 -0.70 -0.11 0.00 -0.52 0.00 0.00 55.73 54.35 1qni s ARG 45 Cb -0.00 -2.81 0.06 0.00 0.52 0.00 0.00 34.95 32.71 1qni s ARG 45 CO 0.04 -0.14 0.26 0.42 0.02 0.00 0.00 175.30 175.90 1qni s ILE 46 N 1.25 4.54 0.30 1.52 1.01 0.74 -4.97 121.20 125.58 1qni s ILE 46 Ca 0.03 -1.13 -0.29 0.00 0.00 0.00 0.00 60.65 59.25 1qni s ILE 46 Cb -0.14 -3.67 -0.10 0.00 0.01 0.00 0.00 42.46 38.56 1qni s ILE 46 CO -0.05 -0.42 1.35 -2.16 0.00 0.00 0.00 174.94 173.66 1qni s PRO 47 N 1.51 4.33 0.01 2.79 0.04 -1.26 -1.24 135.00 141.17 1qni s PRO 47 Ca 0.03 2.24 0.00 0.00 0.04 0.00 0.00 61.00 63.31 1qni s PRO 47 Cb -0.22 -3.09 0.00 0.00 0.04 0.00 0.00 34.50 31.24 1qni s PRO 47 CO 0.05 -0.27 0.00 0.28 0.04 0.00 0.00 177.00 177.10 1qni n VAL 48 N 1.34 0.02 0.73 -0.36 0.31 -1.23 -4.40 118.33 114.74 1qni n VAL 48 Ca 0.02 0.01 0.08 0.00 -0.01 0.00 0.00 64.34 64.44 1qni n VAL 48 Cb 0.41 -0.54 -0.03 0.00 -0.91 0.00 0.00 33.84 32.78 1qni n VAL 48 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 1qni n PHE 49 N -2.53 0.00 -2.47 3.52 3.72 -0.69 -4.98 117.46 114.03 1qni n PHE 49 Ca 0.00 0.00 -0.23 0.00 -0.05 0.00 0.00 57.45 57.17 1qni n PHE 49 Cb 0.00 0.00 0.06 0.00 -0.94 0.00 0.00 39.48 38.60 1qni n PHE 49 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 1qni s ASN 50 N -2.10 4.93 -0.32 4.37 6.03 -1.25 -3.76 114.94 122.85 1qni s ASN 50 Ca 0.11 0.10 -0.06 0.00 -1.03 0.00 0.00 52.86 51.98 1qni s ASN 50 Cb 0.13 -0.81 0.03 0.00 -3.03 0.00 0.00 41.25 37.56 1qni s ASN 50 CO 0.49 -1.44 0.09 -0.69 -2.03 0.00 0.00 177.10 173.51 1qni s VAL 51 N -3.01 3.81 -0.41 3.54 1.01 -1.26 -4.69 120.40 119.39 1qni s VAL 51 Ca 0.60 -0.95 -0.20 0.00 0.00 0.00 0.00 61.98 61.43 1qni s VAL 51 Cb -0.10 -3.06 0.02 0.00 0.00 0.00 0.00 36.38 33.24 1qni s VAL 51 CO 0.42 -0.05 0.62 -0.62 0.00 0.00 0.00 175.10 175.47 1qni s ASP 52 N 1.44 6.34 0.64 3.32 2.15 -0.16 -4.95 116.67 125.45 1qni s ASP 52 Ca 0.00 -0.22 0.39 0.00 0.43 0.00 0.00 52.55 53.15 1qni s ASP 52 Cb -0.18 -2.31 2.21 0.00 -0.30 0.00 0.00 42.92 42.33 1qni s ASP 52 CO 0.02 -0.71 2.33 -1.28 -0.17 0.00 0.00 175.17 175.36 1qni h SER 53 N 8.75 0.00 0.00 -0.34 0.87 -1.95 0.14 113.55 121.03 1qni h SER 53 Ca -0.26 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.30 1qni h SER 53 Cb 1.10 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.06 1qni h SER 53 CO 0.87 0.00 -0.13 0.00 -0.53 0.00 0.00 176.83 177.04 1qni h ALA 54 N 2.00 0.00 0.00 6.23 0.00 -1.92 -3.39 119.26 122.18 1qni h ALA 54 Ca -0.00 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1qni h ALA 54 Cb 0.01 0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1qni h ALA 54 CO 0.00 0.13 0.00 1.79 0.00 0.00 0.00 179.25 181.17 1qni h THR 55 N -0.51 0.00 0.00 0.00 1.35 -1.89 -3.36 112.91 108.49 1qni h THR 55 Ca 0.00 -0.70 0.00 0.00 -0.55 0.00 0.00 66.41 65.16 1qni h THR 55 Cb 0.13 1.67 0.00 0.00 -1.73 0.00 0.00 68.15 68.22 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 0.67 0.57 3.66 5.82 0.00 0.03 -2.05 105.19 113.89 1qni n GLY 56 Ca 0.03 -0.39 -0.42 0.00 0.00 0.00 0.00 46.02 45.23 1qni n GLY 56 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1qni s TRP 57 N -2.00 1.63 0.00 1.61 -0.11 -1.18 0.10 118.94 119.00 1qni s TRP 57 Ca 0.00 -0.12 0.00 0.00 1.22 0.00 0.00 56.10 57.20 1qni s TRP 57 Cb 0.00 -4.08 0.00 0.00 -1.50 0.00 0.00 33.47 27.89 1qni s TRP 57 CO 0.00 -4.68 0.00 0.41 -4.62 0.00 0.00 176.95 168.06 1qni n GLY 58 N 4.35 0.93 0.00 5.86 0.00 -1.26 -0.98 105.19 114.08 1qni n GLY 58 Ca 0.19 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.20 1qni n GLY 58 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1qni n ILE 59 N -1.32 0.02 -1.68 -0.61 5.41 0.29 -4.84 119.36 116.63 1qni n ILE 59 Ca 0.00 -0.01 -0.32 0.00 1.00 0.00 0.00 62.75 63.42 1qni n ILE 59 Cb 0.00 -0.85 0.05 0.00 -0.71 0.00 0.00 39.64 38.13 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 -2.01 3.67 0.23 1.39 -4.23 0.57 -4.67 115.64 110.60 1qni s THR 60 Ca -0.00 0.66 0.20 0.00 -1.18 0.00 0.00 61.69 61.37 1qni s THR 60 Cb 0.00 -3.24 0.17 0.00 1.34 0.00 0.00 72.50 70.78 1qni s THR 60 CO 0.01 -0.60 1.82 0.78 -0.54 0.00 0.00 174.62 176.10 1qni h ASN 61 N -0.31 0.00 -0.13 3.99 -0.26 -1.60 -2.18 115.58 115.08 1qni h ASN 61 Ca -0.45 0.00 -0.16 0.00 -0.56 0.00 0.00 56.30 55.13 1qni h ASN 61 Cb 1.22 0.00 0.01 0.00 -1.06 0.00 0.00 38.32 38.49 1qni h ASN 61 CO 0.55 0.30 -0.55 -0.33 -1.06 0.00 0.00 177.43 176.34 1qni h GLU 62 N 0.00 0.60 -0.21 0.81 3.07 -1.91 -2.35 114.58 114.59 1qni h GLU 62 Ca -0.00 -0.47 -0.04 0.00 -0.50 0.00 0.00 59.36 58.34 1qni h GLU 62 Cb 0.74 0.09 -0.01 0.00 -0.84 0.00 0.00 28.75 28.74 1qni h GLU 62 CO 0.04 1.10 -0.02 0.66 -1.40 0.00 0.00 179.01 179.39 1qni h SER 63 N 0.24 0.38 -1.00 1.42 4.64 -1.88 -2.77 113.55 114.57 1qni h SER 63 Ca -0.03 -0.33 0.11 0.00 -0.47 0.00 0.00 61.79 61.07 1qni h SER 63 Cb 1.19 -0.10 -0.08 0.00 -0.31 0.00 0.00 62.40 63.09 1qni h SER 63 CO 0.12 0.62 0.63 0.11 -0.87 0.00 0.00 176.83 177.43 1qni h LYS 64 N 0.13 0.98 -0.63 4.77 1.57 -1.42 0.68 116.57 122.65 1qni h LYS 64 Ca 0.06 -0.06 -0.08 0.00 -1.87 0.00 0.00 60.65 58.69 1qni h LYS 64 Cb 0.43 -0.22 -0.02 0.00 0.08 0.00 0.00 32.23 32.50 1qni h LYS 64 CO 0.01 0.65 0.06 1.49 -0.57 0.00 0.00 179.45 181.10 1qni h GLU 65 N 1.01 1.07 -0.39 3.15 4.81 -1.30 -1.64 114.58 121.29 1qni h GLU 65 Ca 0.49 -0.31 -0.13 0.00 -0.13 0.00 0.00 59.36 59.28 1qni h GLU 65 Cb 0.45 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.70 1qni h GLU 65 CO -0.25 1.01 -0.26 0.82 -0.73 0.00 0.00 179.01 179.60 1qni h ILE 66 N 0.98 1.27 -0.02 2.32 2.04 -0.97 -2.78 117.51 120.36 1qni h ILE 66 Ca 0.19 -1.40 -0.06 0.00 1.00 0.00 0.00 64.86 64.59 1qni h ILE 66 Cb 0.49 1.25 -0.01 0.00 -0.74 0.00 0.00 36.82 37.81 1qni h ILE 66 CO 0.02 0.47 -0.26 -0.07 0.00 0.00 0.00 178.15 178.31 1qni h LEU 67 N 0.71 0.03 0.00 1.44 3.38 -0.71 -3.29 115.31 116.86 1qni h LEU 67 Ca 0.09 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1qni h LEU 67 Cb 0.80 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.54 1qni h LEU 67 CO 0.07 0.28 0.00 0.61 0.09 0.00 0.00 178.44 179.49 1qni n GLY 68 N -0.77 1.42 0.51 0.83 0.00 -0.63 -4.94 105.19 101.61 1qni n GLY 68 Ca -0.02 -0.42 0.02 0.00 0.00 0.00 0.00 46.02 45.60 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 -3.09 1.53 -0.02 0.00 -1.26 -4.66 105.19 97.69 1qni n GLY 69 Ca 0.00 -1.21 0.06 0.00 0.00 0.00 0.00 46.02 44.87 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 -2.23 4.53 -3.67 1.61 5.68 -1.26 -4.88 116.55 116.33 1qni n ASP 70 Ca -0.01 -2.65 -0.15 0.00 -0.50 0.00 0.00 54.79 51.48 1qni n ASP 70 Cb 0.19 -0.62 -0.08 0.00 -1.14 0.00 0.00 41.12 39.47 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 -2.25 0.75 -0.10 0.11 0.74 -1.26 -5.15 119.66 112.50 1qni s GLN 71 Ca 0.42 0.29 -0.20 0.00 0.05 0.00 0.00 55.36 55.91 1qni s GLN 71 Cb 0.31 0.35 -0.04 0.00 1.10 0.00 0.00 33.01 34.73 1qni s GLN 71 CO 0.14 -0.18 0.57 -1.14 -0.55 0.00 0.00 175.29 174.13 1qni s GLN 72 N -0.66 4.38 -0.21 1.67 0.74 -1.26 -5.04 119.66 119.28 1qni s GLN 72 Ca -0.08 0.63 0.00 0.00 0.05 0.00 0.00 55.36 55.97 1qni s GLN 72 Cb -0.03 -3.44 0.03 0.00 1.10 0.00 0.00 33.01 30.66 1qni s GLN 72 CO 0.04 0.12 -0.14 0.71 -0.55 0.00 0.00 175.29 175.48 1qni s TYR 73 N 0.68 2.95 -2.00 1.67 2.02 -1.26 -4.98 117.35 116.44 1qni s TYR 73 Ca 0.31 -1.67 0.25 0.00 -0.37 0.00 0.00 57.07 55.59 1qni s TYR 73 Cb -0.16 -1.97 1.48 0.00 -0.40 0.00 0.00 41.96 40.90 1qni s TYR 73 CO 0.14 -0.78 1.95 1.28 -1.57 0.00 0.00 175.55 176.57 1qni n LEU 74 N 4.62 0.00 -4.23 -1.29 4.77 -1.26 -4.86 117.00 114.74 1qni n LEU 74 Ca -0.18 0.00 -0.17 0.00 -0.03 0.00 0.00 56.01 55.63 1qni n LEU 74 Cb 0.48 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.49 1qni n LEU 74 CO 0.26 0.00 -0.09 0.54 -1.33 0.00 0.00 177.39 176.76 1qni s ASN 75 N -1.78 1.21 0.10 -1.43 6.03 -1.25 -4.27 114.94 113.55 1qni s ASN 75 Ca 0.37 -1.62 -0.22 0.00 -1.03 0.00 0.00 52.86 50.36 1qni s ASN 75 Cb 0.17 0.54 0.07 0.00 -3.03 0.00 0.00 41.25 39.00 1qni s ASN 75 CO 0.29 -1.05 1.01 0.61 -2.03 0.00 0.00 177.10 175.92 1qni n GLY 76 N -0.53 0.52 3.02 0.45 0.00 -1.26 -4.73 105.19 102.66 1qni n GLY 76 Ca 0.05 -1.09 -0.06 0.00 0.00 0.00 0.00 46.02 44.92 1qni n GLY 76 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1qni s ASP 77 N -3.32 -0.42 -0.01 1.61 2.15 -1.25 -4.15 116.67 111.28 1qni s ASP 77 Ca 0.23 -0.91 -0.15 0.00 0.43 0.00 0.00 52.55 52.15 1qni s ASP 77 Cb -0.02 1.40 -0.06 0.00 -0.30 0.00 0.00 42.92 43.95 1qni s ASP 77 CO 0.03 -0.23 0.41 0.00 -0.17 0.00 0.00 175.17 175.21 1qni n HIS 79 N 1.92 0.00 -4.03 0.00 8.25 -1.26 -1.33 115.22 118.76 1qni n HIS 79 Ca -0.14 0.00 -0.32 0.00 -0.26 0.00 0.00 57.72 57.01 1qni n HIS 79 Cb 0.52 0.00 -0.15 0.00 1.12 0.00 0.00 29.99 31.48 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 -1.79 3.09 -0.20 4.41 3.76 -1.26 -2.11 115.29 121.19 1qni s HIS 80 Ca 0.00 -2.24 -0.09 0.00 -0.15 0.00 0.00 55.06 52.58 1qni s HIS 80 Cb 0.00 -1.91 -0.05 0.00 1.11 0.00 0.00 32.58 31.73 1qni s HIS 80 CO 0.00 -0.86 0.11 -1.25 -0.85 0.00 0.00 174.74 171.89 1qni s PRO 81 N 1.16 4.11 -0.00 8.40 0.04 -1.26 -3.79 135.00 143.65 1qni s PRO 81 Ca -0.07 -0.27 0.00 0.00 0.04 0.00 0.00 61.00 60.71 1qni s PRO 81 Cb -0.20 -3.38 0.00 0.00 0.04 0.00 0.00 34.50 30.97 1qni s PRO 81 CO -0.06 0.25 -0.00 -1.01 0.04 0.00 0.00 177.00 176.23 1qni s HIS 82 N 0.48 0.03 0.10 0.56 3.76 -0.59 -4.51 115.29 115.13 1qni s HIS 82 Ca 0.07 0.00 -0.10 0.00 -0.15 0.00 0.00 55.06 54.88 1qni s HIS 82 Cb -0.12 -0.04 -0.06 0.00 1.11 0.00 0.00 32.58 33.48 1qni s HIS 82 CO -0.00 -0.01 0.43 -1.50 -0.85 0.00 0.00 174.74 172.81 1qni s ILE 83 N 0.08 5.05 0.83 0.60 2.07 -1.26 -0.60 121.20 127.97 1qni s ILE 83 Ca -0.01 0.49 -0.13 0.00 -1.41 0.00 0.00 60.65 59.60 1qni s ILE 83 Cb -0.01 -3.66 0.10 0.00 0.13 0.00 0.00 42.46 39.02 1qni s ILE 83 CO -0.00 0.24 1.20 -0.94 -1.91 0.00 0.00 174.94 173.53 1qni s SER 84 N -1.83 3.43 0.08 4.50 1.04 -0.11 -4.90 113.70 115.90 1qni s SER 84 Ca 0.35 2.35 -0.00 0.00 0.48 0.00 0.00 55.95 59.12 1qni s SER 84 Cb -0.14 -2.59 -0.04 0.00 0.10 0.00 0.00 66.02 63.36 1qni s SER 84 CO 0.19 -2.77 -0.02 -0.04 0.98 0.00 0.00 173.24 171.57 1qni s MET 85 N -4.23 0.72 -0.17 4.02 1.00 -1.26 -2.01 119.30 117.37 1qni s MET 85 Ca 0.72 -1.29 -0.04 0.00 0.00 0.00 0.00 55.69 55.09 1qni s MET 85 Cb -0.28 0.11 0.06 0.00 0.00 0.00 0.00 34.83 34.72 1qni s MET 85 CO 0.52 -0.11 0.06 0.99 0.00 0.00 0.00 175.02 176.48 1qni s THR 86 N -3.86 0.22 -1.20 2.05 2.01 0.07 -1.25 115.64 113.67 1qni s THR 86 Ca 0.11 -0.31 -0.07 0.00 0.31 0.00 0.00 61.69 61.73 1qni s THR 86 Cb 0.07 -0.77 0.01 0.00 0.01 0.00 0.00 72.50 71.83 1qni s THR 86 CO -0.07 -0.20 1.05 -0.67 -0.69 0.00 0.00 174.62 174.04 1qni n ASP 87 N 5.17 -5.49 -0.12 3.53 2.03 0.31 -2.75 116.55 119.23 1qni n ASP 87 Ca -0.08 -0.49 -0.02 0.00 0.52 0.00 0.00 54.79 54.72 1qni n ASP 87 Cb 0.48 -4.58 -0.01 0.00 -0.72 0.00 0.00 41.12 36.30 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 -1.77 0.52 3.21 0.27 0.00 0.02 -4.90 105.19 102.53 1qni n GLY 88 Ca -0.02 -0.40 -0.23 0.00 0.00 0.00 0.00 46.02 45.37 1qni n GLY 88 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1qni s ARG 89 N -1.19 1.12 0.09 1.61 0.52 -1.11 -1.36 118.95 118.63 1qni s ARG 89 Ca 0.00 -0.91 -0.31 0.00 -0.52 0.00 0.00 55.73 53.99 1qni s ARG 89 Cb 0.00 -1.21 -0.08 0.00 0.52 0.00 0.00 34.95 34.18 1qni s ARG 89 CO 0.00 0.30 1.48 0.71 0.02 0.00 0.00 175.30 177.81 1qni s TYR 90 N -0.93 2.94 -1.79 -0.53 2.02 -1.26 -0.75 117.35 117.05 1qni s TYR 90 Ca 0.04 0.73 0.20 0.00 -0.37 0.00 0.00 57.07 57.66 1qni s TYR 90 Cb -0.09 -3.78 -0.01 0.00 -0.40 0.00 0.00 41.96 37.68 1qni s TYR 90 CO 0.02 -2.90 0.98 -0.40 -1.57 0.00 0.00 175.55 171.69 1qni n ASP 91 N 4.66 1.86 -1.87 2.29 5.68 -0.85 -4.86 116.55 123.45 1qni n ASP 91 Ca 0.13 -1.43 -0.19 0.00 -0.50 0.00 0.00 54.79 52.81 1qni n ASP 91 Cb 0.42 0.47 -0.03 0.00 -1.14 0.00 0.00 41.12 40.84 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 1.30 0.38 0.07 6.12 0.00 -1.24 -4.86 105.19 106.95 1qni n GLY 92 Ca 0.08 -0.11 -0.05 0.00 0.00 0.00 0.00 46.02 45.94 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 -5.65 1.61 3.64 -1.86 -3.43 116.57 110.88 1qni h LYS 93 Ca -0.42 0.00 -0.56 0.00 -1.27 0.00 0.00 60.65 58.40 1qni h LYS 93 Cb 1.29 0.00 -0.14 0.00 -0.41 0.00 0.00 32.23 32.97 1qni h LYS 93 CO 0.53 0.09 -0.65 0.71 -2.27 0.00 0.00 179.45 177.87 1qni s TYR 94 N -2.11 2.24 -0.05 1.91 2.02 -1.26 -2.20 117.35 117.89 1qni s TYR 94 Ca -0.13 -0.66 -0.02 0.00 -0.37 0.00 0.00 57.07 55.89 1qni s TYR 94 Cb 0.02 -1.38 0.04 0.00 -0.40 0.00 0.00 41.96 40.23 1qni s TYR 94 CO 0.21 0.39 0.10 -1.17 -1.57 0.00 0.00 175.55 173.51 1qni s LEU 95 N -3.57 0.56 0.02 -1.29 0.20 -0.82 -0.93 118.68 112.86 1qni s LEU 95 Ca 0.33 0.20 0.05 0.00 0.69 0.00 0.00 54.13 55.40 1qni s LEU 95 Cb 0.05 0.14 -0.03 0.00 -0.43 0.00 0.00 46.19 45.92 1qni s LEU 95 CO 0.15 -0.18 -0.13 -0.36 -0.29 0.00 0.00 176.35 175.54 1qni s PHE 96 N 1.54 2.69 0.05 5.38 0.40 0.24 -0.39 117.98 127.90 1qni s PHE 96 Ca -0.04 -0.17 -0.06 0.00 -0.60 0.00 0.00 56.93 56.06 1qni s PHE 96 Cb -0.12 -1.53 -0.01 0.00 0.51 0.00 0.00 43.02 41.87 1qni s PHE 96 CO -0.05 0.30 0.12 -1.50 0.70 0.00 0.00 175.22 174.79 1qni s ILE 97 N -0.95 0.14 0.54 0.64 2.07 -0.54 -1.54 121.20 121.56 1qni s ILE 97 Ca 0.16 -1.19 0.01 0.00 -1.41 0.00 0.00 60.65 58.21 1qni s ILE 97 Cb -0.11 -1.12 0.03 0.00 0.13 0.00 0.00 42.46 41.40 1qni s ILE 97 CO 0.06 -0.66 0.76 0.54 -1.91 0.00 0.00 174.94 173.74 1qni s ASN 98 N -2.45 5.35 -0.30 4.50 2.20 -1.25 -0.45 114.94 122.55 1qni s ASN 98 Ca -0.00 0.03 -0.03 0.00 -0.94 0.00 0.00 52.86 51.92 1qni s ASN 98 Cb 0.02 -0.96 0.11 0.00 -2.00 0.00 0.00 41.25 38.42 1qni s ASN 98 CO -0.07 -1.09 0.17 -0.62 -2.94 0.00 0.00 177.10 172.56 1qni s ASP 99 N -4.40 3.06 0.46 3.54 2.15 -0.69 -3.61 116.67 117.18 1qni s ASP 99 Ca 0.56 -1.24 0.25 0.00 0.43 0.00 0.00 52.55 52.56 1qni s ASP 99 Cb -0.10 -0.15 0.59 0.00 -0.30 0.00 0.00 42.92 42.96 1qni s ASP 99 CO 0.38 -0.42 1.70 0.50 -0.17 0.00 0.00 175.17 177.17 1qni h LYS 100 N 8.27 0.00 0.03 4.34 3.64 -0.87 -2.68 116.57 129.29 1qni h LYS 100 Ca -0.16 0.00 -0.24 0.00 -1.27 0.00 0.00 60.65 58.98 1qni h LYS 100 Cb 1.02 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.85 1qni h LYS 100 CO 0.40 0.02 -1.01 0.00 -2.27 0.00 0.00 179.45 176.59 1qni h ALA 101 N 1.98 0.29 0.00 5.00 0.00 -1.87 -3.38 119.26 121.28 1qni h ALA 101 Ca -0.00 -0.74 -0.11 0.00 0.00 0.00 0.00 54.91 54.06 1qni h ALA 101 Cb 0.89 -0.01 -0.23 0.00 0.00 0.00 0.00 17.79 18.44 1qni h ALA 101 CO 0.00 0.83 -0.80 0.09 0.00 0.00 0.00 179.25 179.37 1qni n ASN 102 N -3.71 1.13 -3.33 0.00 3.02 -1.25 -4.98 115.26 106.13 1qni n ASN 102 Ca -0.07 -2.52 -0.20 0.00 -0.03 0.00 0.00 54.58 51.76 1qni n ASN 102 Cb 0.88 -0.35 0.01 0.00 -0.61 0.00 0.00 39.78 39.71 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 -0.04 -6.80 -4.04 3.41 -1.04 -1.03 -4.93 114.28 99.81 1qni n THR 103 Ca 0.09 0.18 -0.10 0.00 -2.04 0.00 0.00 64.05 62.18 1qni n THR 103 Cb 0.97 -5.00 -0.06 0.00 -1.82 0.00 0.00 70.33 64.42 1qni n THR 103 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 1qni s ARG 104 N -3.26 1.52 -0.01 -2.82 0.52 -1.09 -2.79 118.95 111.02 1qni s ARG 104 Ca 0.17 -1.37 -0.01 0.00 -0.52 0.00 0.00 55.73 54.01 1qni s ARG 104 Cb -0.03 0.43 0.01 0.00 0.52 0.00 0.00 34.95 35.88 1qni s ARG 104 CO 0.83 -0.61 0.03 0.08 0.02 0.00 0.00 175.30 175.65 1qni s VAL 105 N -3.95 -0.02 0.14 3.52 1.01 -0.43 -1.71 120.40 118.98 1qni s VAL 105 Ca 0.26 0.06 0.11 0.00 0.00 0.00 0.00 61.98 62.41 1qni s VAL 105 Cb 0.01 -0.06 -0.04 0.00 0.00 0.00 0.00 36.38 36.29 1qni s VAL 105 CO 0.11 0.03 -0.25 0.00 0.00 0.00 0.00 175.10 174.99 1qni s ALA 106 N 0.34 2.31 0.02 5.51 0.00 0.41 -1.34 121.76 129.00 1qni s ALA 106 Ca -0.03 -1.48 0.07 0.00 0.00 0.00 0.00 51.96 50.52 1qni s ALA 106 Cb -0.04 -0.33 -0.03 0.00 0.00 0.00 0.00 23.12 22.72 1qni s ALA 106 CO -0.01 0.46 -0.20 0.50 0.00 0.00 0.00 175.76 176.52 1qni s ARG 107 N -2.25 2.11 -0.06 0.00 3.52 0.10 -1.47 118.95 120.91 1qni s ARG 107 Ca 0.15 -0.94 0.02 0.00 -0.13 0.00 0.00 55.73 54.82 1qni s ARG 107 Cb -0.09 -2.17 0.02 0.00 -1.56 0.00 0.00 34.95 31.14 1qni s ARG 107 CO 0.07 0.55 -0.09 0.42 -0.81 0.00 0.00 175.30 175.44 1qni s ILE 108 N -0.84 0.92 -0.24 4.11 1.01 0.48 -0.08 121.20 126.56 1qni s ILE 108 Ca 0.13 -0.34 -0.29 0.00 0.00 0.00 0.00 60.65 60.15 1qni s ILE 108 Cb -0.10 -0.87 -0.00 0.00 0.01 0.00 0.00 42.46 41.50 1qni s ILE 108 CO 0.03 0.31 1.22 -0.13 0.00 0.00 0.00 174.94 176.37 1qni s ARG 109 N 0.80 4.11 0.22 2.79 0.52 -0.50 -1.94 118.95 124.95 1qni s ARG 109 Ca -0.13 1.40 0.26 0.00 -0.52 0.00 0.00 55.73 56.74 1qni s ARG 109 Cb -0.15 -3.78 0.83 0.00 0.52 0.00 0.00 34.95 32.37 1qni s ARG 109 CO 0.02 -0.86 1.77 1.28 0.02 0.00 0.00 175.30 177.52 1qni n LEU 110 N 6.95 0.81 0.18 2.53 4.77 -0.94 -0.46 117.00 130.85 1qni n LEU 110 Ca 0.14 0.59 0.02 0.00 -0.03 0.00 0.00 56.01 56.73 1qni n LEU 110 Cb 0.46 -0.36 0.34 0.00 -2.33 0.00 0.00 43.42 41.53 1qni n LEU 110 CO 0.58 -0.25 0.70 -2.24 -1.33 0.00 0.00 177.39 174.85 1qni h ASP 111 N 0.00 0.00 0.00 -1.43 2.03 -1.79 -3.28 116.42 111.95 1qni h ASP 111 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1qni h ASP 111 Cb 0.68 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.18 1qni h ASP 111 CO 0.00 0.40 0.00 2.30 -1.03 0.00 0.00 179.24 180.91 1qni n ILE 112 N -4.03 0.20 -3.57 4.15 -5.35 -1.20 -1.05 119.36 108.52 1qni n ILE 112 Ca -0.02 -0.37 -0.27 0.00 -0.27 0.00 0.00 62.75 61.82 1qni n ILE 112 Cb 0.43 1.19 0.05 0.00 -1.74 0.00 0.00 39.64 39.57 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 -0.10 -1.57 -3.90 6.28 2.81 0.39 -5.02 117.12 116.01 1qni n MET 113 Ca 0.00 0.57 -0.11 0.00 -1.81 0.00 0.00 57.70 56.35 1qni n MET 113 Cb 0.21 -4.61 -0.11 0.00 -0.71 0.00 0.00 33.22 28.00 1qni n MET 113 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 1qni s LYS 114 N -5.55 0.30 -0.01 0.03 -0.14 -1.04 -4.84 119.74 108.49 1qni s LYS 114 Ca 0.46 -0.33 -0.30 0.00 -1.36 0.00 0.00 55.97 54.45 1qni s LYS 114 Cb -0.14 0.12 -0.07 0.00 -1.68 0.00 0.00 37.83 36.06 1qni s LYS 114 CO 0.83 -0.06 1.78 0.99 -0.76 0.00 0.00 175.35 178.13 1qni s THR 115 N -0.98 3.34 -0.12 2.17 2.01 -1.26 -1.41 115.64 119.39 1qni s THR 115 Ca -0.11 0.43 -0.05 0.00 0.31 0.00 0.00 61.69 62.27 1qni s THR 115 Cb -0.06 -3.27 -0.02 0.00 0.01 0.00 0.00 72.50 69.16 1qni s THR 115 CO 0.00 -0.04 -0.09 -0.78 -0.69 0.00 0.00 174.62 173.02 1qni h ASP 116 N 9.91 0.00 -4.36 3.53 3.58 -0.82 -3.47 116.42 124.79 1qni h ASP 116 Ca -0.43 0.00 -0.35 0.00 0.42 0.00 0.00 57.03 56.66 1qni h ASP 116 Cb 1.20 0.00 -0.19 0.00 1.72 0.00 0.00 39.33 42.06 1qni h ASP 116 CO 0.95 0.62 -0.75 -0.54 -2.88 0.00 0.00 179.24 176.64 1qni s LYS 117 N -1.89 0.85 -0.04 0.28 -0.14 -1.10 -4.94 119.74 112.76 1qni s LYS 117 Ca -0.08 -1.10 0.00 0.00 -1.36 0.00 0.00 55.97 53.43 1qni s LYS 117 Cb 0.01 -0.64 0.02 0.00 -1.68 0.00 0.00 37.83 35.54 1qni s LYS 117 CO 0.11 0.12 -0.02 0.42 -0.76 0.00 0.00 175.35 175.22 1qni s ILE 118 N -2.08 0.35 -0.03 2.17 1.01 -1.24 -0.72 121.20 120.66 1qni s ILE 118 Ca 0.03 0.01 0.04 0.00 0.00 0.00 0.00 60.65 60.73 1qni s ILE 118 Cb -0.05 -0.43 -0.00 0.00 0.01 0.00 0.00 42.46 41.99 1qni s ILE 118 CO 0.01 0.20 -0.14 -0.89 0.00 0.00 0.00 174.94 174.12 1qni s THR 119 N 1.15 1.16 -0.15 2.92 2.01 -0.45 -4.87 115.64 117.42 1qni s THR 119 Ca -0.08 -0.58 -0.21 0.00 0.31 0.00 0.00 61.69 61.13 1qni s THR 119 Cb -0.14 -1.01 -0.03 0.00 0.01 0.00 0.00 72.50 71.34 1qni s THR 119 CO -0.02 0.34 0.64 -1.00 -0.69 0.00 0.00 174.62 173.89 1qni s HIS 120 N 0.05 3.45 -0.12 4.92 3.76 -1.26 -1.31 115.29 124.78 1qni s HIS 120 Ca -0.02 1.02 -0.27 0.00 -0.15 0.00 0.00 55.06 55.64 1qni s HIS 120 Cb -0.10 -2.77 -0.02 0.00 1.11 0.00 0.00 32.58 30.80 1qni s HIS 120 CO 0.01 -0.06 0.88 0.42 -0.85 0.00 0.00 174.74 175.15 1qni s ILE 121 N 1.45 4.87 0.44 0.60 -1.09 -1.12 -5.00 121.20 121.34 1qni s ILE 121 Ca 0.31 1.78 -0.11 0.00 -2.23 0.00 0.00 60.65 60.40 1qni s ILE 121 Cb -0.16 -4.20 -0.06 0.00 -1.58 0.00 0.00 42.46 36.46 1qni s ILE 121 CO 0.12 0.06 0.82 -2.16 -1.23 0.00 0.00 174.94 172.55 1qni s PRO 122 N 1.85 3.79 -1.31 2.79 0.04 -1.26 -4.36 135.00 136.54 1qni s PRO 122 Ca 0.42 0.54 -0.12 0.00 0.04 0.00 0.00 61.00 61.88 1qni s PRO 122 Cb -0.18 -2.33 0.11 0.00 0.04 0.00 0.00 34.50 32.14 1qni s PRO 122 CO 0.16 -0.11 0.50 0.09 0.04 0.00 0.00 177.00 177.69 1qni n ASN 123 N -1.46 -2.99 -3.78 6.66 3.02 -1.26 -4.91 115.26 110.54 1qni n ASN 123 Ca 0.03 -0.54 -0.11 0.00 -0.03 0.00 0.00 54.58 53.93 1qni n ASN 123 Cb 0.54 -2.50 -0.05 0.00 -0.61 0.00 0.00 39.78 37.16 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 -2.93 0.00 -0.02 2.41 0.11 -1.26 -4.82 120.40 113.88 1qni s VAL 124 Ca 0.49 -1.47 -0.05 0.00 -2.93 0.00 0.00 61.98 58.02 1qni s VAL 124 Cb -0.27 -2.37 0.00 0.00 -1.53 0.00 0.00 36.38 32.22 1qni s VAL 124 CO 0.60 0.00 0.10 -1.58 -3.33 0.00 0.00 175.10 170.90 1qni s GLN 125 N -3.71 0.29 -0.30 1.54 0.74 -1.26 -5.00 119.66 111.97 1qni s GLN 125 Ca 0.25 -0.16 -0.06 0.00 0.05 0.00 0.00 55.36 55.44 1qni s GLN 125 Cb -0.00 0.12 0.01 0.00 1.10 0.00 0.00 33.01 34.24 1qni s GLN 125 CO 0.12 -0.06 0.17 0.00 -0.55 0.00 0.00 175.29 174.98 1qni n ALA 126 N 2.22 -3.11 -2.47 1.58 0.00 -1.26 -2.68 120.51 114.78 1qni n ALA 126 Ca -0.18 0.58 -0.43 0.00 0.00 0.00 0.00 53.44 53.41 1qni n ALA 126 Cb 0.57 -1.64 -0.02 0.00 0.00 0.00 0.00 19.45 18.36 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 -1.76 4.31 0.00 0.00 -1.09 -1.24 -0.36 121.20 121.05 1qni s ILE 127 Ca 0.08 1.54 0.00 0.00 -2.23 0.00 0.00 60.65 60.04 1qni s ILE 127 Cb -0.02 -4.13 0.00 0.00 -1.58 0.00 0.00 42.46 36.73 1qni s ILE 127 CO 0.68 -0.29 0.00 1.57 -1.23 0.00 0.00 174.94 175.67 1qni n HIS 128 N 6.94 0.00 -1.73 3.97 -0.00 -0.51 -2.58 115.22 121.30 1qni n HIS 128 Ca 0.14 0.00 -0.42 0.00 0.46 0.00 0.00 57.72 57.90 1qni n HIS 128 Cb 0.46 0.00 -0.00 0.00 -0.12 0.00 0.00 29.99 30.32 1qni n HIS 128 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1qni n GLY 129 N 4.17 0.83 3.61 1.57 0.00 0.14 -4.68 105.19 110.83 1qni n GLY 129 Ca 0.00 0.31 -0.08 0.00 0.00 0.00 0.00 46.02 46.25 1qni n GLY 129 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1qni s LEU 130 N -1.46 -0.86 0.19 0.99 0.20 -1.26 -0.22 118.68 116.26 1qni s LEU 130 Ca 0.55 1.47 -0.22 0.00 0.69 0.00 0.00 54.13 56.61 1qni s LEU 130 Cb -0.53 2.33 0.06 0.00 -0.43 0.00 0.00 46.19 47.61 1qni s LEU 130 CO 0.63 -0.24 0.63 -0.13 -0.29 0.00 0.00 176.35 176.95 1qni s ARG 131 N 1.47 1.43 0.27 1.98 0.52 -0.39 -4.86 118.95 119.36 1qni s ARG 131 Ca -0.09 -0.62 0.07 0.00 -0.52 0.00 0.00 55.73 54.57 1qni s ARG 131 Cb -0.05 0.59 -0.03 0.00 0.52 0.00 0.00 34.95 35.98 1qni s ARG 131 CO -0.17 -0.63 0.24 -0.51 0.02 0.00 0.00 175.30 174.24 1qni s LEU 132 N -2.80 3.81 0.34 2.53 1.43 -1.26 -1.47 118.68 121.26 1qni s LEU 132 Ca 0.04 -0.28 -0.27 0.00 -1.03 0.00 0.00 54.13 52.59 1qni s LEU 132 Cb -0.02 -2.37 -0.09 0.00 0.03 0.00 0.00 46.19 43.74 1qni s LEU 132 CO -0.07 -0.12 1.11 -1.58 0.23 0.00 0.00 176.35 175.92 1qni s GLN 133 N -3.90 4.35 -0.18 1.70 0.74 -1.02 -4.49 119.66 116.86 1qni s GLN 133 Ca 0.35 1.76 0.05 0.00 0.05 0.00 0.00 55.36 57.56 1qni s GLN 133 Cb -0.08 -2.88 -0.14 0.00 1.10 0.00 0.00 33.01 31.01 1qni s GLN 133 CO 0.26 -0.04 -0.11 1.63 -0.55 0.00 0.00 175.29 176.48 1qni n LYS 134 N 0.55 0.76 -4.54 1.67 5.02 -1.26 -3.55 118.16 116.82 1qni n LYS 134 Ca 0.02 0.08 -0.21 0.00 -2.02 0.00 0.00 58.31 56.18 1qni n LYS 134 Cb 0.46 -1.39 -0.15 0.00 -0.02 0.00 0.00 35.03 33.93 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 -2.38 0.97 -0.19 -0.18 1.01 -1.26 -0.80 120.40 117.57 1qni s VAL 135 Ca -0.21 -0.55 0.29 0.00 0.00 0.00 0.00 61.98 61.51 1qni s VAL 135 Cb 0.06 -0.82 0.33 0.00 0.00 0.00 0.00 36.38 35.96 1qni s VAL 135 CO 0.49 0.26 1.85 -0.65 0.00 0.00 0.00 175.10 177.05 1qni h PRO 136 N 5.79 0.00 -2.23 2.72 0.11 -1.95 -3.02 132.00 133.41 1qni h PRO 136 Ca -0.33 0.00 0.28 0.00 0.11 0.00 0.00 66.00 66.06 1qni h PRO 136 Cb 1.17 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.22 1qni h PRO 136 CO 0.49 0.00 0.79 -1.59 -0.21 0.00 0.00 178.00 177.48 1qni s LYS 137 N -3.48 0.70 -0.98 1.05 -2.85 -1.23 -0.53 119.74 112.43 1qni s LYS 137 Ca 0.03 -0.45 -0.24 0.00 -1.00 0.00 0.00 55.97 54.32 1qni s LYS 137 Cb 0.09 0.20 0.05 0.00 -2.06 0.00 0.00 37.83 36.10 1qni s LYS 137 CO 0.50 -0.33 1.43 0.99 0.10 0.00 0.00 175.35 178.04 1qni s THR 138 N -2.10 3.89 -0.18 3.79 2.01 -0.38 -4.35 115.64 118.33 1qni s THR 138 Ca 0.26 -0.60 0.16 0.00 0.31 0.00 0.00 61.69 61.82 1qni s THR 138 Cb -0.01 -5.04 -0.22 0.00 0.01 0.00 0.00 72.50 67.24 1qni s THR 138 CO 0.01 -1.93 0.06 0.59 -0.69 0.00 0.00 174.62 172.66 1qni n ASN 139 N 8.98 0.60 -4.42 3.53 5.03 -1.26 -4.66 115.26 123.06 1qni n ASN 139 Ca 0.29 -0.00 -0.30 0.00 0.87 0.00 0.00 54.58 55.43 1qni n ASN 139 Cb 0.51 0.92 -0.13 0.00 -1.02 0.00 0.00 39.78 40.06 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 -2.43 2.47 -0.21 3.10 2.02 -1.26 -1.44 117.35 119.59 1qni s TYR 140 Ca -0.09 -0.32 0.01 0.00 -0.37 0.00 0.00 57.07 56.30 1qni s TYR 140 Cb 0.05 -1.43 0.03 0.00 -0.40 0.00 0.00 41.96 40.21 1qni s TYR 140 CO 0.73 0.21 -0.15 0.08 -1.57 0.00 0.00 175.55 174.86 1qni s VAL 141 N -0.89 2.33 -0.23 0.71 1.01 0.45 -2.42 120.40 121.36 1qni s VAL 141 Ca 0.14 -1.05 -0.10 0.00 0.00 0.00 0.00 61.98 60.96 1qni s VAL 141 Cb -0.10 -2.10 -0.05 0.00 0.00 0.00 0.00 36.38 34.13 1qni s VAL 141 CO 0.04 0.36 0.15 -0.36 0.00 0.00 0.00 175.10 175.29 1qni s PHE 142 N 1.28 3.34 0.02 5.22 0.08 -0.54 -0.75 117.98 126.62 1qni s PHE 142 Ca 0.02 0.25 0.03 0.00 0.12 0.00 0.00 56.93 57.34 1qni s PHE 142 Cb -0.15 -2.23 -0.01 0.00 -0.57 0.00 0.00 43.02 40.06 1qni s PHE 142 CO -0.09 0.14 -0.08 0.00 -0.10 0.00 0.00 175.22 175.09 1qni s ASN 144 N -0.73 6.23 -0.22 0.00 0.02 0.69 -1.70 114.94 119.23 1qni s ASN 144 Ca -0.01 0.18 -0.04 0.00 -1.02 0.00 0.00 52.86 51.97 1qni s ASN 144 Cb -0.06 -1.87 -0.01 0.00 0.02 0.00 0.00 41.25 39.34 1qni s ASN 144 CO 0.00 0.11 -0.05 0.00 0.02 0.00 0.00 177.10 177.18 1qni s ALA 145 N -1.62 2.79 -0.00 0.60 0.00 -1.23 -1.42 121.76 120.87 1qni s ALA 145 Ca 0.34 -1.16 -0.21 0.00 0.00 0.00 0.00 51.96 50.93 1qni s ALA 145 Cb -0.12 -1.66 -0.21 0.00 0.00 0.00 0.00 23.12 21.12 1qni s ALA 145 CO 0.27 -0.40 1.13 1.49 0.00 0.00 0.00 175.76 178.25 1qni h GLU 146 N 8.05 0.35 -5.99 0.00 4.81 -0.48 -3.29 114.58 118.04 1qni h GLU 146 Ca -0.41 -0.33 -0.58 0.00 -0.13 0.00 0.00 59.36 57.91 1qni h GLU 146 Cb 1.16 0.08 -0.06 0.00 0.63 0.00 0.00 28.75 30.56 1qni h GLU 146 CO 0.60 0.99 -0.10 -0.06 -0.73 0.00 0.00 179.01 179.72 1qni s PHE 147 N -3.40 3.67 0.12 0.92 0.08 -1.18 -4.18 117.98 114.00 1qni s PHE 147 Ca -0.14 1.07 -0.23 0.00 0.12 0.00 0.00 56.93 57.75 1qni s PHE 147 Cb 0.03 -2.50 -0.07 0.00 -0.57 0.00 0.00 43.02 39.92 1qni s PHE 147 CO 0.79 0.41 0.69 0.14 -0.10 0.00 0.00 175.22 177.15 1qni s VAL 148 N -0.32 4.55 0.08 -0.44 -7.23 -1.26 -4.18 120.40 111.60 1qni s VAL 148 Ca 0.27 1.50 -0.05 0.00 -1.81 0.00 0.00 61.98 61.90 1qni s VAL 148 Cb -0.17 -4.04 -0.02 0.00 0.56 0.00 0.00 36.38 32.71 1qni s VAL 148 CO 0.15 0.52 0.09 0.27 -0.31 0.00 0.00 175.10 175.82 1qni s ILE 149 N -1.01 0.17 0.69 -0.62 -4.36 0.35 -4.67 121.20 111.74 1qni s ILE 149 Ca 0.33 -1.53 -0.17 0.00 -0.26 0.00 0.00 60.65 59.03 1qni s ILE 149 Cb -0.21 -1.51 0.01 0.00 1.25 0.00 0.00 42.46 42.00 1qni s ILE 149 CO 0.23 -0.76 1.27 -2.16 0.24 0.00 0.00 174.94 173.76 1qni s PRO 150 N -3.91 2.33 -0.29 0.37 0.04 -1.26 0.14 135.00 132.42 1qni s PRO 150 Ca 0.08 1.99 0.02 0.00 0.04 0.00 0.00 61.00 63.14 1qni s PRO 150 Cb 0.06 -1.83 0.08 0.00 0.04 0.00 0.00 34.50 32.86 1qni s PRO 150 CO -0.09 -1.75 -0.00 -0.65 0.04 0.00 0.00 177.00 174.55 1qni s GLN 151 N -3.56 1.58 0.46 4.56 -0.21 -1.26 -1.16 119.66 120.07 1qni s GLN 151 Ca 0.80 -1.45 -0.14 0.00 0.02 0.00 0.00 55.36 54.60 1qni s GLN 151 Cb -0.35 -2.83 -0.07 0.00 1.00 0.00 0.00 33.01 30.75 1qni s GLN 151 CO 0.42 -0.78 0.88 -1.25 -2.12 0.00 0.00 175.29 172.44 1qni s PRO 152 N 1.15 3.88 -1.38 2.91 0.04 -1.26 -5.02 135.00 135.32 1qni s PRO 152 Ca 0.02 0.73 -0.12 0.00 0.04 0.00 0.00 61.00 61.68 1qni s PRO 152 Cb -0.19 -2.26 0.09 0.00 0.04 0.00 0.00 34.50 32.18 1qni s PRO 152 CO -0.09 -0.14 2.11 -1.71 0.04 0.00 0.00 177.00 177.20 1qni n ASN 153 N -1.38 4.71 -0.93 6.66 5.15 -0.31 -4.64 115.26 124.52 1qni n ASN 153 Ca 0.05 -2.96 0.11 0.00 -0.60 0.00 0.00 54.58 51.18 1qni n ASN 153 Cb 0.54 -1.57 0.27 0.00 -0.53 0.00 0.00 39.78 38.49 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 4.89 2.78 -0.14 1.20 5.68 -1.26 -4.94 116.55 124.75 1qni n ASP 154 Ca 0.48 -1.90 -0.01 0.00 -0.50 0.00 0.00 54.79 52.86 1qni n ASP 154 Cb 0.37 -0.20 -0.00 0.00 -1.14 0.00 0.00 41.12 40.15 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 1.36 0.37 0.00 6.12 0.00 -1.26 -4.93 105.19 106.85 1qni n GLY 155 Ca 0.18 -0.90 0.07 0.00 0.00 0.00 0.00 46.02 45.37 1qni n GLY 155 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1qni n THR 156 N -3.64 0.00 -3.15 2.61 -2.24 -1.26 -4.89 114.28 101.71 1qni n THR 156 Ca -0.02 -0.15 0.04 0.00 -2.27 0.00 0.00 64.05 61.65 1qni n THR 156 Cb 0.35 0.99 -0.01 0.00 -2.10 0.00 0.00 70.33 69.57 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 -2.42 -1.46 0.06 3.42 2.15 -1.26 -5.03 116.67 112.12 1qni s ASP 157 Ca 0.06 0.62 0.25 0.00 0.43 0.00 0.00 52.55 53.91 1qni s ASP 157 Cb 0.11 2.11 0.54 0.00 -0.30 0.00 0.00 42.92 45.38 1qni s ASP 157 CO 0.61 -0.27 1.45 0.49 -0.17 0.00 0.00 175.17 177.28 1qni n PHE 158 N 5.43 0.26 -1.56 -5.34 3.72 -1.26 -4.69 117.46 114.01 1qni n PHE 158 Ca 0.01 0.07 -0.53 0.00 -0.05 0.00 0.00 57.45 56.96 1qni n PHE 158 Cb 0.52 -0.47 -0.06 0.00 -0.94 0.00 0.00 39.48 38.53 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 -1.77 1.03 0.27 4.37 3.41 -1.26 -4.83 113.62 114.84 1qni n SER 159 Ca 0.05 1.14 0.18 0.00 -0.26 0.00 0.00 58.87 59.97 1qni n SER 159 Cb 0.38 -1.12 0.74 0.00 -0.26 0.00 0.00 64.21 63.95 1qni n SER 159 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1qni h LEU 160 N 3.71 0.00 -1.26 1.04 3.38 -1.93 -2.93 115.31 117.33 1qni h LEU 160 Ca -0.46 0.00 0.06 0.00 0.09 0.00 0.00 57.88 57.56 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 0.72 0.00 0.53 0.44 0.09 0.00 0.00 178.44 180.22 1qni h ASP 161 N 0.00 0.80 -0.39 -0.43 5.19 -1.89 -2.28 116.42 117.42 1qni h ASP 161 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1qni h ASP 161 Cb 0.43 -0.17 0.00 0.00 0.18 0.00 0.00 39.33 39.77 1qni h ASP 161 CO 0.00 0.52 0.00 0.59 -3.12 0.00 0.00 179.24 177.23 1qni n ASN 162 N -4.48 3.37 -4.71 6.45 3.02 -1.11 -4.96 115.26 112.84 1qni n ASN 162 Ca 0.12 -2.24 -0.39 0.00 -0.03 0.00 0.00 54.58 52.04 1qni n ASN 162 Cb 0.19 -0.34 -0.05 0.00 -0.61 0.00 0.00 39.78 38.96 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 -1.17 6.85 0.19 6.41 0.01 -0.86 -4.01 113.70 121.12 1qni s SER 163 Ca 0.31 1.02 0.02 0.00 1.31 0.00 0.00 55.95 58.62 1qni s SER 163 Cb 0.19 -2.37 -0.01 0.00 0.21 0.00 0.00 66.02 64.05 1qni s SER 163 CO 0.17 -0.12 0.09 -1.22 0.41 0.00 0.00 173.24 172.57 1qni n TYR 164 N 4.03 -0.05 -4.03 2.43 4.02 0.12 -4.55 117.16 119.13 1qni n TYR 164 Ca -0.03 -1.32 -0.10 0.00 -0.01 0.00 0.00 57.90 56.45 1qni n TYR 164 Cb 0.51 0.04 -0.07 0.00 -0.02 0.00 0.00 39.34 39.80 1qni n TYR 164 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 176.86 175.77 1qni s THR 165 N -2.40 0.02 0.06 -0.72 -1.32 -1.26 0.13 115.64 110.15 1qni s THR 165 Ca 0.13 -1.52 -0.00 0.00 -1.21 0.00 0.00 61.69 59.08 1qni s THR 165 Cb 0.01 -2.17 -0.04 0.00 -1.51 0.00 0.00 72.50 68.79 1qni s THR 165 CO 0.09 -0.07 -0.04 -0.04 -2.21 0.00 0.00 174.62 172.35 1qni s MET 166 N -4.03 0.67 -0.25 7.08 -1.94 -1.26 -2.99 119.30 116.58 1qni s MET 166 Ca 0.25 -1.23 -0.13 0.00 -1.71 0.00 0.00 55.69 52.86 1qni s MET 166 Cb 0.02 0.07 -0.04 0.00 2.01 0.00 0.00 34.83 36.89 1qni s MET 166 CO 0.07 -0.08 0.28 0.12 -0.01 0.00 0.00 175.02 175.41 1qni s PHE 167 N -3.74 3.29 -0.05 -0.03 5.36 0.24 -3.47 117.98 119.59 1qni s PHE 167 Ca 0.08 0.35 -0.01 0.00 -0.96 0.00 0.00 56.93 56.39 1qni s PHE 167 Cb 0.06 -2.43 -0.04 0.00 -0.34 0.00 0.00 43.02 40.27 1qni s PHE 167 CO -0.08 -0.07 0.03 0.99 -1.46 0.00 0.00 175.22 174.63 1qni s THR 168 N 1.52 4.49 -0.11 0.12 2.01 -0.69 -0.19 115.64 122.79 1qni s THR 168 Ca 0.12 -0.33 0.03 0.00 0.31 0.00 0.00 61.69 61.83 1qni s THR 168 Cb -0.15 -2.96 0.00 0.00 0.01 0.00 0.00 72.50 69.40 1qni s THR 168 CO 0.08 0.49 -0.23 0.00 -0.69 0.00 0.00 174.62 174.27 1qni s ALA 169 N -1.02 2.19 -0.07 7.40 0.00 -0.16 -1.78 121.76 128.32 1qni s ALA 169 Ca 0.17 -1.01 0.05 0.00 0.00 0.00 0.00 51.96 51.18 1qni s ALA 169 Cb -0.12 -0.87 -0.01 0.00 0.00 0.00 0.00 23.12 22.12 1qni s ALA 169 CO 0.07 0.18 -0.24 0.42 0.00 0.00 0.00 175.76 176.19 1qni s ILE 170 N 0.50 2.09 -0.29 0.00 1.01 0.07 0.38 121.20 124.96 1qni s ILE 170 Ca -0.15 -1.04 -0.29 0.00 0.00 0.00 0.00 60.65 59.17 1qni s ILE 170 Cb -0.17 -1.76 -0.02 0.00 0.01 0.00 0.00 42.46 40.51 1qni s ILE 170 CO 0.05 0.57 1.77 -0.62 0.00 0.00 0.00 174.94 176.71 1qni s ASP 171 N -0.04 6.01 0.20 3.58 2.15 -0.80 -0.41 116.67 127.37 1qni s ASP 171 Ca -0.07 1.43 -0.13 0.00 0.43 0.00 0.00 52.55 54.21 1qni s ASP 171 Cb -0.15 -2.53 0.23 0.00 -0.30 0.00 0.00 42.92 40.17 1qni s ASP 171 CO 0.05 -1.59 1.65 0.00 -0.17 0.00 0.00 175.17 175.11 1qni h ALA 172 N 12.36 0.45 0.00 3.66 0.00 -1.52 0.56 119.26 134.77 1qni h ALA 172 Ca -0.34 0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 1qni h ALA 172 Cb 1.17 0.40 -0.00 0.00 0.00 0.00 0.00 17.79 19.35 1qni h ALA 172 CO 1.02 -0.42 -0.02 0.93 0.00 0.00 0.00 179.25 180.76 1qni h GLU 173 N 0.04 0.00 0.00 0.00 4.39 -1.84 -3.31 114.58 113.85 1qni h GLU 173 Ca 0.29 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.99 1qni h GLU 173 Cb 0.45 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.10 1qni h GLU 173 CO -0.56 0.02 -1.00 2.41 -1.16 0.00 0.00 179.01 178.72 1qni n THR 174 N -3.12 0.00 -1.84 1.13 -1.04 -0.93 -5.02 114.28 103.47 1qni n THR 174 Ca 0.01 -0.12 -0.19 0.00 -2.04 0.00 0.00 64.05 61.71 1qni n THR 174 Cb 0.32 0.51 -0.06 0.00 -1.82 0.00 0.00 70.33 69.29 1qni n THR 174 CO 0.00 0.00 0.00 0.23 -0.64 0.00 0.00 175.07 174.66 1qni n MET 175 N -1.53 -1.39 -4.00 -2.82 2.81 0.19 -5.00 117.12 105.39 1qni n MET 175 Ca -0.00 1.08 -0.36 0.00 -1.81 0.00 0.00 57.70 56.60 1qni n MET 175 Cb 0.07 -5.47 -0.07 0.00 -0.71 0.00 0.00 33.22 27.04 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 -2.57 6.04 0.17 7.83 1.01 -1.25 -4.76 116.67 123.14 1qni s ASP 176 Ca 0.00 0.35 -0.32 0.00 0.71 0.00 0.00 52.55 53.29 1qni s ASP 176 Cb 0.00 -1.91 -0.11 0.00 1.01 0.00 0.00 42.92 41.91 1qni s ASP 176 CO 0.00 0.37 1.73 -0.69 0.21 0.00 0.00 175.17 176.79 1qni s VAL 177 N -0.82 2.33 -0.17 -1.27 1.01 -1.26 -1.89 120.40 118.33 1qni s VAL 177 Ca 0.13 0.12 -0.26 0.00 0.00 0.00 0.00 61.98 61.97 1qni s VAL 177 Cb -0.12 -3.07 -0.23 0.00 0.00 0.00 0.00 36.38 32.96 1qni s VAL 177 CO 0.03 0.01 0.54 0.00 0.00 0.00 0.00 175.10 175.67 1qni h ALA 178 N 7.47 0.10 -2.12 5.51 0.00 -0.40 -3.46 119.26 126.35 1qni h ALA 178 Ca -0.44 -0.77 0.17 0.00 0.00 0.00 0.00 54.91 53.87 1qni h ALA 178 Cb 1.21 0.29 -0.13 0.00 0.00 0.00 0.00 17.79 19.15 1qni h ALA 178 CO 0.95 0.28 0.56 1.67 0.00 0.00 0.00 179.25 182.70 1qni s TRP 179 N -2.27 -0.23 0.08 0.00 1.48 -1.12 -4.25 118.94 112.64 1qni s TRP 179 Ca -0.22 0.06 0.06 0.00 -1.06 0.00 0.00 56.10 54.94 1qni s TRP 179 Cb 0.00 0.57 -0.03 0.00 -1.16 0.00 0.00 33.47 32.85 1qni s TRP 179 CO 0.64 -0.56 -0.17 -0.65 -4.06 0.00 0.00 176.95 172.15 1qni s GLN 180 N -3.02 0.99 -0.16 3.25 -0.21 -0.44 -0.99 119.66 119.08 1qni s GLN 180 Ca 0.08 -1.01 0.01 0.00 0.02 0.00 0.00 55.36 54.46 1qni s GLN 180 Cb -0.01 -1.10 0.02 0.00 1.00 0.00 0.00 33.01 32.92 1qni s GLN 180 CO -0.05 0.26 -0.16 0.08 -2.12 0.00 0.00 175.29 173.30 1qni s VAL 181 N -1.15 1.70 0.45 1.09 1.01 0.74 -1.61 120.40 122.62 1qni s VAL 181 Ca 0.02 -0.71 -0.23 0.00 0.00 0.00 0.00 61.98 61.06 1qni s VAL 181 Cb -0.10 -1.57 -0.08 0.00 0.00 0.00 0.00 36.38 34.63 1qni s VAL 181 CO 0.03 0.48 1.11 -0.63 0.00 0.00 0.00 175.10 176.09 1qni s ILE 182 N 1.42 3.37 0.18 2.22 1.01 -0.36 -0.59 121.20 128.44 1qni s ILE 182 Ca 0.05 1.00 -0.05 0.00 0.00 0.00 0.00 60.65 61.65 1qni s ILE 182 Cb -0.13 -3.49 -0.03 0.00 0.01 0.00 0.00 42.46 38.82 1qni s ILE 182 CO -0.11 -0.04 0.20 0.68 0.00 0.00 0.00 174.94 175.67 1qni s VAL 183 N -1.64 0.05 0.50 2.92 -7.23 -1.16 -0.96 120.40 112.87 1qni s VAL 183 Ca 0.63 -1.72 -0.05 0.00 -1.81 0.00 0.00 61.98 59.02 1qni s VAL 183 Cb -0.25 -2.15 -0.03 0.00 0.56 0.00 0.00 36.38 34.52 1qni s VAL 183 CO 0.30 -0.21 0.80 -1.81 -0.31 0.00 0.00 175.10 173.87 1qni s ASP 184 N -3.06 6.12 1.78 4.85 1.01 -1.26 -4.44 116.67 121.67 1qni s ASP 184 Ca 0.26 0.85 0.00 0.00 0.71 0.00 0.00 52.55 54.37 1qni s ASP 184 Cb 0.05 -2.11 0.00 0.00 1.01 0.00 0.00 42.92 41.87 1qni s ASP 184 CO 0.05 -0.67 0.00 0.61 0.21 0.00 0.00 175.17 175.37 1qni n GLY 185 N -2.30 3.26 0.00 0.21 0.00 -1.26 -4.86 105.19 100.23 1qni n GLY 185 Ca 0.01 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.85 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 4.68 0.04 -3.87 1.61 2.04 -1.20 -4.58 115.26 113.98 1qni n ASN 186 Ca 0.00 -0.53 -0.14 0.00 -0.44 0.00 0.00 54.58 53.47 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 1.81 0.00 -4.53 1.43 -1.24 -4.57 118.68 111.59 1qni s LEU 187 Ca 0.00 -0.02 0.00 0.00 -1.03 0.00 0.00 54.13 53.08 1qni s LEU 187 Cb 0.00 -0.09 0.00 0.00 0.03 0.00 0.00 46.19 46.13 1qni s LEU 187 CO 0.00 -0.01 0.00 -0.67 0.23 0.00 0.00 176.35 175.90 1qni n ASP 188 N 3.28 0.00 -4.67 2.29 -0.08 -0.81 -3.78 116.55 112.78 1qni n ASP 188 Ca -0.16 0.00 -0.23 0.00 -1.51 0.00 0.00 54.79 52.89 1qni n ASP 188 Cb 0.57 0.00 -0.07 0.00 2.34 0.00 0.00 41.12 43.96 1qni n ASP 188 CO 0.00 0.00 0.00 0.20 0.12 0.00 0.00 177.20 177.52 1qni s ASN 189 N 0.36 4.49 0.20 1.67 -0.87 -1.26 -0.68 114.94 118.86 1qni s ASN 189 Ca 0.00 -0.77 -0.05 0.00 -1.57 0.00 0.00 52.86 50.47 1qni s ASN 189 Cb 0.00 -0.73 -0.03 0.00 -0.02 0.00 0.00 41.25 40.47 1qni s ASN 189 CO 0.00 -0.15 0.25 0.28 -2.57 0.00 0.00 177.10 174.91 1qni s THR 190 N -2.40 0.02 0.14 1.60 -1.32 -1.26 -1.12 115.64 111.29 1qni s THR 190 Ca 0.34 -1.75 -0.25 0.00 -1.21 0.00 0.00 61.69 58.82 1qni s THR 190 Cb -0.04 -2.30 0.07 0.00 -1.51 0.00 0.00 72.50 68.72 1qni s THR 190 CO 0.21 -0.07 0.88 -0.62 -2.21 0.00 0.00 174.62 172.81 1qni s ASP 191 N -3.09 -0.26 0.22 8.08 -1.08 -0.15 -4.62 116.67 115.78 1qni s ASP 191 Ca 0.30 -0.32 0.07 0.00 -0.52 0.00 0.00 52.55 52.08 1qni s ASP 191 Cb 0.04 0.51 -0.05 0.00 -1.46 0.00 0.00 42.92 41.96 1qni s ASP 191 CO 0.09 -0.91 -0.11 0.00 0.52 0.00 0.00 175.17 174.75 1qni s ALA 192 N -3.38 2.05 0.83 3.66 0.00 -1.26 -0.34 121.76 123.33 1qni s ALA 192 Ca 0.10 -1.72 0.00 0.00 0.00 0.00 0.00 51.96 50.34 1qni s ALA 192 Cb -0.02 0.02 0.00 0.00 0.00 0.00 0.00 23.12 23.12 1qni s ALA 192 CO -0.01 0.01 0.00 -0.40 0.00 0.00 0.00 175.76 175.36 1qni n ASP 193 N -0.42 0.00 -2.11 0.00 5.68 -0.91 -4.80 116.55 114.00 1qni n ASP 193 Ca -0.07 -0.61 -0.28 0.00 -0.50 0.00 0.00 54.79 53.33 1qni n ASP 193 Cb 0.61 0.00 0.06 0.00 -1.14 0.00 0.00 41.12 40.65 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 -1.13 2.87 0.00 2.11 4.02 -1.26 -4.28 117.16 119.49 1qni n TYR 194 Ca 0.00 -2.54 0.00 0.00 -0.01 0.00 0.00 57.90 55.35 1qni n TYR 194 Cb 0.00 -0.84 0.00 0.00 -0.02 0.00 0.00 39.34 38.48 1qni n TYR 194 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 176.86 176.10 1qni n THR 195 N -0.83 0.00 0.00 -0.72 -2.24 -1.26 -4.73 114.28 104.50 1qni n THR 195 Ca 0.52 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.30 1qni n THR 195 Cb 0.85 -0.21 0.00 0.00 -2.10 0.00 0.00 70.33 68.87 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 2.06 0.55 0.08 3.38 0.00 -1.14 -4.19 105.19 105.92 1qni n GLY 196 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.95 1qni n GLY 196 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1qni n LYS 197 N -1.67 0.63 -4.31 1.61 4.81 -1.26 -4.59 118.16 113.37 1qni n LYS 197 Ca 0.00 0.29 -0.23 0.00 -0.87 0.00 0.00 58.31 57.50 1qni n LYS 197 Cb 0.00 -1.80 -0.12 0.00 0.02 0.00 0.00 35.03 33.13 1qni n LYS 197 CO 0.00 0.00 0.00 0.71 1.17 0.00 0.00 177.40 179.28 1qni s TYR 198 N -2.67 1.79 -0.13 5.64 2.02 -1.26 -0.58 117.35 122.17 1qni s TYR 198 Ca -0.04 -0.44 -0.07 0.00 -0.37 0.00 0.00 57.07 56.15 1qni s TYR 198 Cb 0.08 -0.94 0.05 0.00 -0.40 0.00 0.00 41.96 40.75 1qni s TYR 198 CO 0.82 0.26 0.30 0.00 -1.57 0.00 0.00 175.55 175.36 1qni s ALA 199 N -1.57 -0.72 0.06 3.71 0.00 -1.03 -2.13 121.76 120.08 1qni s ALA 199 Ca 0.10 1.18 0.08 0.00 0.00 0.00 0.00 51.96 53.32 1qni s ALA 199 Cb -0.08 -0.75 -0.03 0.00 0.00 0.00 0.00 23.12 22.26 1qni s ALA 199 CO 0.05 -0.24 -0.22 0.95 0.00 0.00 0.00 175.76 176.30 1qni s THR 200 N 1.37 1.74 0.11 0.00 -4.23 0.54 -0.59 115.64 114.58 1qni s THR 200 Ca -0.09 -1.31 0.05 0.00 -1.18 0.00 0.00 61.69 59.16 1qni s THR 200 Cb -0.10 -1.53 -0.04 0.00 1.34 0.00 0.00 72.50 72.18 1qni s THR 200 CO -0.10 0.16 -0.13 -0.44 -0.54 0.00 0.00 174.62 173.57 1qni s SER 201 N -1.37 1.86 0.53 3.99 0.01 -0.58 -0.98 113.70 117.16 1qni s SER 201 Ca 0.08 -0.79 0.03 0.00 1.31 0.00 0.00 55.95 56.58 1qni s SER 201 Cb -0.09 -0.05 0.04 0.00 0.21 0.00 0.00 66.02 66.12 1qni s SER 201 CO 0.02 -0.16 0.74 0.42 0.41 0.00 0.00 173.24 174.67 1qni s THR 202 N -2.13 2.68 -0.12 1.44 -4.23 -0.27 -0.63 115.64 112.38 1qni s THR 202 Ca 0.07 -0.77 -0.09 0.00 -1.18 0.00 0.00 61.69 59.72 1qni s THR 202 Cb -0.05 -2.91 0.04 0.00 1.34 0.00 0.00 72.50 70.92 1qni s THR 202 CO 0.02 0.00 0.30 0.00 -0.54 0.00 0.00 174.62 174.41 1qni n TYR 204 N 3.50 0.00 -2.77 0.00 0.18 -1.26 -3.84 117.16 112.97 1qni n TYR 204 Ca -0.18 0.00 -0.23 0.00 1.88 0.00 0.00 57.90 59.37 1qni n TYR 204 Cb 0.56 0.00 -0.01 0.00 -0.38 0.00 0.00 39.34 39.51 1qni n TYR 204 CO 0.00 0.00 0.00 -1.71 -2.08 0.00 0.00 176.86 173.07 1qni n ASN 205 N -0.36 3.67 0.00 9.48 2.85 -1.26 -4.64 115.26 124.99 1qni n ASN 205 Ca 0.00 -3.48 0.06 0.00 -0.11 0.00 0.00 54.58 51.05 1qni n ASN 205 Cb 0.03 -0.53 0.28 0.00 1.24 0.00 0.00 39.78 40.81 1qni n ASN 205 CO 0.00 0.00 0.00 -1.54 -2.11 0.00 0.00 177.26 173.61 1qni n SER 206 N -0.23 0.00 0.03 1.20 3.41 -1.26 -1.37 113.62 115.40 1qni n SER 206 Ca 0.30 0.37 0.12 0.00 -0.26 0.00 0.00 58.87 59.40 1qni n SER 206 Cb 0.58 -0.43 0.11 0.00 -0.26 0.00 0.00 64.21 64.21 1qni n SER 206 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1qni n GLU 207 N -1.43 0.22 -3.89 4.33 4.71 -1.26 -4.39 120.64 118.93 1qni n GLU 207 Ca 0.04 0.03 -0.30 0.00 -0.01 0.00 0.00 57.16 56.91 1qni n GLU 207 Cb 0.13 -1.60 0.02 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 -1.91 -5.14 -3.61 3.49 1.74 -0.47 -4.98 116.66 105.79 1qni n ARG 208 Ca 0.03 0.57 -0.20 0.00 -0.77 0.00 0.00 57.85 57.49 1qni n ARG 208 Cb 0.41 -5.44 -0.02 0.00 -1.02 0.00 0.00 32.46 26.39 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 -3.27 4.05 -0.23 7.54 0.00 -1.26 -4.86 121.76 123.73 1qni s ALA 209 Ca 0.65 -1.61 -0.02 0.00 0.00 0.00 0.00 51.96 50.99 1qni s ALA 209 Cb -0.33 -1.37 -0.14 0.00 0.00 0.00 0.00 23.12 21.28 1qni s ALA 209 CO 0.80 -0.05 -0.23 1.55 0.00 0.00 0.00 175.76 177.84 1qni n VAL 210 N -1.52 1.29 -2.01 0.00 3.14 -1.26 -4.79 118.33 113.19 1qni n VAL 210 Ca -0.00 -0.45 -0.37 0.00 -2.96 0.00 0.00 64.34 60.56 1qni n VAL 210 Cb 0.59 -1.42 0.02 0.00 -1.06 0.00 0.00 33.84 31.97 1qni n VAL 210 CO 0.00 0.00 0.00 1.51 -6.46 0.00 0.00 176.83 171.88 1qni s ASP 211 N -6.41 5.48 0.17 6.55 -4.77 -1.26 -4.92 116.67 111.50 1qni s ASP 211 Ca -0.31 2.48 -0.15 0.00 -3.30 0.00 0.00 52.55 51.27 1qni s ASP 211 Cb 0.09 -2.61 0.11 0.00 -1.09 0.00 0.00 42.92 39.42 1qni s ASP 211 CO 0.49 -1.40 1.74 0.25 0.70 0.00 0.00 175.17 176.95 1qni h LEU 212 N 1.38 0.08 -0.96 2.11 6.46 -2.00 -2.50 115.31 119.88 1qni h LEU 212 Ca -0.50 0.06 0.05 0.00 -0.12 0.00 0.00 57.88 57.37 1qni h LEU 212 Cb 1.28 0.07 -0.06 0.00 -0.73 0.00 0.00 40.66 41.22 1qni h LEU 212 CO 0.57 0.08 0.62 0.00 -0.62 0.00 0.00 178.44 179.09 1qni h ALA 213 N 1.29 1.31 0.00 1.25 0.00 -1.99 -2.67 119.26 118.45 1qni h ALA 213 Ca 0.20 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 1qni h ALA 213 Cb 0.22 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1qni h ALA 213 CO -0.23 0.45 -0.24 0.78 0.00 0.00 0.00 179.25 180.00 1qni h GLY 214 N 1.16 0.00 1.95 0.00 0.00 -1.84 -2.49 103.07 101.85 1qni h GLY 214 Ca 0.40 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.73 1qni h GLY 214 CO -0.15 0.00 -0.03 -1.30 0.00 0.00 0.00 176.54 175.06 1qni n THR 215 N -3.49 0.09 0.25 4.70 -2.24 -1.01 -3.21 114.28 109.37 1qni n THR 215 Ca -0.00 -0.04 0.03 0.00 -2.27 0.00 0.00 64.05 61.76 1qni n THR 215 Cb 0.41 -0.48 0.02 0.00 -2.10 0.00 0.00 70.33 68.19 1qni n THR 215 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 1qni n MET 216 N -1.61 0.04 -0.04 -0.78 2.00 -1.09 -4.70 117.12 110.95 1qni n MET 216 Ca 0.07 -0.82 -0.03 0.00 0.00 0.00 0.00 57.70 56.91 1qni n MET 216 Cb 0.35 -1.10 -0.02 0.00 0.00 0.00 0.00 33.22 32.45 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 1.13 -0.08 -6.78 0.03 2.43 -1.42 -3.40 114.38 106.29 1qni h ARG 217 Ca 0.00 0.01 -0.53 0.00 -0.81 0.00 0.00 59.98 58.65 1qni h ARG 217 Cb 0.25 0.02 0.08 0.00 -0.42 0.00 0.00 29.97 29.89 1qni h ARG 217 CO 0.00 -0.05 0.85 -0.80 -1.51 0.00 0.00 179.97 178.46 1qni s ASN 218 N -3.29 6.45 0.41 -3.80 0.01 -1.26 -4.86 114.94 108.60 1qni s ASN 218 Ca -0.03 2.87 0.29 0.00 -0.71 0.00 0.00 52.86 55.27 1qni s ASN 218 Cb 0.02 -2.63 1.17 0.00 0.41 0.00 0.00 41.25 40.22 1qni s ASN 218 CO 0.14 -0.85 1.85 0.44 -1.51 0.00 0.00 177.10 177.17 1qni h ASP 219 N 4.94 0.00 -3.94 -1.22 3.32 -1.98 -3.43 116.42 114.10 1qni h ASP 219 Ca -0.47 0.00 -0.25 0.00 0.02 0.00 0.00 57.03 56.34 1qni h ASP 219 Cb 1.22 0.00 -0.27 0.00 0.22 0.00 0.00 39.33 40.50 1qni h ASP 219 CO 0.79 0.00 -0.73 -0.13 -1.72 0.00 0.00 179.24 177.45 1qni s ARG 220 N -3.49 0.15 0.00 3.56 0.52 -1.26 -1.60 118.95 116.83 1qni s ARG 220 Ca 0.03 -0.14 0.00 0.00 -0.52 0.00 0.00 55.73 55.10 1qni s ARG 220 Cb 0.09 -0.10 0.00 0.00 0.52 0.00 0.00 34.95 35.46 1qni s ARG 220 CO 0.48 0.02 0.00 -0.25 0.02 0.00 0.00 175.30 175.57 1qni n ASP 221 N 2.84 0.00 -3.16 0.23 8.00 0.54 -4.85 116.55 120.14 1qni n ASP 221 Ca -0.14 0.00 -0.05 0.00 0.71 0.00 0.00 54.79 55.31 1qni n ASP 221 Cb 0.59 0.00 0.02 0.00 -0.02 0.00 0.00 41.12 41.71 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 4.17 0.10 -0.30 1.24 -2.14 -1.25 -0.92 118.94 119.84 1qni s TRP 222 Ca 0.00 -0.62 0.01 0.00 2.66 0.00 0.00 56.10 58.15 1qni s TRP 222 Cb 0.00 0.76 0.09 0.00 -3.10 0.00 0.00 33.47 31.22 1qni s TRP 222 CO 0.00 -1.18 0.03 0.08 -2.66 0.00 0.00 176.95 173.22 1qni s VAL 223 N -2.14 1.59 -0.08 -0.66 1.01 -0.81 -1.73 120.40 117.58 1qni s VAL 223 Ca 0.20 -1.69 -0.30 0.00 0.00 0.00 0.00 61.98 60.19 1qni s VAL 223 Cb -0.04 -2.08 -0.04 0.00 0.00 0.00 0.00 36.38 34.23 1qni s VAL 223 CO 0.08 -0.47 1.35 -0.69 0.00 0.00 0.00 175.10 175.36 1qni s VAL 224 N 1.29 4.00 -0.05 2.92 1.01 0.20 -2.73 120.40 127.04 1qni s VAL 224 Ca 0.06 1.29 -0.08 0.00 0.00 0.00 0.00 61.98 63.25 1qni s VAL 224 Cb -0.18 -3.83 -0.05 0.00 0.00 0.00 0.00 36.38 32.32 1qni s VAL 224 CO -0.13 -0.06 0.24 -0.69 0.00 0.00 0.00 175.10 174.46 1qni s VAL 225 N 3.00 5.34 -0.10 2.92 1.01 -0.14 -1.52 120.40 130.91 1qni s VAL 225 Ca 0.60 0.31 0.04 0.00 0.00 0.00 0.00 61.98 62.93 1qni s VAL 225 Cb -0.27 -3.53 -0.00 0.00 0.00 0.00 0.00 36.38 32.58 1qni s VAL 225 CO 0.22 0.51 -0.23 -0.36 0.00 0.00 0.00 175.10 175.25 1qni s PHE 226 N -1.14 2.58 -0.93 5.22 0.08 0.24 -2.03 117.98 122.00 1qni s PHE 226 Ca 0.22 -0.96 -0.15 0.00 0.12 0.00 0.00 56.93 56.16 1qni s PHE 226 Cb -0.13 -1.72 0.19 0.00 -0.57 0.00 0.00 43.02 40.79 1qni s PHE 226 CO 0.11 -0.37 0.99 1.21 -0.10 0.00 0.00 175.22 177.06 1qni s ASN 227 N 0.28 6.81 0.21 1.36 3.84 -0.15 -2.45 114.94 124.84 1qni s ASN 227 Ca -0.16 -2.60 -0.11 0.00 0.21 0.00 0.00 52.86 50.19 1qni s ASN 227 Cb -0.17 -2.29 0.27 0.00 -0.55 0.00 0.00 41.25 38.51 1qni s ASN 227 CO 0.08 -0.72 1.68 0.58 -2.79 0.00 0.00 177.10 175.93 1qni h VAL 228 N 5.00 0.58 -0.87 -5.21 2.07 -1.14 0.09 116.25 116.76 1qni h VAL 228 Ca 0.15 -0.06 0.14 0.00 0.82 0.00 0.00 66.70 67.75 1qni h VAL 228 Cb 1.00 0.39 -0.09 0.00 -1.52 0.00 0.00 31.29 31.07 1qni h VAL 228 CO 0.94 0.03 0.47 -0.08 0.02 0.00 0.00 177.57 178.96 1qni h GLU 229 N 0.17 0.68 0.09 1.57 4.81 -1.81 0.24 114.58 120.33 1qni h GLU 229 Ca 0.30 -0.04 -0.29 0.00 -0.13 0.00 0.00 59.36 59.20 1qni h GLU 229 Cb 0.47 -0.15 0.03 0.00 0.63 0.00 0.00 28.75 29.72 1qni h GLU 229 CO -0.45 0.45 -1.19 0.00 -0.73 0.00 0.00 179.01 177.09 1qni h ARG 230 N 0.70 0.64 -0.44 1.92 3.08 -1.59 -2.71 114.38 115.99 1qni h ARG 230 Ca 0.46 -0.81 -0.07 0.00 0.07 0.00 0.00 59.98 59.63 1qni h ARG 230 Cb 0.59 0.26 -0.02 0.00 0.08 0.00 0.00 29.97 30.88 1qni h ARG 230 CO -0.33 1.37 -0.02 0.82 -1.07 0.00 0.00 179.97 180.74 1qni h ILE 231 N 0.29 1.24 -0.14 2.04 2.04 -0.53 -1.18 117.51 121.26 1qni h ILE 231 Ca -0.17 -0.98 -0.05 0.00 1.00 0.00 0.00 64.86 64.65 1qni h ILE 231 Cb 1.85 0.92 -0.00 0.00 -0.74 0.00 0.00 36.82 38.85 1qni h ILE 231 CO 0.23 0.34 -0.11 0.00 0.00 0.00 0.00 178.15 178.61 1qni h ALA 232 N 1.30 0.21 -0.42 1.87 0.00 -0.60 -2.26 119.26 119.37 1qni h ALA 232 Ca 0.13 -0.30 -0.03 0.00 0.00 0.00 0.00 54.91 54.71 1qni h ALA 232 Cb 0.45 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 1qni h ALA 232 CO 0.02 0.06 0.11 0.00 0.00 0.00 0.00 179.25 179.44 1qni h ALA 233 N 0.63 1.42 0.01 0.00 0.00 -1.35 -1.27 119.26 118.69 1qni h ALA 233 Ca 0.03 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 1qni h ALA 233 Cb 0.62 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1qni h ALA 233 CO 0.03 0.43 -0.01 0.00 0.00 0.00 0.00 179.25 179.70 1qni h ALA 234 N 1.52 -0.02 -0.70 0.00 0.00 -1.11 -0.91 119.26 118.04 1qni h ALA 234 Ca 0.14 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 1qni h ALA 234 Cb 0.21 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 1qni h ALA 234 CO -0.01 -0.43 0.25 0.28 0.00 0.00 0.00 179.25 179.35 1qni h VAL 235 N -0.17 1.25 0.00 0.00 2.07 -1.17 -1.73 116.25 116.49 1qni h VAL 235 Ca -0.00 -0.81 -0.07 0.00 0.82 0.00 0.00 66.70 66.64 1qni h VAL 235 Cb 0.17 0.44 -0.01 0.00 -1.52 0.00 0.00 31.29 30.37 1qni h VAL 235 CO 0.00 0.32 -0.33 0.50 0.02 0.00 0.00 177.57 178.09 1qni h LYS 236 N 1.02 0.00 0.00 1.57 3.64 -1.08 -1.77 116.57 119.94 1qni h LYS 236 Ca 0.23 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.61 1qni h LYS 236 Cb 0.24 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.06 1qni h LYS 236 CO -0.01 0.33 0.00 0.00 -2.27 0.00 0.00 179.45 177.49 1qni n ALA 237 N -2.43 2.35 -0.85 5.00 0.00 -0.36 -4.89 120.51 119.33 1qni n ALA 237 Ca -0.02 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.31 1qni n ALA 237 Cb 0.38 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.37 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 1.30 0.57 3.46 0.00 0.00 -0.67 -4.98 105.19 104.87 1qni n GLY 238 Ca 0.10 -0.07 -0.44 0.00 0.00 0.00 0.00 46.02 45.61 1qni n GLY 238 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1qni s ASN 239 N -2.06 6.87 0.22 1.61 0.01 -0.71 -4.91 114.94 115.97 1qni s ASN 239 Ca 0.00 -2.56 -0.19 0.00 -0.71 0.00 0.00 52.86 49.40 1qni s ASN 239 Cb 0.00 -2.40 0.07 0.00 0.41 0.00 0.00 41.25 39.33 1qni s ASN 239 CO 0.00 -0.89 0.95 2.22 -1.51 0.00 0.00 177.10 177.86 1qni n PHE 240 N 6.07 -1.56 -4.28 2.20 1.16 -1.26 -4.46 117.46 115.32 1qni n PHE 240 Ca 0.31 -1.36 -0.18 0.00 -1.87 0.00 0.00 57.45 54.35 1qni n PHE 240 Cb 0.46 0.67 -0.09 0.00 -1.61 0.00 0.00 39.48 38.91 1qni n PHE 240 CO 0.00 0.00 0.00 0.15 -1.87 0.00 0.00 176.76 175.04 1qni s LYS 241 N -2.06 1.61 0.14 3.97 1.02 -0.58 -4.92 119.74 118.92 1qni s LYS 241 Ca 0.21 -1.92 0.07 0.00 0.02 0.00 0.00 55.97 54.34 1qni s LYS 241 Cb -0.03 0.22 -0.04 0.00 -0.52 0.00 0.00 37.83 37.46 1qni s LYS 241 CO 0.07 -0.56 -0.15 0.95 -0.92 0.00 0.00 175.35 174.74 1qni s THR 242 N -3.63 1.46 0.01 2.17 -4.23 -1.26 -0.60 115.64 109.57 1qni s THR 242 Ca 0.39 -1.81 0.08 0.00 -1.18 0.00 0.00 61.69 59.17 1qni s THR 242 Cb 0.04 -1.65 -0.03 0.00 1.34 0.00 0.00 72.50 72.20 1qni s THR 242 CO 0.22 -0.42 -0.24 -0.63 -0.54 0.00 0.00 174.62 173.01 1qni s ILE 243 N -2.21 2.26 0.00 2.99 1.01 -1.26 -5.04 121.20 118.96 1qni s ILE 243 Ca 0.12 -1.20 0.00 0.00 0.00 0.00 0.00 60.65 59.56 1qni s ILE 243 Cb -0.05 -1.85 0.00 0.00 0.01 0.00 0.00 42.46 40.57 1qni s ILE 243 CO 0.04 0.46 0.00 0.61 0.00 0.00 0.00 174.94 176.05 1qni n GLY 244 N 2.05 2.42 0.22 6.18 0.00 -1.26 -2.22 105.19 112.58 1qni n GLY 244 Ca -0.16 -0.25 0.13 0.00 0.00 0.00 0.00 46.02 45.74 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 0.55 0.95 -4.76 1.61 8.00 -1.26 -4.91 116.55 116.74 1qni n ASP 245 Ca 0.00 -0.82 -0.40 0.00 0.71 0.00 0.00 54.79 54.28 1qni n ASP 245 Cb 0.00 0.13 -0.04 0.00 -0.02 0.00 0.00 41.12 41.19 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 -2.54 7.22 0.00 -2.24 0.15 -0.94 -4.92 113.70 110.43 1qni s SER 246 Ca 0.24 2.28 0.23 0.00 0.70 0.00 0.00 55.95 59.40 1qni s SER 246 Cb 0.19 -2.62 0.49 0.00 -1.71 0.00 0.00 66.02 62.37 1qni s SER 246 CO 0.53 -0.19 1.43 0.29 1.20 0.00 0.00 173.24 176.49 1qni n LYS 247 N 1.37 2.27 -1.99 5.44 4.76 -1.26 -4.14 118.16 124.61 1qni n LYS 247 Ca -0.00 -1.90 -0.42 0.00 -2.87 0.00 0.00 58.31 53.12 1qni n LYS 247 Cb 0.45 -1.48 -0.03 0.00 -1.84 0.00 0.00 35.03 32.13 1qni n LYS 247 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1qni s VAL 248 N -1.67 2.91 0.01 -0.18 1.01 -1.26 -4.92 120.40 116.30 1qni s VAL 248 Ca 0.36 0.58 -0.30 0.00 0.00 0.00 0.00 61.98 62.61 1qni s VAL 248 Cb 0.21 -3.37 -0.09 0.00 0.00 0.00 0.00 36.38 33.13 1qni s VAL 248 CO 0.30 0.03 1.99 -2.65 0.00 0.00 0.00 175.10 174.78 1qni n PRO 249 N 4.47 2.74 -4.38 2.72 -0.02 -1.26 -4.62 135.00 134.65 1qni n PRO 249 Ca 0.14 0.99 -0.33 0.00 -2.02 0.00 0.00 63.50 62.27 1qni n PRO 249 Cb 0.40 -3.01 -0.15 0.00 -0.02 0.00 0.00 33.50 30.72 1qni n PRO 249 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1qni s VAL 250 N 4.79 2.72 0.24 -1.45 1.01 0.23 -1.33 120.40 126.62 1qni s VAL 250 Ca 0.90 -0.74 0.09 0.00 0.00 0.00 0.00 61.98 62.23 1qni s VAL 250 Cb -0.45 -2.17 -0.04 0.00 0.00 0.00 0.00 36.38 33.73 1qni s VAL 250 CO 0.42 0.50 0.00 0.68 0.00 0.00 0.00 175.10 176.71 1qni s VAL 251 N 0.96 3.55 -0.16 2.92 -7.23 -0.63 -1.53 120.40 118.28 1qni s VAL 251 Ca -0.02 -1.76 -0.07 0.00 -1.81 0.00 0.00 61.98 58.31 1qni s VAL 251 Cb -0.15 -2.87 -0.04 0.00 0.56 0.00 0.00 36.38 33.88 1qni s VAL 251 CO -0.02 -0.30 0.10 -0.62 -0.31 0.00 0.00 175.10 173.95 1qni s ASP 252 N -3.47 5.97 -0.01 4.85 -1.08 -1.26 -1.22 116.67 120.45 1qni s ASP 252 Ca 0.30 0.24 0.02 0.00 -0.52 0.00 0.00 52.55 52.59 1qni s ASP 252 Cb -0.07 -1.98 0.02 0.00 -1.46 0.00 0.00 42.92 39.43 1qni s ASP 252 CO 0.20 0.27 0.90 0.61 0.52 0.00 0.00 175.17 177.66 1qni n GLY 253 N 2.93 1.78 3.79 2.66 0.00 -0.14 -4.83 105.19 111.39 1qni n GLY 253 Ca -0.18 -0.09 -0.33 0.00 0.00 0.00 0.00 46.02 45.42 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 -0.91 3.17 4.93 1.61 0.52 -1.21 -4.59 118.95 122.48 1qni s ARG 254 Ca 0.03 1.31 0.00 0.00 -0.52 0.00 0.00 55.73 56.55 1qni s ARG 254 Cb 0.02 -2.01 0.00 0.00 0.52 0.00 0.00 34.95 33.49 1qni s ARG 254 CO 0.00 -0.94 0.00 0.41 0.02 0.00 0.00 175.30 174.79 1qni n GLY 255 N -0.69 2.74 3.50 -3.53 0.00 -1.26 -4.06 105.19 101.89 1qni n GLY 255 Ca 0.10 -0.30 -0.42 0.00 0.00 0.00 0.00 46.02 45.39 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 3.29 0.24 1.61 2.02 -1.26 -4.94 118.70 119.66 1qni s GLU 256 Ca 0.00 -0.86 0.11 0.00 0.02 0.00 0.00 54.97 54.24 1qni s GLU 256 Cb 0.00 -4.50 -0.05 0.00 0.10 0.00 0.00 34.13 29.68 1qni s GLU 256 CO 0.00 -1.97 -0.17 0.45 0.02 0.00 0.00 175.26 173.59 1qni s SER 257 N 3.90 3.76 0.00 -0.19 0.15 -1.26 -5.01 113.70 115.05 1qni s SER 257 Ca 0.31 -0.88 0.27 0.00 0.70 0.00 0.00 55.95 56.35 1qni s SER 257 Cb -0.10 -0.41 0.86 0.00 -1.71 0.00 0.00 66.02 64.65 1qni s SER 257 CO 0.05 0.06 1.65 -1.84 1.20 0.00 0.00 173.24 174.36 1qni n GLU 258 N -0.36 0.24 -0.04 5.44 0.28 -1.26 -3.84 120.64 121.09 1qni n GLU 258 Ca -0.08 -0.10 -0.15 0.00 -0.16 0.00 0.00 57.16 56.66 1qni n GLU 258 Cb 0.58 -1.50 -0.14 0.00 1.43 0.00 0.00 31.44 31.82 1qni n GLU 258 CO 0.00 0.00 0.00 1.19 -0.16 0.00 0.00 177.13 178.16 1qni n PHE 259 N -1.29 0.78 -4.53 -1.84 3.72 -1.26 -4.85 117.46 108.19 1qni n PHE 259 Ca 0.08 0.21 -0.27 0.00 -0.05 0.00 0.00 57.45 57.42 1qni n PHE 259 Cb 0.33 -1.12 -0.10 0.00 -0.94 0.00 0.00 39.48 37.64 1qni n PHE 259 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 1qni s THR 260 N -2.55 2.05 -0.23 4.37 -4.23 -1.25 -0.98 115.64 112.83 1qni s THR 260 Ca -0.18 -1.94 -0.05 0.00 -1.18 0.00 0.00 61.69 58.34 1qni s THR 260 Cb 0.07 -2.99 0.11 0.00 1.34 0.00 0.00 72.50 71.03 1qni s THR 260 CO 0.76 0.00 0.43 -0.60 -0.54 0.00 0.00 174.62 174.68 1qni s ARG 261 N -3.75 0.36 -0.59 3.99 6.06 -0.86 -4.49 118.95 119.67 1qni s ARG 261 Ca 0.36 0.90 -0.19 0.00 -2.50 0.00 0.00 55.73 54.29 1qni s ARG 261 Cb 0.09 0.12 0.09 0.00 0.06 0.00 0.00 34.95 35.31 1qni s ARG 261 CO 0.19 -0.40 0.73 0.71 -2.50 0.00 0.00 175.30 174.03 1qni s TYR 262 N 2.62 2.96 -0.58 5.12 1.51 -1.26 -0.97 117.35 126.76 1qni s TYR 262 Ca 0.04 -0.84 -0.20 0.00 -1.01 0.00 0.00 57.07 55.05 1qni s TYR 262 Cb -0.13 -3.98 0.08 0.00 -0.11 0.00 0.00 41.96 37.81 1qni s TYR 262 CO -0.15 -1.30 0.77 0.42 -1.11 0.00 0.00 175.55 174.18 1qni s ILE 263 N 2.86 4.67 0.06 2.71 1.01 -1.10 -4.89 121.20 126.50 1qni s ILE 263 Ca 0.13 -0.55 -0.37 0.00 0.00 0.00 0.00 60.65 59.86 1qni s ILE 263 Cb -0.22 -4.49 -0.17 0.00 0.01 0.00 0.00 42.46 37.59 1qni s ILE 263 CO 0.08 -1.11 1.37 -2.65 0.00 0.00 0.00 174.94 172.62 1qni n PRO 264 N 6.74 1.13 -4.20 2.79 -0.02 -1.26 -1.92 135.00 138.26 1qni n PRO 264 Ca -0.06 0.41 -0.17 0.00 -2.02 0.00 0.00 63.50 61.65 1qni n PRO 264 Cb 0.45 -2.05 -0.15 0.00 -0.02 0.00 0.00 33.50 31.72 1qni n PRO 264 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1qni s VAL 265 N 0.71 0.50 -0.04 -1.45 1.01 -0.10 -4.89 120.40 116.15 1qni s VAL 265 Ca 0.86 -0.22 -0.37 0.00 0.00 0.00 0.00 61.98 62.24 1qni s VAL 265 Cb -0.97 -0.45 -0.15 0.00 0.00 0.00 0.00 36.38 34.81 1qni s VAL 265 CO 0.48 0.16 1.57 -0.81 0.00 0.00 0.00 175.10 176.50 1qni n PRO 266 N 3.22 1.43 0.00 2.72 -0.04 -1.26 -0.34 135.00 140.73 1qni n PRO 266 Ca -0.16 0.52 0.00 0.00 -0.04 0.00 0.00 63.50 63.81 1qni n PRO 266 Cb 0.56 -2.22 0.00 0.00 -0.04 0.00 0.00 33.50 31.80 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 4.05 0.00 -3.80 0.54 5.02 -0.63 -3.97 118.16 119.37 1qni n LYS 267 Ca 0.21 0.00 -0.25 0.00 -2.02 0.00 0.00 58.31 56.25 1qni n LYS 267 Cb 0.20 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 35.18 1qni n LYS 267 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1qni n ASN 268 N 0.70 -0.69 -4.65 4.39 4.13 -1.26 -3.48 115.26 114.39 1qni n ASN 268 Ca 0.00 -0.85 -0.42 0.00 1.68 0.00 0.00 54.58 54.99 1qni n ASN 268 Cb 0.00 -1.04 0.00 0.00 -1.54 0.00 0.00 39.78 37.21 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 -3.48 1.67 0.00 3.52 -0.04 -1.25 -4.53 135.00 130.90 1qni n PRO 269 Ca -0.16 0.59 0.00 0.00 -0.04 0.00 0.00 63.50 63.89 1qni n PRO 269 Cb 0.42 -2.16 0.00 0.00 -0.04 0.00 0.00 33.50 31.72 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 -0.12 0.00 -1.44 0.54 -0.00 -0.08 -4.25 115.22 109.86 1qni n HIS 270 Ca 0.08 0.00 -0.33 0.00 0.46 0.00 0.00 57.72 57.92 1qni n HIS 270 Cb 0.37 0.00 0.09 0.00 -0.12 0.00 0.00 29.99 30.33 1qni n HIS 270 CO 0.00 0.00 0.00 0.20 0.46 0.00 0.00 176.34 177.00 1qni s GLY 271 N -0.17 2.16 -0.19 1.57 0.00 -0.02 -4.09 107.32 106.58 1qni s GLY 271 Ca 0.00 0.69 -0.04 0.00 0.00 0.00 0.00 44.72 45.37 1qni s GLY 271 CO 0.00 1.07 0.18 -2.27 0.00 0.00 0.00 173.10 172.09 1qni s LEU 272 N -5.28 0.01 -0.02 0.66 0.20 -1.26 -0.46 118.68 112.53 1qni s LEU 272 Ca 0.70 -0.31 0.05 0.00 0.69 0.00 0.00 54.13 55.26 1qni s LEU 272 Cb -0.25 0.21 -0.01 0.00 -0.43 0.00 0.00 46.19 45.72 1qni s LEU 272 CO 0.46 -0.33 -0.18 0.20 -0.29 0.00 0.00 176.35 176.21 1qni s ASN 273 N 2.28 2.19 -0.06 3.68 -0.87 0.03 -4.40 114.94 117.78 1qni s ASN 273 Ca 0.05 -0.34 -0.16 0.00 -1.57 0.00 0.00 52.86 50.84 1qni s ASN 273 Cb -0.16 -0.35 -0.05 0.00 -0.02 0.00 0.00 41.25 40.67 1qni s ASN 273 CO -0.11 0.21 0.41 -0.89 -2.57 0.00 0.00 177.10 174.15 1qni s THR 274 N -0.30 5.12 0.38 1.60 2.01 -1.26 -0.86 115.64 122.32 1qni s THR 274 Ca 0.04 0.84 -0.25 0.00 0.31 0.00 0.00 61.69 62.63 1qni s THR 274 Cb -0.08 -3.74 -0.09 0.00 0.01 0.00 0.00 72.50 68.60 1qni s THR 274 CO 0.00 0.47 1.02 -0.94 -0.69 0.00 0.00 174.62 174.48 1qni s SER 275 N -0.32 6.94 0.54 3.53 1.04 -0.75 -4.86 113.70 119.82 1qni s SER 275 Ca 0.23 1.98 0.31 0.00 0.48 0.00 0.00 55.95 58.95 1qni s SER 275 Cb -0.16 -2.58 1.47 0.00 0.10 0.00 0.00 66.02 64.85 1qni s SER 275 CO 0.11 -0.36 1.91 -0.65 0.98 0.00 0.00 173.24 175.23 1qni h PRO 276 N 2.69 0.00 0.00 4.02 0.11 -1.84 0.62 132.00 137.60 1qni h PRO 276 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1qni h PRO 276 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1qni h PRO 276 CO 0.63 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 178.02 1qni n ASP 277 N -4.28 0.29 -1.09 -2.05 5.68 -1.26 -4.41 116.55 109.43 1qni n ASP 277 Ca 0.17 0.55 -0.11 0.00 -0.50 0.00 0.00 54.79 54.90 1qni n ASP 277 Cb 0.91 -0.62 -0.02 0.00 -1.14 0.00 0.00 41.12 40.25 1qni n ASP 277 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1qni n GLY 278 N 0.66 0.39 0.00 6.12 0.00 0.22 -4.92 105.19 107.66 1qni n GLY 278 Ca 0.05 -0.47 0.00 0.00 0.00 0.00 0.00 46.02 45.60 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 -2.28 1.99 -3.80 1.61 2.85 -1.26 -4.45 118.16 112.83 1qni n LYS 279 Ca -0.12 -1.18 -0.14 0.00 -1.05 0.00 0.00 58.31 55.82 1qni n LYS 279 Cb 0.51 -0.88 -0.15 0.00 -0.65 0.00 0.00 35.03 33.86 1qni n LYS 279 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 177.40 178.06 1qni s TYR 280 N -0.69 -0.02 -0.39 5.58 2.02 -1.26 -2.36 117.35 120.24 1qni s TYR 280 Ca 0.00 0.16 -0.05 0.00 -0.37 0.00 0.00 57.07 56.81 1qni s TYR 280 Cb 0.00 -0.13 0.08 0.00 -0.40 0.00 0.00 41.96 41.51 1qni s TYR 280 CO 0.00 -0.08 0.18 -0.06 -1.57 0.00 0.00 175.55 174.02 1qni s PHE 281 N 0.73 3.41 -0.30 2.71 0.08 0.49 -1.81 117.98 123.29 1qni s PHE 281 Ca -0.06 -1.93 -0.11 0.00 0.12 0.00 0.00 56.93 54.95 1qni s PHE 281 Cb -0.08 -2.85 -0.03 0.00 -0.57 0.00 0.00 43.02 39.49 1qni s PHE 281 CO -0.02 -0.88 0.18 0.42 -0.10 0.00 0.00 175.22 174.82 1qni s ILE 282 N 1.28 5.02 0.13 0.64 1.01 -0.04 -0.89 121.20 128.34 1qni s ILE 282 Ca 0.03 -0.13 -0.02 0.00 0.00 0.00 0.00 60.65 60.52 1qni s ILE 282 Cb -0.22 -3.48 -0.05 0.00 0.01 0.00 0.00 42.46 38.72 1qni s ILE 282 CO -0.01 0.13 0.32 0.00 0.00 0.00 0.00 174.94 175.39 1qni s ALA 283 N 1.70 3.87 -0.21 9.38 0.00 -0.72 -0.79 121.76 134.98 1qni s ALA 283 Ca 0.06 -0.71 -0.09 0.00 0.00 0.00 0.00 51.96 51.22 1qni s ALA 283 Cb -0.17 -2.00 -0.04 0.00 0.00 0.00 0.00 23.12 20.91 1qni s ALA 283 CO 0.09 0.67 0.11 -0.80 0.00 0.00 0.00 175.76 175.83 1qni s ASN 284 N -2.61 5.85 0.19 0.00 0.01 0.39 -1.81 114.94 116.97 1qni s ASN 284 Ca 0.39 0.09 -0.11 0.00 -0.71 0.00 0.00 52.86 52.51 1qni s ASN 284 Cb -0.12 -2.03 0.19 0.00 0.41 0.00 0.00 41.25 39.70 1qni s ASN 284 CO 0.27 0.12 1.78 1.23 -1.51 0.00 0.00 177.10 178.98 1qni h GLY 285 N 7.13 0.80 0.00 0.66 0.00 -0.84 -0.19 103.07 110.62 1qni h GLY 285 Ca -0.38 -0.18 0.00 0.00 0.00 0.00 0.00 47.33 46.77 1qni h GLY 285 CO 0.68 0.09 0.00 1.17 0.00 0.00 0.00 176.54 178.48 1qni n LYS 286 N -4.89 0.00 0.28 4.80 4.81 0.76 -2.32 118.16 121.60 1qni n LYS 286 Ca 0.06 0.00 0.13 0.00 -0.87 0.00 0.00 58.31 57.63 1qni n LYS 286 Cb 0.18 0.00 0.82 0.00 0.02 0.00 0.00 35.03 36.04 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 -9.24 3.14 3.38 -1.79 -3.11 115.31 107.70 1qni h LEU 287 Ca 0.00 0.00 -0.60 0.00 0.09 0.00 0.00 57.88 57.37 1qni h LEU 287 Cb 0.00 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 40.63 1qni h LEU 287 CO 0.00 0.04 -0.43 -0.55 0.09 0.00 0.00 178.44 177.59 1qni s SER 288 N -6.31 6.26 0.00 -0.43 0.15 -0.98 -4.89 113.70 107.51 1qni s SER 288 Ca -0.04 0.30 0.00 0.00 0.70 0.00 0.00 55.95 56.90 1qni s SER 288 Cb 0.15 -2.12 0.00 0.00 -1.71 0.00 0.00 66.02 62.33 1qni s SER 288 CO 0.58 0.12 0.38 -0.81 1.20 0.00 0.00 173.24 174.71 1qni n PRO 289 N 3.73 0.48 -3.76 5.44 -0.04 -1.26 -4.18 135.00 135.41 1qni n PRO 289 Ca -0.14 0.00 -0.20 0.00 -0.04 0.00 0.00 63.50 63.12 1qni n PRO 289 Cb 0.52 -1.25 -0.05 0.00 -0.04 0.00 0.00 33.50 32.68 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 0.55 0.00 -3.79 0.52 -2.24 -1.26 0.13 114.28 108.19 1qni n THR 290 Ca 0.00 -1.68 -0.14 0.00 -2.27 0.00 0.00 64.05 59.96 1qni n THR 290 Cb 0.19 0.51 -0.15 0.00 -2.10 0.00 0.00 70.33 68.78 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 -2.51 -0.04 -0.37 2.28 1.01 -0.99 -0.50 120.40 119.29 1qni s VAL 291 Ca 0.09 0.15 -0.13 0.00 0.00 0.00 0.00 61.98 62.10 1qni s VAL 291 Cb 0.00 -0.10 0.01 0.00 0.00 0.00 0.00 36.38 36.29 1qni s VAL 291 CO 0.07 0.06 0.25 -0.44 0.00 0.00 0.00 175.10 175.04 1qni s SER 292 N 0.81 5.96 -0.58 3.32 0.01 -0.75 -3.44 113.70 119.03 1qni s SER 292 Ca -0.07 -0.71 -0.21 0.00 1.31 0.00 0.00 55.95 56.28 1qni s SER 292 Cb -0.09 -2.11 0.07 0.00 0.21 0.00 0.00 66.02 64.10 1qni s SER 292 CO -0.03 -0.33 0.79 -0.69 0.41 0.00 0.00 173.24 173.39 1qni s VAL 293 N 1.67 4.62 -0.05 3.43 1.01 0.83 -1.76 120.40 130.15 1qni s VAL 293 Ca 0.05 -0.46 -0.19 0.00 0.00 0.00 0.00 61.98 61.37 1qni s VAL 293 Cb -0.18 -4.50 -0.05 0.00 0.00 0.00 0.00 36.38 31.65 1qni s VAL 293 CO 0.09 -1.13 0.54 -0.63 0.00 0.00 0.00 175.10 173.98 1qni s ILE 294 N 3.27 5.02 -0.34 2.22 1.01 -0.07 -1.25 121.20 131.06 1qni s ILE 294 Ca 0.19 1.12 -0.19 0.00 0.00 0.00 0.00 60.65 61.77 1qni s ILE 294 Cb -0.19 -3.88 -0.00 0.00 0.01 0.00 0.00 42.46 38.40 1qni s ILE 294 CO 0.11 0.39 0.56 0.00 0.00 0.00 0.00 174.94 176.00 1qni s ALA 295 N 0.06 3.48 0.48 9.38 0.00 -0.70 -0.38 121.76 134.09 1qni s ALA 295 Ca 0.29 -0.91 0.16 0.00 0.00 0.00 0.00 51.96 51.50 1qni s ALA 295 Cb -0.17 -3.07 1.17 0.00 0.00 0.00 0.00 23.12 21.05 1qni s ALA 295 CO 0.15 -1.22 2.06 0.82 0.00 0.00 0.00 175.76 177.57 1qni h ILE 296 N 5.62 0.94 -0.74 0.00 2.04 -1.81 -2.42 117.51 121.14 1qni h ILE 296 Ca -0.27 -0.07 0.01 0.00 1.00 0.00 0.00 64.86 65.53 1qni h ILE 296 Cb 1.12 0.73 -0.04 0.00 -0.74 0.00 0.00 36.82 37.89 1qni h ILE 296 CO 0.79 0.04 0.49 -0.78 0.00 0.00 0.00 178.15 178.69 1qni h ASP 297 N 0.19 0.84 1.36 1.72 1.82 -1.91 -1.84 116.42 118.60 1qni h ASP 297 Ca 0.14 -0.02 0.00 0.00 -0.39 0.00 0.00 57.03 56.76 1qni h ASP 297 Cb 0.33 -0.21 0.00 0.00 0.68 0.00 0.00 39.33 40.13 1qni h ASP 297 CO -0.02 0.61 0.00 0.29 -1.61 0.00 0.00 179.24 178.50 1qni n LYS 298 N -4.43 0.26 0.01 0.28 5.02 -0.91 -3.88 118.16 114.51 1qni n LYS 298 Ca 0.08 0.26 0.20 0.00 -2.02 0.00 0.00 58.31 56.83 1qni n LYS 298 Cb 0.04 -1.83 0.69 0.00 -0.02 0.00 0.00 35.03 33.91 1qni n LYS 298 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 1qni h LEU 299 N 0.00 0.00 -0.30 -0.35 3.38 -1.37 -1.55 115.31 115.12 1qni h LEU 299 Ca 0.00 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 1qni h LEU 299 Cb 0.68 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 1qni h LEU 299 CO 0.00 0.00 0.04 0.44 0.09 0.00 0.00 178.44 179.01 1qni h ASP 300 N 0.00 0.48 -0.33 -0.43 3.32 -1.75 -2.52 116.42 115.19 1qni h ASP 300 Ca 0.25 -0.26 -0.12 0.00 0.02 0.00 0.00 57.03 56.92 1qni h ASP 300 Cb 1.00 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 40.40 1qni h ASP 300 CO -0.00 0.62 -0.21 0.44 -1.72 0.00 0.00 179.24 178.36 1qni h ASP 301 N 0.32 0.83 -0.82 6.45 3.32 -1.58 -3.02 116.42 121.91 1qni h ASP 301 Ca 0.09 -0.30 0.05 0.00 0.02 0.00 0.00 57.03 56.89 1qni h ASP 301 Cb 0.35 -0.23 -0.05 0.00 0.22 0.00 0.00 39.33 39.62 1qni h ASP 301 CO 0.01 1.02 0.54 0.25 -1.72 0.00 0.00 179.24 179.34 1qni h LEU 302 N 0.71 0.84 -0.68 1.55 5.85 -1.20 0.11 115.31 122.49 1qni h LEU 302 Ca 0.10 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.82 1qni h LEU 302 Cb 0.74 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.58 1qni h LEU 302 CO 0.06 0.56 0.00 0.49 -0.34 0.00 0.00 178.44 179.21 1qni n PHE 303 N -4.47 0.21 0.08 1.25 3.01 -0.96 -2.59 117.46 113.98 1qni n PHE 303 Ca 0.11 -0.10 0.01 0.00 1.01 0.00 0.00 57.45 58.48 1qni n PHE 303 Cb 0.16 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.64 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 -0.02 0.60 -2.13 -1.08 4.07 0.23 -5.00 120.64 117.32 1qni n GLU 304 Ca 0.10 -0.49 -0.18 0.00 -0.06 0.00 0.00 57.16 56.52 1qni n GLU 304 Cb 0.18 -0.95 -0.03 0.00 -0.06 0.00 0.00 31.44 30.59 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 -0.11 -5.21 0.04 4.31 8.00 -0.35 -4.88 116.55 118.35 1qni n ASP 305 Ca 0.01 0.10 0.13 0.00 0.71 0.00 0.00 54.79 55.74 1qni n ASP 305 Cb 0.04 -4.28 0.37 0.00 -0.02 0.00 0.00 41.12 37.23 1qni n ASP 305 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1qni n LYS 306 N -2.66 0.14 -4.19 -1.24 5.02 -0.69 -4.91 118.16 109.63 1qni n LYS 306 Ca -0.20 0.07 -0.19 0.00 -2.02 0.00 0.00 58.31 55.97 1qni n LYS 306 Cb 0.64 -1.62 -0.07 0.00 -0.02 0.00 0.00 35.03 33.96 1qni n LYS 306 CO 0.00 0.00 0.00 0.44 -0.52 0.00 0.00 177.40 177.32 1qni n ILE 307 N -1.84 0.00 -3.11 -0.18 -5.35 -1.26 -5.01 119.36 102.62 1qni n ILE 307 Ca 0.05 -2.31 -0.23 0.00 -0.27 0.00 0.00 62.75 59.99 1qni n ILE 307 Cb 0.39 1.20 0.00 0.00 -1.74 0.00 0.00 39.64 39.49 1qni n ILE 307 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 1qni s GLU 308 N -3.25 3.18 0.10 6.28 2.56 -1.26 -4.85 118.70 121.46 1qni s GLU 308 Ca 0.38 -0.48 -0.26 0.00 0.00 0.00 0.00 54.97 54.61 1qni s GLU 308 Cb 0.01 -2.60 -0.12 0.00 2.00 0.00 0.00 34.13 33.43 1qni s GLU 308 CO 0.27 -0.15 1.67 -0.07 -0.56 0.00 0.00 175.26 176.42 1qni h LEU 309 N 0.51 -0.48 -0.07 2.70 3.38 -1.96 -2.49 115.31 116.91 1qni h LEU 309 Ca -0.47 0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.55 1qni h LEU 309 Cb 1.24 0.17 0.00 0.00 0.09 0.00 0.00 40.66 42.16 1qni h LEU 309 CO 0.58 -0.27 0.00 0.54 0.09 0.00 0.00 178.44 179.38 1qni n ARG 310 N -5.31 0.02 0.13 1.13 5.12 -1.26 -2.54 116.66 113.95 1qni n ARG 310 Ca -0.08 0.28 0.12 0.00 -1.93 0.00 0.00 57.85 56.24 1qni n ARG 310 Cb 0.22 -1.53 0.49 0.00 -1.16 0.00 0.00 32.46 30.48 1qni n ARG 310 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45 1qni n ASP 311 N -1.56 0.64 0.19 0.55 9.92 -0.94 -1.73 116.55 123.62 1qni n ASP 311 Ca 0.03 0.67 0.08 0.00 -0.53 0.00 0.00 54.79 55.04 1qni n ASP 311 Cb 0.16 -0.80 0.18 0.00 -0.64 0.00 0.00 41.12 40.02 1qni n ASP 311 CO 0.00 0.00 0.00 0.71 0.13 0.00 0.00 177.20 178.04 1qni h THR 312 N 0.00 0.46 -2.90 -3.53 1.35 -1.63 -3.43 112.91 103.23 1qni h THR 312 Ca 0.00 -1.53 -0.57 0.00 -0.55 0.00 0.00 66.41 63.76 1qni h THR 312 Cb 0.34 2.13 -0.04 0.00 -1.73 0.00 0.00 68.15 68.85 1qni h THR 312 CO 0.00 0.25 1.19 -0.63 -0.25 0.00 0.00 175.52 176.07 1qni s ILE 313 N -3.19 3.65 -0.37 6.82 -1.09 -0.70 -1.71 121.20 124.60 1qni s ILE 313 Ca 0.04 0.68 0.23 0.00 -2.23 0.00 0.00 60.65 59.37 1qni s ILE 313 Cb 0.07 -3.85 -0.07 0.00 -1.58 0.00 0.00 42.46 37.03 1qni s ILE 313 CO 0.69 -0.52 1.00 0.52 -1.23 0.00 0.00 174.94 175.40 1qni n VAL 314 N 7.18 0.37 -3.57 2.92 0.31 -0.38 -4.98 118.33 120.17 1qni n VAL 314 Ca 0.20 -0.41 -0.08 0.00 -0.01 0.00 0.00 64.34 64.04 1qni n VAL 314 Cb 0.47 -0.10 -0.04 0.00 -0.91 0.00 0.00 33.84 33.26 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 -3.31 -1.96 -0.44 3.52 0.00 -1.23 -4.60 121.76 113.75 1qni s ALA 315 Ca 0.01 1.51 0.07 0.00 0.00 0.00 0.00 51.96 53.55 1qni s ALA 315 Cb 0.12 -0.48 0.32 0.00 0.00 0.00 0.00 23.12 23.08 1qni s ALA 315 CO 0.80 -0.42 1.02 -1.91 0.00 0.00 0.00 175.76 175.25 1qni n GLU 316 N 0.37 1.00 -2.11 0.00 2.13 -1.25 -0.12 120.64 120.66 1qni n GLU 316 Ca -0.07 -2.26 -0.37 0.00 0.66 0.00 0.00 57.16 55.12 1qni n GLU 316 Cb 0.59 -1.20 0.01 0.00 0.27 0.00 0.00 31.44 31.11 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 -0.32 3.54 -0.11 5.31 0.04 -1.22 -4.60 135.00 137.63 1qni s PRO 317 Ca 0.26 1.91 -0.21 0.00 0.04 0.00 0.00 61.00 63.00 1qni s PRO 317 Cb 0.30 -2.34 -0.03 0.00 0.04 0.00 0.00 34.50 32.46 1qni s PRO 317 CO -0.06 -0.77 0.63 -2.00 0.04 0.00 0.00 177.00 174.84 1qni s GLU 318 N -2.79 4.36 -0.10 4.56 2.12 -1.26 -2.34 118.70 123.25 1qni s GLU 318 Ca 0.66 0.71 -0.01 0.00 0.36 0.00 0.00 54.97 56.69 1qni s GLU 318 Cb -0.32 -3.48 -0.06 0.00 0.26 0.00 0.00 34.13 30.54 1qni s GLU 318 CO 0.38 0.01 -0.10 1.28 -0.54 0.00 0.00 175.26 176.29 1qni n LEU 319 N 4.09 2.23 0.00 2.70 4.77 0.12 -4.96 117.00 125.95 1qni n LEU 319 Ca -0.03 0.01 0.00 0.00 -0.03 0.00 0.00 56.01 55.96 1qni n LEU 319 Cb 0.51 -0.32 0.00 0.00 -2.33 0.00 0.00 43.42 41.28 1qni n LEU 319 CO 0.45 0.51 0.00 0.61 -1.33 0.00 0.00 177.39 177.63 1qni n GLY 320 N 2.82 -1.59 3.71 -0.72 0.00 -1.17 -5.07 105.19 103.16 1qni n GLY 320 Ca -0.18 -1.07 -0.42 0.00 0.00 0.00 0.00 46.02 44.35 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 4.38 -0.34 0.99 1.43 -1.26 -4.22 118.68 119.66 1qni s LEU 321 Ca 0.00 1.71 -0.01 0.00 -1.03 0.00 0.00 54.13 54.80 1qni s LEU 321 Cb 0.00 -3.57 0.00 0.00 0.03 0.00 0.00 46.19 42.65 1qni s LEU 321 CO 0.00 -0.27 0.29 0.61 0.23 0.00 0.00 176.35 177.21 1qni n GLY 322 N 2.88 0.42 3.64 -3.19 0.00 -1.17 -2.91 105.19 104.87 1qni n GLY 322 Ca 0.06 -0.39 -0.43 0.00 0.00 0.00 0.00 46.02 45.27 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 -4.93 3.96 -0.20 1.61 0.04 -1.25 -0.59 135.00 133.64 1qni s PRO 323 Ca 0.09 1.86 -0.04 0.00 0.04 0.00 0.00 61.00 62.95 1qni s PRO 323 Cb -0.04 -4.00 -0.11 0.00 0.04 0.00 0.00 34.50 30.39 1qni s PRO 323 CO 0.19 -1.10 -0.22 1.28 0.04 0.00 0.00 177.00 177.19 1qni n LEU 324 N 7.89 2.22 -4.05 -3.56 4.77 -0.88 -0.17 117.00 123.22 1qni n LEU 324 Ca 0.18 0.07 -0.08 0.00 -0.03 0.00 0.00 56.01 56.15 1qni n LEU 324 Cb 0.44 -0.64 -0.09 0.00 -2.33 0.00 0.00 43.42 40.80 1qni n LEU 324 CO 0.63 0.63 -0.26 -1.00 -1.33 0.00 0.00 177.39 176.06 1qni s HIS 325 N -2.38 0.54 0.03 -1.77 3.76 -1.26 -0.84 115.29 113.37 1qni s HIS 325 Ca -0.27 -1.00 0.01 0.00 -0.15 0.00 0.00 55.06 53.65 1qni s HIS 325 Cb 0.09 -0.32 -0.02 0.00 1.11 0.00 0.00 32.58 33.44 1qni s HIS 325 CO 0.40 -0.49 -0.05 0.99 -0.85 0.00 0.00 174.74 174.75 1qni s THR 326 N -3.95 0.29 0.30 1.30 2.01 -1.26 -1.52 115.64 112.80 1qni s THR 326 Ca 0.13 -1.04 0.04 0.00 0.31 0.00 0.00 61.69 61.13 1qni s THR 326 Cb 0.07 -0.48 -0.03 0.00 0.01 0.00 0.00 72.50 72.06 1qni s THR 326 CO -0.06 -0.49 0.26 0.28 -0.69 0.00 0.00 174.62 173.92 1qni s THR 327 N -1.61 0.00 0.07 -0.82 -1.32 0.54 -4.77 115.64 107.73 1qni s THR 327 Ca -0.12 -1.96 0.01 0.00 -1.21 0.00 0.00 61.69 58.41 1qni s THR 327 Cb -0.09 -2.51 -0.04 0.00 -1.51 0.00 0.00 72.50 68.36 1qni s THR 327 CO -0.01 0.00 -0.05 -0.36 -2.21 0.00 0.00 174.62 171.99 1qni s PHE 328 N -3.60 0.72 -1.79 9.09 0.40 -1.26 -1.28 117.98 120.26 1qni s PHE 328 Ca 0.39 -0.89 0.19 0.00 -0.60 0.00 0.00 56.93 56.02 1qni s PHE 328 Cb 0.03 -0.45 0.02 0.00 0.51 0.00 0.00 43.02 43.13 1qni s PHE 328 CO 0.23 -0.21 0.96 -0.40 0.70 0.00 0.00 175.22 176.50 1qni n ASP 329 N 0.27 1.90 0.00 1.36 5.68 -1.18 -4.66 116.55 119.93 1qni n ASP 329 Ca -0.15 -1.45 0.00 0.00 -0.50 0.00 0.00 54.79 52.69 1qni n ASP 329 Cb 0.60 0.40 0.00 0.00 -1.14 0.00 0.00 41.12 40.98 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 1.22 0.48 0.61 6.12 0.00 -1.26 -2.62 105.19 109.75 1qni n GLY 330 Ca 0.08 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.16 1qni n GLY 330 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1qni n ARG 331 N -2.11 2.61 0.00 1.61 1.74 -1.26 -4.95 116.66 114.30 1qni n ARG 331 Ca 0.00 -1.95 0.00 0.00 -0.77 0.00 0.00 57.85 55.13 1qni n ARG 331 Cb 0.08 -1.26 0.00 0.00 -1.02 0.00 0.00 32.46 30.26 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 0.32 3.82 -0.13 0.00 -1.26 -5.08 105.19 103.38 1qni n GLY 332 Ca 0.11 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.84 1qni n GLY 332 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1qni s ASN 333 N -2.21 5.76 0.10 1.61 0.01 -1.26 -2.25 114.94 116.70 1qni s ASN 333 Ca 0.00 0.04 0.10 0.00 -0.71 0.00 0.00 52.86 52.29 1qni s ASN 333 Cb 0.00 -1.61 -0.04 0.00 0.41 0.00 0.00 41.25 40.02 1qni s ASN 333 CO 0.00 0.14 -0.26 0.00 -1.51 0.00 0.00 177.10 175.47 1qni s ALA 334 N -1.51 2.29 -0.17 0.60 0.00 0.13 -3.09 121.76 120.02 1qni s ALA 334 Ca 0.31 -1.38 0.01 0.00 0.00 0.00 0.00 51.96 50.90 1qni s ALA 334 Cb -0.12 -0.40 0.02 0.00 0.00 0.00 0.00 23.12 22.62 1qni s ALA 334 CO 0.24 0.52 -0.19 0.71 0.00 0.00 0.00 175.76 177.05 1qni s TYR 335 N -0.98 2.59 0.10 0.00 1.51 -0.41 -0.69 117.35 119.47 1qni s TYR 335 Ca 0.13 -1.49 0.09 0.00 -1.01 0.00 0.00 57.07 54.79 1qni s TYR 335 Cb -0.10 -1.81 -0.03 0.00 -0.11 0.00 0.00 41.96 39.90 1qni s TYR 335 CO 0.05 -0.74 -0.24 0.99 -1.11 0.00 0.00 175.55 174.49 1qni s THR 336 N 1.28 1.99 0.00 -0.71 2.01 -0.42 -0.34 115.64 119.45 1qni s THR 336 Ca 0.03 -1.55 -0.10 0.00 0.31 0.00 0.00 61.69 60.38 1qni s THR 336 Cb -0.13 -1.76 -0.05 0.00 0.01 0.00 0.00 72.50 70.57 1qni s THR 336 CO -0.11 0.11 0.33 0.42 -0.69 0.00 0.00 174.62 174.67 1qni s THR 337 N -1.01 5.19 -0.41 -0.82 -4.23 -0.58 0.56 115.64 114.34 1qni s THR 337 Ca 0.10 0.48 0.04 0.00 -1.18 0.00 0.00 61.69 61.13 1qni s THR 337 Cb -0.10 -3.61 0.11 0.00 1.34 0.00 0.00 72.50 70.25 1qni s THR 337 CO 0.04 0.47 0.13 -0.76 -0.54 0.00 0.00 174.62 173.96 1qni s LEU 338 N -1.42 4.65 0.08 4.79 1.43 0.16 -2.07 118.68 126.29 1qni s LEU 338 Ca 0.25 -2.45 -0.25 0.00 -1.03 0.00 0.00 54.13 50.65 1qni s LEU 338 Cb -0.14 -1.65 -0.10 0.00 0.03 0.00 0.00 46.19 44.33 1qni s LEU 338 CO 0.13 -0.34 1.40 0.15 0.23 0.00 0.00 176.35 177.93 1qni h PHE 339 N 7.25 -1.14 -0.30 0.29 3.57 -0.91 0.68 116.94 126.38 1qni h PHE 339 Ca -0.06 0.04 0.03 0.00 3.53 0.00 0.00 57.97 61.51 1qni h PHE 339 Cb 0.98 0.50 -0.03 0.00 2.79 0.00 0.00 35.95 40.18 1qni h PHE 339 CO 0.49 -0.42 0.09 0.82 -2.23 0.00 0.00 178.31 177.06 1qni h ILE 340 N -0.50 0.90 0.00 1.41 2.04 -1.73 -1.60 117.51 118.03 1qni h ILE 340 Ca 0.01 -0.07 0.00 0.00 1.00 0.00 0.00 64.86 65.79 1qni h ILE 340 Cb 0.53 0.67 0.00 0.00 -0.74 0.00 0.00 36.82 37.28 1qni h ILE 340 CO -0.25 0.04 0.00 0.47 0.00 0.00 0.00 178.15 178.41 1qni n ASP 341 N -5.04 0.00 -3.57 1.72 8.00 -1.17 -4.95 116.55 111.54 1qni n ASP 341 Ca -0.00 0.17 -0.25 0.00 0.71 0.00 0.00 54.79 55.42 1qni n ASP 341 Cb 0.11 -0.39 0.05 0.00 -0.02 0.00 0.00 41.12 40.87 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 -1.39 -4.67 -3.68 -2.24 2.88 0.23 -4.87 113.62 99.88 1qni n SER 342 Ca 0.10 -0.89 -0.07 0.00 -1.33 0.00 0.00 58.87 56.69 1qni n SER 342 Cb 0.28 -4.03 -0.02 0.00 -0.75 0.00 0.00 64.21 59.69 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 -5.56 1.28 -0.13 -1.46 -2.07 -0.86 -1.11 119.66 109.75 1qni s GLN 343 Ca 0.36 -0.64 -0.02 0.00 -1.82 0.00 0.00 55.36 53.24 1qni s GLN 343 Cb -0.10 0.48 -0.03 0.00 -1.09 0.00 0.00 33.01 32.28 1qni s GLN 343 CO 0.82 -0.58 -0.06 0.08 -1.32 0.00 0.00 175.29 174.23 1qni s VAL 344 N -3.48 3.71 -0.21 3.63 1.01 -0.38 0.37 120.40 125.05 1qni s VAL 344 Ca 0.09 -0.43 -0.05 0.00 0.00 0.00 0.00 61.98 61.58 1qni s VAL 344 Cb -0.02 -2.59 -0.02 0.00 0.00 0.00 0.00 36.38 33.74 1qni s VAL 344 CO -0.01 0.52 -0.01 0.00 0.00 0.00 0.00 175.10 175.60 1qni s LYS 346 N 1.15 3.82 0.09 0.00 2.20 -0.19 -1.29 119.74 125.51 1qni s LYS 346 Ca 0.03 -0.16 0.04 0.00 -0.36 0.00 0.00 55.97 55.51 1qni s LYS 346 Cb -0.14 -3.72 -0.03 0.00 -1.51 0.00 0.00 37.83 32.42 1qni s LYS 346 CO 0.01 -0.39 -0.10 1.67 -0.36 0.00 0.00 175.35 176.18 1qni s TRP 347 N 2.07 1.05 -0.20 4.03 1.48 0.14 0.34 118.94 127.84 1qni s TRP 347 Ca 0.14 -0.64 -0.19 0.00 -1.06 0.00 0.00 56.10 54.35 1qni s TRP 347 Cb -0.16 -0.58 -0.03 0.00 -1.16 0.00 0.00 33.47 31.54 1qni s TRP 347 CO 0.11 -0.00 0.55 1.21 -4.06 0.00 0.00 176.95 174.75 1qni s ASN 348 N -2.36 6.60 0.08 -2.66 3.84 0.13 0.20 114.94 120.76 1qni s ASN 348 Ca 0.04 0.72 -0.25 0.00 0.21 0.00 0.00 52.86 53.58 1qni s ASN 348 Cb -0.04 -2.31 -0.16 0.00 -0.55 0.00 0.00 41.25 38.20 1qni s ASN 348 CO 0.00 -0.20 1.69 0.40 -2.79 0.00 0.00 177.10 176.20 1qni h ILE 349 N 5.13 0.87 -0.85 -5.21 2.04 -1.79 -1.66 117.51 116.04 1qni h ILE 349 Ca -0.33 -0.06 0.10 0.00 1.00 0.00 0.00 64.86 65.57 1qni h ILE 349 Cb 1.15 0.91 -0.08 0.00 -0.74 0.00 0.00 36.82 38.07 1qni h ILE 349 CO 0.75 0.01 0.49 0.00 0.00 0.00 0.00 178.15 179.40 1qni h ALA 350 N 0.63 1.22 0.00 1.87 0.00 -1.94 0.42 119.26 121.46 1qni h ALA 350 Ca -0.02 0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 1qni h ALA 350 Cb 0.17 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1qni h ALA 350 CO 0.03 0.10 -0.37 -0.44 0.00 0.00 0.00 179.25 178.57 1qni h ASP 351 N 0.80 0.00 0.77 0.00 3.32 -1.89 -1.19 116.42 118.23 1qni h ASP 351 Ca 0.41 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 57.33 1qni h ASP 351 Cb 0.40 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.93 1qni h ASP 351 CO -0.26 0.37 -0.64 0.00 -1.72 0.00 0.00 179.24 176.99 1qni h ALA 352 N 1.63 0.85 -0.09 3.45 0.00 -0.02 -1.01 119.26 124.06 1qni h ALA 352 Ca -0.00 -0.58 -0.03 0.00 0.00 0.00 0.00 54.91 54.30 1qni h ALA 352 Cb 0.68 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.36 1qni h ALA 352 CO 0.05 0.80 -0.05 0.82 0.00 0.00 0.00 179.25 180.86 1qni h ILE 353 N 0.00 1.33 -0.47 0.00 2.04 -0.24 -2.41 117.51 117.76 1qni h ILE 353 Ca -0.01 -1.10 -0.05 0.00 1.00 0.00 0.00 64.86 64.71 1qni h ILE 353 Cb 1.20 1.87 -0.02 0.00 -0.74 0.00 0.00 36.82 39.13 1qni h ILE 353 CO 0.08 0.31 0.12 0.11 0.00 0.00 0.00 178.15 178.77 1qni h LYS 354 N -0.18 0.76 -0.15 2.37 1.57 -1.18 -2.79 116.57 116.97 1qni h LYS 354 Ca 0.02 -0.18 -0.03 0.00 -1.87 0.00 0.00 60.65 58.59 1qni h LYS 354 Cb 0.52 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.72 1qni h LYS 354 CO 0.02 0.74 -0.04 1.25 -0.57 0.00 0.00 179.45 180.85 1qni h HIS 355 N 0.64 0.22 -0.18 -1.35 2.76 -1.21 -1.50 115.15 114.54 1qni h HIS 355 Ca 0.15 -0.01 -0.13 0.00 -2.20 0.00 0.00 60.37 58.18 1qni h HIS 355 Cb 0.32 -0.07 -0.01 0.00 1.55 0.00 0.00 27.41 29.20 1qni h HIS 355 CO 0.02 0.27 -0.43 -0.92 -1.30 0.00 0.00 177.93 175.58 1qni h TYR 356 N 0.22 0.51 0.00 5.26 3.20 -1.17 -2.74 116.97 122.25 1qni h TYR 356 Ca 0.05 -0.15 0.00 0.00 3.14 0.00 0.00 58.73 61.77 1qni h TYR 356 Cb 0.22 -0.11 0.00 0.00 1.54 0.00 0.00 36.73 38.38 1qni h TYR 356 CO 0.00 0.78 0.00 0.09 -1.64 0.00 0.00 178.16 177.40 1qni n ASN 357 N -4.01 0.00 0.00 -2.11 3.02 -0.79 -4.84 115.26 106.52 1qni n ASN 357 Ca -0.02 -1.22 0.00 0.00 -0.03 0.00 0.00 54.58 53.31 1qni n ASN 357 Cb 0.51 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.68 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 0.72 0.69 0.00 7.41 0.00 -1.03 -5.10 105.19 107.89 1qni n GLY 358 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 1qni n GLY 358 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1qni n ASP 359 N 0.00 -1.95 -0.24 1.61 -0.08 -0.63 -4.98 116.55 110.27 1qni n ASP 359 Ca 0.00 0.00 0.01 0.00 -1.51 0.00 0.00 54.79 53.29 1qni n ASP 359 Cb 0.00 0.00 0.02 0.00 2.34 0.00 0.00 41.12 43.48 1qni n ASP 359 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 1qni n ARG 360 N -1.95 0.45 -2.39 -0.67 1.74 -1.26 -4.76 116.66 107.81 1qni n ARG 360 Ca 0.00 -1.10 -0.34 0.00 -0.77 0.00 0.00 57.85 55.64 1qni n ARG 360 Cb 0.00 -0.68 -0.02 0.00 -1.02 0.00 0.00 32.46 30.74 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 -0.48 3.73 -0.41 1.55 1.01 -1.26 -5.02 120.40 119.52 1qni s VAL 361 Ca 0.04 1.01 -0.21 0.00 0.00 0.00 0.00 61.98 62.83 1qni s VAL 361 Cb 0.04 -3.42 0.02 0.00 0.00 0.00 0.00 36.38 33.02 1qni s VAL 361 CO 0.00 -0.30 0.64 0.20 0.00 0.00 0.00 175.10 175.65 1qni s ASN 362 N -2.16 6.35 0.02 3.32 0.02 -1.26 -4.79 114.94 116.45 1qni s ASN 362 Ca 0.67 -0.18 -0.06 0.00 -1.02 0.00 0.00 52.86 52.27 1qni s ASN 362 Cb -0.17 -2.32 -0.30 0.00 0.02 0.00 0.00 41.25 38.48 1qni s ASN 362 CO 0.25 -0.72 0.92 0.10 0.02 0.00 0.00 177.10 177.67 1qni h TYR 363 N 8.75 0.58 -2.84 2.20 -0.00 -1.89 -3.45 116.97 120.32 1qni h TYR 363 Ca -0.26 -0.43 -0.53 0.00 0.00 0.00 0.00 58.73 57.51 1qni h TYR 363 Cb 1.10 -0.02 0.02 0.00 0.00 0.00 0.00 36.73 37.82 1qni h TYR 363 CO 0.74 1.43 0.87 0.42 -0.00 0.00 0.00 178.16 181.62 1qni s ILE 364 N -2.62 3.25 -0.13 -0.90 1.01 -1.26 -0.70 121.20 119.86 1qni s ILE 364 Ca -0.09 0.77 0.17 0.00 0.00 0.00 0.00 60.65 61.50 1qni s ILE 364 Cb 0.06 -3.49 -0.25 0.00 0.01 0.00 0.00 42.46 38.79 1qni s ILE 364 CO 0.88 0.02 0.18 0.54 0.00 0.00 0.00 174.94 176.55 1qni n ARG 365 N 4.97 0.88 -3.60 2.79 5.12 0.15 -4.94 116.66 122.03 1qni n ARG 365 Ca 0.14 -0.06 -0.04 0.00 -1.93 0.00 0.00 57.85 55.95 1qni n ARG 365 Cb 0.42 -1.47 -0.02 0.00 -1.16 0.00 0.00 32.46 30.22 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 -2.73 0.30 -0.05 5.56 0.74 -0.91 -4.99 119.66 117.58 1qni s GLN 366 Ca -0.08 -0.09 -0.00 0.00 0.05 0.00 0.00 55.36 55.23 1qni s GLN 366 Cb 0.08 0.14 0.03 0.00 1.10 0.00 0.00 33.01 34.35 1qni s GLN 366 CO 0.77 -0.13 0.01 0.15 -0.55 0.00 0.00 175.29 175.54 1qni s LYS 367 N -2.22 0.40 -0.18 1.67 1.02 -1.26 -1.02 119.74 118.14 1qni s LYS 367 Ca 0.09 0.12 -0.01 0.00 0.02 0.00 0.00 55.97 56.18 1qni s LYS 367 Cb -0.01 -0.68 -0.00 0.00 -0.52 0.00 0.00 37.83 36.61 1qni s LYS 367 CO -0.05 -0.21 -0.12 -1.17 -0.92 0.00 0.00 175.35 172.88 1qni s LEU 368 N 1.50 2.61 -0.02 3.17 0.20 -0.45 -4.97 118.68 120.72 1qni s LEU 368 Ca -0.03 -0.44 -0.30 0.00 0.69 0.00 0.00 54.13 54.05 1qni s LEU 368 Cb -0.13 -1.62 -0.07 0.00 -0.43 0.00 0.00 46.19 43.94 1qni s LEU 368 CO -0.03 0.05 1.87 -1.81 -0.29 0.00 0.00 176.35 176.15 1qni s ASP 369 N 1.02 6.45 0.15 3.68 1.01 -1.26 -1.25 116.67 126.45 1qni s ASP 369 Ca -0.01 2.44 -0.04 0.00 0.71 0.00 0.00 52.55 55.65 1qni s ASP 369 Cb -0.15 -2.53 -0.05 0.00 1.01 0.00 0.00 42.92 41.20 1qni s ASP 369 CO -0.02 -1.09 0.38 -0.69 0.21 0.00 0.00 175.17 173.96 1qni s VAL 370 N 4.63 5.17 -0.97 -1.27 1.01 -0.26 -4.91 120.40 123.79 1qni s VAL 370 Ca 0.84 -0.00 -0.22 0.00 0.00 0.00 0.00 61.98 62.60 1qni s VAL 370 Cb -0.38 -3.63 0.08 0.00 0.00 0.00 0.00 36.38 32.44 1qni s VAL 370 CO 0.37 0.02 1.33 -1.10 0.00 0.00 0.00 175.10 175.71 1qni s GLN 371 N -2.72 3.56 -0.07 2.72 1.11 -1.26 -4.53 119.66 118.47 1qni s GLN 371 Ca 0.41 -1.27 -0.05 0.00 0.01 0.00 0.00 55.36 54.46 1qni s GLN 371 Cb -0.12 -5.13 0.02 0.00 -1.01 0.00 0.00 33.01 26.76 1qni s GLN 371 CO 0.25 -2.06 0.10 0.66 0.01 0.00 0.00 175.29 174.25 1qni n TYR 372 N 8.14 -1.95 -3.25 0.91 4.01 -1.26 -4.71 117.16 119.05 1qni n TYR 372 Ca 0.28 1.14 -0.25 0.00 -0.16 0.00 0.00 57.90 58.91 1qni n TYR 372 Cb 0.50 -2.57 0.03 0.00 -0.31 0.00 0.00 39.34 36.98 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 0.74 -2.02 -1.51 -0.72 3.00 -1.26 -2.71 117.38 112.90 1qni n GLN 373 Ca -0.16 1.66 -0.34 0.00 -0.01 0.00 0.00 57.00 58.14 1qni n GLN 373 Cb 0.25 -3.25 0.09 0.00 0.00 0.00 0.00 30.24 27.33 1qni n GLN 373 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.06 174.92 1qni s PRO 374 N -2.36 2.25 0.00 -1.09 0.02 -1.26 -0.73 135.00 131.84 1qni s PRO 374 Ca 0.30 1.76 0.00 0.00 0.02 0.00 0.00 61.00 63.08 1qni s PRO 374 Cb -0.04 -1.85 0.00 0.00 0.02 0.00 0.00 34.50 32.63 1qni s PRO 374 CO 0.77 -1.75 0.00 0.41 -0.33 0.00 0.00 177.00 176.11 1qni n GLY 375 N 0.38 1.42 3.84 0.52 0.00 -0.35 -4.34 105.19 106.67 1qni n GLY 375 Ca 0.13 -0.10 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 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 1.18 3.35 0.03 1.61 3.76 -1.23 -4.22 115.29 119.77 1qni s HIS 376 Ca 0.00 1.39 0.05 0.00 -0.15 0.00 0.00 55.06 56.35 1qni s HIS 376 Cb 0.00 -2.82 -0.02 0.00 1.11 0.00 0.00 32.58 30.85 1qni s HIS 376 CO 0.00 -0.86 -0.15 1.21 -0.85 0.00 0.00 174.74 174.09 1qni s ASN 377 N -3.67 1.75 -0.24 1.40 2.47 -1.26 -2.40 114.94 112.98 1qni s ASN 377 Ca 0.58 -0.44 -0.10 0.00 0.42 0.00 0.00 52.86 53.32 1qni s ASN 377 Cb -0.12 -0.13 0.09 0.00 -1.45 0.00 0.00 41.25 39.64 1qni s ASN 377 CO 0.48 0.07 0.54 -2.28 -3.72 0.00 0.00 177.10 172.19 1qni s HIS 378 N -0.77 -0.97 -0.06 0.43 2.46 -0.80 -4.74 115.29 110.83 1qni s HIS 378 Ca 0.03 1.84 0.01 0.00 0.47 0.00 0.00 55.06 57.41 1qni s HIS 378 Cb -0.08 0.51 -0.03 0.00 -0.13 0.00 0.00 32.58 32.86 1qni s HIS 378 CO 0.01 -0.52 -0.07 0.00 -2.47 0.00 0.00 174.74 171.69 1qni s ALA 379 N 2.26 2.97 -0.40 1.58 0.00 -1.26 -0.35 121.76 126.55 1qni s ALA 379 Ca -0.06 -0.91 -0.42 0.00 0.00 0.00 0.00 51.96 50.57 1qni s ALA 379 Cb -0.10 -1.20 -0.17 0.00 0.00 0.00 0.00 23.12 21.65 1qni s ALA 379 CO -0.16 0.58 1.89 -1.13 0.00 0.00 0.00 175.76 176.93 1qni n SER 380 N 2.16 1.63 -1.42 0.00 3.41 0.13 -0.70 113.62 118.82 1qni n SER 380 Ca -0.18 0.89 -0.15 0.00 -0.26 0.00 0.00 58.87 59.17 1qni n SER 380 Cb 0.53 -1.03 -0.04 0.00 -0.26 0.00 0.00 64.21 63.41 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 6.34 -1.37 -0.12 1.04 4.77 -1.26 -3.13 117.00 123.28 1qni n LEU 381 Ca 0.37 0.20 0.08 0.00 -0.03 0.00 0.00 56.01 56.64 1qni n LEU 381 Cb 0.05 -2.26 0.42 0.00 -2.33 0.00 0.00 43.42 39.30 1qni n LEU 381 CO 0.84 -0.52 1.20 0.00 -1.33 0.00 0.00 177.39 177.58 1qni h THR 382 N 0.00 0.99 -0.15 -5.08 1.03 -1.18 -2.56 112.91 105.96 1qni h THR 382 Ca -0.33 -0.21 -0.01 0.00 -0.01 0.00 0.00 66.41 65.85 1qni h THR 382 Cb 1.12 0.34 -0.01 0.00 -1.07 0.00 0.00 68.15 68.53 1qni h THR 382 CO 0.44 0.11 0.01 -0.62 -0.01 0.00 0.00 175.52 175.46 1qni n GLU 383 N -4.48 1.94 -4.09 0.00 1.02 -1.26 -4.26 120.64 109.51 1qni n GLU 383 Ca 0.09 -0.80 -0.09 0.00 -0.02 0.00 0.00 57.16 56.34 1qni n GLU 383 Cb 0.25 -1.67 -0.09 0.00 -0.02 0.00 0.00 31.44 29.91 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 -0.15 0.26 0.45 1.62 1.04 -0.98 -4.90 113.70 111.04 1qni s SER 384 Ca 0.14 -1.10 0.15 0.00 0.48 0.00 0.00 55.95 55.62 1qni s SER 384 Cb 0.11 0.32 1.07 0.00 0.10 0.00 0.00 66.02 67.61 1qni s SER 384 CO 0.04 -0.75 2.00 0.03 0.98 0.00 0.00 173.24 175.53 1qni h ARG 385 N 2.82 0.35 -0.98 4.02 3.08 -1.42 -2.44 114.38 119.80 1qni h ARG 385 Ca -0.34 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 59.68 1qni h ARG 385 Cb 1.20 -0.08 -0.00 0.00 0.08 0.00 0.00 29.97 31.17 1qni h ARG 385 CO 0.57 0.23 0.01 -0.25 -1.07 0.00 0.00 179.97 179.46 1qni n ASP 386 N -4.47 1.68 -4.49 7.04 8.00 -1.26 -4.90 116.55 118.15 1qni n ASP 386 Ca 0.08 -2.06 -0.47 0.00 0.71 0.00 0.00 54.79 53.06 1qni n ASP 386 Cb 0.35 -0.51 -0.06 0.00 -0.02 0.00 0.00 41.12 40.88 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 0.13 1.21 0.80 2.24 0.00 -0.92 -4.80 120.51 119.16 1qni n ALA 387 Ca 0.02 -0.20 0.13 0.00 0.00 0.00 0.00 53.44 53.39 1qni n ALA 387 Cb 0.36 -2.69 0.32 0.00 0.00 0.00 0.00 19.45 17.44 1qni n ALA 387 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1qni n ASP 388 N 10.91 0.52 -3.68 0.00 5.68 -1.18 -4.30 116.55 124.49 1qni n ASP 388 Ca 0.39 0.14 -0.27 0.00 -0.50 0.00 0.00 54.79 54.55 1qni n ASP 388 Cb 0.31 -0.08 0.04 0.00 -1.14 0.00 0.00 41.12 40.24 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 1.42 -0.77 0.12 6.12 0.00 -1.08 -4.93 105.19 106.07 1qni n GLY 389 Ca 0.05 0.36 -0.06 0.00 0.00 0.00 0.00 46.02 46.37 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 -4.14 0.21 -4.65 1.61 4.76 -1.26 -3.55 118.16 111.14 1qni n LYS 390 Ca -0.16 0.05 -0.27 0.00 -2.87 0.00 0.00 58.31 55.06 1qni n LYS 390 Cb 0.62 -1.13 -0.14 0.00 -1.84 0.00 0.00 35.03 32.54 1qni n LYS 390 CO 0.00 0.00 0.00 -1.58 -1.37 0.00 0.00 177.40 174.45 1qni s TRP 391 N -2.17 2.02 -0.05 2.13 0.52 -1.26 -2.63 118.94 117.50 1qni s TRP 391 Ca -0.11 -0.39 0.01 0.00 0.02 0.00 0.00 56.10 55.62 1qni s TRP 391 Cb 0.03 -1.18 0.02 0.00 -1.15 0.00 0.00 33.47 31.19 1qni s TRP 391 CO 0.19 0.14 -0.04 -1.17 0.02 0.00 0.00 176.95 176.09 1qni s LEU 392 N -1.38 1.24 -0.15 2.99 2.96 -0.27 -0.70 118.68 123.38 1qni s LEU 392 Ca 0.09 -0.13 -0.01 0.00 -0.22 0.00 0.00 54.13 53.87 1qni s LEU 392 Cb -0.09 -0.47 -0.01 0.00 0.50 0.00 0.00 46.19 46.12 1qni s LEU 392 CO 0.03 -0.07 -0.13 -0.69 -1.32 0.00 0.00 176.35 174.17 1qni s VAL 393 N 1.06 3.01 -0.23 1.68 1.01 0.52 0.30 120.40 127.75 1qni s VAL 393 Ca -0.09 -0.66 -0.03 0.00 0.00 0.00 0.00 61.98 61.20 1qni s VAL 393 Cb -0.14 -2.28 0.01 0.00 0.00 0.00 0.00 36.38 33.97 1qni s VAL 393 CO -0.01 0.51 -0.06 -0.69 0.00 0.00 0.00 175.10 174.85 1qni s VAL 394 N 0.58 3.06 -0.49 2.92 1.01 -0.44 -1.91 120.40 125.11 1qni s VAL 394 Ca -0.08 -0.74 -0.15 0.00 0.00 0.00 0.00 61.98 61.02 1qni s VAL 394 Cb -0.16 -2.44 0.10 0.00 0.00 0.00 0.00 36.38 33.88 1qni s VAL 394 CO 0.03 0.35 0.42 -0.76 0.00 0.00 0.00 175.10 175.14 1qni s LEU 395 N 1.40 5.81 0.62 3.92 1.02 -1.01 -0.87 118.68 129.58 1qni s LEU 395 Ca 0.04 -1.55 -0.06 0.00 0.02 0.00 0.00 54.13 52.59 1qni s LEU 395 Cb -0.15 -2.17 0.03 0.00 0.02 0.00 0.00 46.19 43.92 1qni s LEU 395 CO -0.05 -0.72 0.93 -0.44 0.02 0.00 0.00 176.35 176.09 1qni s SER 396 N 2.94 5.32 0.00 2.29 0.01 -0.08 -1.21 113.70 122.97 1qni s SER 396 Ca 0.04 0.57 0.15 0.00 1.31 0.00 0.00 55.95 58.02 1qni s SER 396 Cb -0.26 -1.45 -0.01 0.00 0.21 0.00 0.00 66.02 64.51 1qni s SER 396 CO 0.05 -1.24 0.81 0.29 0.41 0.00 0.00 173.24 173.55 1qni n LYS 397 N -2.67 1.76 -4.36 12.44 4.76 0.09 -3.62 118.16 126.57 1qni n LYS 397 Ca 0.06 -0.74 -0.19 0.00 -2.87 0.00 0.00 58.31 54.57 1qni n LYS 397 Cb 0.59 -1.24 -0.14 0.00 -1.84 0.00 0.00 35.03 32.39 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 -1.84 0.87 -0.03 2.13 0.08 -1.10 -4.89 117.98 113.20 1qni s PHE 398 Ca 0.12 -0.20 0.05 0.00 0.12 0.00 0.00 56.93 57.02 1qni s PHE 398 Cb 0.12 -0.55 -0.07 0.00 -0.57 0.00 0.00 43.02 41.95 1qni s PHE 398 CO 0.39 -0.01 0.06 -1.13 -0.10 0.00 0.00 175.22 174.43 1qni n SER 399 N 2.66 3.85 0.00 1.36 3.41 -1.25 -4.45 113.62 119.20 1qni n SER 399 Ca -0.14 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.47 1qni n SER 399 Cb 0.56 0.90 0.00 0.00 -0.26 0.00 0.00 64.21 65.41 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 -1.94 0.00 -0.17 4.33 5.02 -1.26 0.09 118.16 124.22 1qni n LYS 400 Ca -0.05 0.00 0.12 0.00 -2.02 0.00 0.00 58.31 56.36 1qni n LYS 400 Cb 0.41 0.00 0.20 0.00 -0.02 0.00 0.00 35.03 35.62 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 4.76 3.40 0.15 4.39 5.75 -1.26 -4.55 116.55 129.18 1qni n ASP 401 Ca 0.00 -1.98 0.07 0.00 -0.01 0.00 0.00 54.79 52.88 1qni n ASP 401 Cb 0.00 -0.23 0.57 0.00 -1.03 0.00 0.00 41.12 40.43 1qni n ASP 401 CO 0.00 0.00 0.00 0.03 -0.11 0.00 0.00 177.20 177.12 1qni h ARG 402 N 4.37 0.20 -5.01 0.11 2.47 -0.75 -3.45 114.38 112.31 1qni h ARG 402 Ca 0.00 -0.01 -0.42 0.00 -1.26 0.00 0.00 59.98 58.28 1qni h ARG 402 Cb 0.97 -0.04 -0.14 0.00 -1.65 0.00 0.00 29.97 29.11 1qni h ARG 402 CO 0.00 0.13 -0.59 -0.06 0.56 0.00 0.00 179.97 180.01 1qni s PHE 403 N -5.22 1.71 0.39 3.04 0.08 -1.26 -5.13 117.98 111.59 1qni s PHE 403 Ca -0.06 -1.15 -0.27 0.00 0.12 0.00 0.00 56.93 55.56 1qni s PHE 403 Cb 0.17 -1.05 -0.11 0.00 -0.57 0.00 0.00 43.02 41.47 1qni s PHE 403 CO 0.70 -0.25 1.39 1.28 -0.10 0.00 0.00 175.22 178.23 1qni n LEU 404 N -0.61 4.36 -4.76 -0.37 4.77 -1.26 -4.90 117.00 114.23 1qni n LEU 404 Ca -0.01 1.19 -0.41 0.00 -0.03 0.00 0.00 56.01 56.74 1qni n LEU 404 Cb 0.66 -1.56 -0.01 0.00 -2.33 0.00 0.00 43.42 40.18 1qni n LEU 404 CO 0.38 -0.21 1.17 -2.16 -1.33 0.00 0.00 177.39 175.25 1qni s PRO 405 N -2.11 4.16 -0.06 3.23 0.04 -1.26 -4.90 135.00 134.10 1qni s PRO 405 Ca 0.56 2.50 0.17 0.00 0.04 0.00 0.00 61.00 64.27 1qni s PRO 405 Cb -0.50 -3.03 0.33 0.00 0.04 0.00 0.00 34.50 31.34 1qni s PRO 405 CO 0.62 -0.53 1.15 1.33 0.04 0.00 0.00 177.00 179.60 1qni n VAL 406 N 1.61 0.67 0.00 -0.36 0.24 -1.26 -5.13 118.33 114.09 1qni n VAL 406 Ca 0.05 -1.43 0.00 0.00 -2.04 0.00 0.00 64.34 60.92 1qni n VAL 406 Cb 0.39 0.52 0.00 0.00 -1.47 0.00 0.00 33.84 33.27 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 -2.12 0.27 7.63 0.00 -1.26 -4.64 105.19 104.94 1qni n GLY 407 Ca 0.09 -2.18 0.06 0.00 0.00 0.00 0.00 46.02 44.00 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 3.04 0.16 -5.77 1.61 0.11 -2.04 -3.39 132.00 125.71 1qni h PRO 408 Ca 0.00 -0.01 -0.60 0.00 0.11 0.00 0.00 66.00 65.50 1qni h PRO 408 Cb 0.00 -0.03 -0.10 0.00 0.11 0.00 0.00 31.00 30.98 1qni h PRO 408 CO 0.00 0.13 0.40 -1.17 -0.21 0.00 0.00 178.00 177.15 1qni s LEU 409 N -9.14 4.08 0.10 2.35 0.20 -1.26 -5.04 118.68 109.98 1qni s LEU 409 Ca -0.06 0.69 0.03 0.00 0.69 0.00 0.00 54.13 55.48 1qni s LEU 409 Cb 0.17 -3.08 -0.04 0.00 -0.43 0.00 0.00 46.19 42.81 1qni s LEU 409 CO 0.69 -0.61 0.14 -1.00 -0.29 0.00 0.00 176.35 175.29 1qni s HIS 410 N 2.95 3.29 1.07 5.38 3.76 -1.26 -4.74 115.29 125.75 1qni s HIS 410 Ca 0.32 0.11 -0.18 0.00 -0.15 0.00 0.00 55.06 55.16 1qni s HIS 410 Cb -0.14 -1.64 0.25 0.00 1.11 0.00 0.00 32.58 32.15 1qni s HIS 410 CO 0.12 0.54 1.25 -1.25 -0.85 0.00 0.00 174.74 174.55 1qni s PRO 411 N -2.64 -0.23 0.61 8.40 0.04 -1.26 -4.92 135.00 134.99 1qni s PRO 411 Ca 0.32 -0.34 0.06 0.00 0.04 0.00 0.00 61.00 61.08 1qni s PRO 411 Cb -0.12 -1.74 0.09 0.00 0.04 0.00 0.00 34.50 32.78 1qni s PRO 411 CO 0.24 -3.01 0.84 -1.21 0.04 0.00 0.00 177.00 173.91 1qni s GLU 412 N -5.75 2.14 -0.17 4.56 0.41 0.13 -3.93 118.70 116.09 1qni s GLU 412 Ca 0.74 -1.42 -0.04 0.00 -0.41 0.00 0.00 54.97 53.84 1qni s GLU 412 Cb -0.05 -2.55 0.06 0.00 -1.78 0.00 0.00 34.13 29.81 1qni s GLU 412 CO 0.54 -1.01 0.07 1.21 -0.49 0.00 0.00 175.26 175.58 1qni s ASN 413 N -4.66 2.49 -0.34 -0.19 2.47 -1.24 -2.07 114.94 111.40 1qni s ASN 413 Ca 0.63 -0.66 -0.07 0.00 0.42 0.00 0.00 52.86 53.18 1qni s ASN 413 Cb -0.06 -0.35 0.04 0.00 -1.45 0.00 0.00 41.25 39.42 1qni s ASN 413 CO 0.40 -0.33 0.12 -1.81 -3.72 0.00 0.00 177.10 171.76 1qni s ASP 414 N 2.05 5.36 -0.13 -4.21 1.01 -0.33 -0.90 116.67 119.52 1qni s ASP 414 Ca 0.01 -1.09 -0.09 0.00 0.71 0.00 0.00 52.55 52.09 1qni s ASP 414 Cb -0.16 -1.89 -0.05 0.00 1.01 0.00 0.00 42.92 41.83 1qni s ASP 414 CO -0.09 -0.32 0.18 -1.10 0.21 0.00 0.00 175.17 174.05 1qni s GLN 415 N 1.43 3.77 -0.09 8.23 -0.21 -0.05 -1.39 119.66 131.35 1qni s GLN 415 Ca -0.01 -0.08 -0.17 0.00 0.02 0.00 0.00 55.36 55.12 1qni s GLN 415 Cb -0.19 -3.28 -0.05 0.00 1.00 0.00 0.00 33.01 30.49 1qni s GLN 415 CO 0.03 0.59 0.45 -1.17 -2.12 0.00 0.00 175.29 173.07 1qni s LEU 416 N -0.50 4.32 -0.04 2.90 2.96 0.55 -1.33 118.68 127.54 1qni s LEU 416 Ca 0.14 0.83 0.04 0.00 -0.22 0.00 0.00 54.13 54.93 1qni s LEU 416 Cb -0.12 -2.65 -0.00 0.00 0.50 0.00 0.00 46.19 43.91 1qni s LEU 416 CO 0.03 0.08 -0.17 -0.63 -1.32 0.00 0.00 176.35 174.35 1qni s ILE 417 N 0.23 1.38 -0.26 6.68 1.01 0.15 -0.72 121.20 129.66 1qni s ILE 417 Ca 0.25 -0.70 -0.25 0.00 0.00 0.00 0.00 60.65 59.96 1qni s ILE 417 Cb -0.15 -1.18 -0.00 0.00 0.01 0.00 0.00 42.46 41.13 1qni s ILE 417 CO 0.11 0.40 0.84 -0.62 0.00 0.00 0.00 174.94 175.66 1qni s ASP 418 N -0.01 6.80 -0.06 3.58 -1.08 0.49 -1.11 116.67 125.27 1qni s ASP 418 Ca -0.02 0.95 0.09 0.00 -0.52 0.00 0.00 52.55 53.06 1qni s ASP 418 Cb -0.11 -2.44 0.14 0.00 -1.46 0.00 0.00 42.92 39.06 1qni s ASP 418 CO 0.02 -0.57 1.03 2.30 0.52 0.00 0.00 175.17 178.47 1qni n ILE 419 N 5.36 1.18 0.58 4.11 -5.35 -1.08 -2.37 119.36 121.80 1qni n ILE 419 Ca 0.06 -1.37 0.11 0.00 -0.27 0.00 0.00 62.75 61.28 1qni n ILE 419 Cb 0.48 0.18 0.44 0.00 -1.74 0.00 0.00 39.64 38.99 1qni n ILE 419 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1qni n SER 420 N -0.83 0.35 -2.08 7.28 3.41 -1.21 -4.68 113.62 115.85 1qni n SER 420 Ca 0.08 0.57 -0.01 0.00 -0.26 0.00 0.00 58.87 59.25 1qni n SER 420 Cb 0.54 -0.65 0.00 0.00 -0.26 0.00 0.00 64.21 63.84 1qni n SER 420 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1qni n GLY 421 N 0.49 2.80 0.25 5.00 0.00 -1.26 -5.01 105.19 107.46 1qni n GLY 421 Ca 0.04 -2.16 -0.14 0.00 0.00 0.00 0.00 46.02 43.76 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 0.86 -5.92 1.61 4.81 -1.97 -3.45 114.58 110.52 1qni h GLU 422 Ca -0.01 -0.51 -0.62 0.00 -0.13 0.00 0.00 59.36 58.09 1qni h GLU 422 Cb 0.03 0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.42 1qni h GLU 422 CO 0.01 1.15 -0.51 -1.21 -0.73 0.00 0.00 179.01 177.72 1qni s GLU 423 N -4.21 3.40 -0.07 1.92 2.02 -1.26 -5.03 118.70 115.47 1qni s GLU 423 Ca -0.10 -0.45 -0.20 0.00 0.02 0.00 0.00 54.97 54.23 1qni s GLU 423 Cb 0.11 -3.02 -0.04 0.00 0.10 0.00 0.00 34.13 31.27 1qni s GLU 423 CO 0.88 0.61 0.57 -1.64 0.02 0.00 0.00 175.26 175.70 1qni s MET 424 N -2.47 4.35 -0.06 1.61 -1.94 -1.26 -4.67 119.30 114.86 1qni s MET 424 Ca 0.34 0.64 0.02 0.00 -1.71 0.00 0.00 55.69 54.98 1qni s MET 424 Cb -0.13 -3.41 0.01 0.00 2.01 0.00 0.00 34.83 33.31 1qni s MET 424 CO 0.27 0.19 -0.11 0.15 -0.01 0.00 0.00 175.02 175.51 1qni s LYS 425 N 0.46 1.58 0.21 2.03 1.02 -1.00 -4.98 119.74 119.05 1qni s LYS 425 Ca 0.31 -0.37 -0.30 0.00 0.02 0.00 0.00 55.97 55.62 1qni s LYS 425 Cb -0.17 -1.32 -0.09 0.00 -0.52 0.00 0.00 37.83 35.73 1qni s LYS 425 CO 0.14 0.02 1.26 -1.17 -0.92 0.00 0.00 175.35 174.68 1qni s LEU 426 N 0.68 4.44 0.00 3.17 2.96 -1.26 -0.38 118.68 128.28 1qni s LEU 426 Ca -0.14 2.35 0.00 0.00 -0.22 0.00 0.00 54.13 56.12 1qni s LEU 426 Cb -0.15 -3.61 0.00 0.00 0.50 0.00 0.00 46.19 42.92 1qni s LEU 426 CO 0.03 -0.45 0.00 0.52 -1.32 0.00 0.00 176.35 175.13 1qni n VAL 427 N 2.36 0.00 -3.65 1.68 0.31 0.10 -4.88 118.33 114.26 1qni n VAL 427 Ca 0.05 0.00 -0.14 0.00 -0.01 0.00 0.00 64.34 64.23 1qni n VAL 427 Cb 0.43 -0.77 -0.08 0.00 -0.91 0.00 0.00 33.84 32.52 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 -1.95 -0.64 -0.38 3.52 5.65 -1.04 -4.98 115.29 115.47 1qni s HIS 428 Ca 0.00 1.49 -0.10 0.00 0.25 0.00 0.00 55.06 56.70 1qni s HIS 428 Cb 0.00 0.25 0.04 0.00 -1.18 0.00 0.00 32.58 31.69 1qni s HIS 428 CO 0.00 -0.37 0.20 -0.51 -0.65 0.00 0.00 174.74 173.41 1qni s ASP 429 N -0.01 5.65 -0.38 9.88 1.11 -1.26 -0.33 116.67 131.33 1qni s ASP 429 Ca -0.03 -1.14 -0.10 0.00 0.18 0.00 0.00 52.55 51.46 1qni s ASP 429 Cb -0.04 -1.99 0.04 0.00 1.07 0.00 0.00 42.92 42.01 1qni s ASP 429 CO 0.02 -0.41 0.20 -0.83 1.18 0.00 0.00 175.17 175.33 1qni s GLY 430 N 1.66 1.92 0.20 0.21 0.00 -0.49 -4.96 107.32 105.86 1qni s GLY 430 Ca 0.01 -1.84 -0.30 0.00 0.00 0.00 0.00 44.72 42.59 1qni s GLY 430 CO 0.05 0.87 1.32 2.56 0.00 0.00 0.00 173.10 177.89 1qni s PRO 431 N 1.49 4.38 0.04 2.90 0.04 -1.26 -1.19 135.00 141.40 1qni s PRO 431 Ca 0.01 2.06 0.03 0.00 0.04 0.00 0.00 61.00 63.15 1qni s PRO 431 Cb -0.20 -3.19 -0.02 0.00 0.04 0.00 0.00 34.50 31.12 1qni s PRO 431 CO 0.05 -0.27 -0.10 0.99 0.04 0.00 0.00 177.00 177.72 1qni s THR 432 N 0.15 0.72 0.59 1.26 2.01 -0.88 -4.94 115.64 114.54 1qni s THR 432 Ca 0.57 -0.95 -0.04 0.00 0.31 0.00 0.00 61.69 61.58 1qni s THR 432 Cb -0.37 -0.71 0.02 0.00 0.01 0.00 0.00 72.50 71.46 1qni s THR 432 CO 0.38 -0.20 0.87 -0.47 -0.69 0.00 0.00 174.62 174.51 1qni s TYR 433 N -1.05 3.09 -0.21 4.92 5.04 -1.26 0.19 117.35 128.07 1qni s TYR 433 Ca -0.04 0.40 -0.05 0.00 -2.44 0.00 0.00 57.07 54.94 1qni s TYR 433 Cb -0.08 -2.78 0.01 0.00 0.35 0.00 0.00 41.96 39.45 1qni s TYR 433 CO 0.01 -0.90 0.19 0.00 -1.34 0.00 0.00 175.55 173.51 1qni n ALA 434 N -2.54 -1.49 -0.10 3.97 0.00 -1.26 -4.19 120.51 114.90 1qni n ALA 434 Ca 0.05 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.48 1qni n ALA 434 Cb 0.59 -0.39 0.00 0.00 0.00 0.00 0.00 19.45 19.65 1qni n ALA 434 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1qni n GLU 435 N -0.73 0.00 -2.39 0.00 2.13 -1.26 -4.14 120.64 114.25 1qni n GLU 435 Ca -0.07 0.00 -0.28 0.00 0.66 0.00 0.00 57.16 57.47 1qni n GLU 435 Cb 0.21 0.00 0.01 0.00 0.27 0.00 0.00 31.44 31.94 1qni n GLU 435 CO 0.00 0.00 0.00 -1.25 -0.41 0.00 0.00 177.13 175.47 1qni s PRO 436 N 0.00 3.33 0.00 5.31 0.04 -1.26 -3.22 135.00 139.20 1qni s PRO 436 Ca 0.00 0.25 0.00 0.00 0.04 0.00 0.00 61.00 61.29 1qni s PRO 436 Cb 0.00 -2.27 0.00 0.00 0.04 0.00 0.00 34.50 32.27 1qni s PRO 436 CO 0.00 -0.47 0.00 0.72 0.04 0.00 0.00 177.00 177.29 1qni n HIS 437 N -2.49 0.00 -3.25 0.56 8.25 -1.26 -4.91 115.22 112.13 1qni n HIS 437 Ca 0.03 0.00 -0.19 0.00 -0.26 0.00 0.00 57.72 57.30 1qni n HIS 437 Cb 0.56 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.67 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 0.56 5.31 0.17 0.41 2.15 -0.90 -4.22 116.67 120.15 1qni s ASP 438 Ca 0.00 -0.64 -0.19 0.00 0.43 0.00 0.00 52.55 52.15 1qni s ASP 438 Cb 0.00 -0.42 0.04 0.00 -0.30 0.00 0.00 42.92 42.24 1qni s ASP 438 CO 0.00 -0.83 0.51 0.00 -0.17 0.00 0.00 175.17 174.67 1qni s ILE 440 N -3.82 0.36 0.00 0.00 2.07 -1.08 -4.90 121.20 113.84 1qni s ILE 440 Ca 0.05 -0.18 0.01 0.00 -1.41 0.00 0.00 60.65 59.12 1qni s ILE 440 Cb -0.00 -0.32 -0.04 0.00 0.13 0.00 0.00 42.46 42.23 1qni s ILE 440 CO -0.08 0.11 0.03 -0.76 -1.91 0.00 0.00 174.94 172.33 1qni s LEU 441 N -0.02 3.64 -0.04 8.50 1.43 -1.26 -1.45 118.68 129.48 1qni s LEU 441 Ca 0.01 0.03 -0.06 0.00 -1.03 0.00 0.00 54.13 53.08 1qni s LEU 441 Cb -0.03 -2.12 0.01 0.00 0.03 0.00 0.00 46.19 44.08 1qni s LEU 441 CO -0.00 0.27 0.14 0.68 0.23 0.00 0.00 176.35 177.67 1qni s VAL 442 N -1.14 0.03 0.41 -1.59 -7.23 -0.86 -3.99 120.40 106.03 1qni s VAL 442 Ca 0.21 -0.22 -0.27 0.00 -1.81 0.00 0.00 61.98 59.89 1qni s VAL 442 Cb -0.12 -0.28 -0.10 0.00 0.56 0.00 0.00 36.38 36.44 1qni s VAL 442 CO 0.12 -0.12 1.47 -0.13 -0.31 0.00 0.00 175.10 176.13 1qni s ARG 443 N -0.37 3.89 0.38 4.82 0.52 -1.26 -0.98 118.95 125.94 1qni s ARG 443 Ca -0.05 2.52 0.18 0.00 -0.52 0.00 0.00 55.73 57.86 1qni s ARG 443 Cb -0.03 -2.82 1.12 0.00 0.52 0.00 0.00 34.95 33.74 1qni s ARG 443 CO 0.01 -0.69 1.71 -0.09 0.02 0.00 0.00 175.30 176.26 1qni h ARG 444 N 2.66 0.35 0.00 3.54 2.43 -1.67 0.14 114.38 121.83 1qni h ARG 444 Ca -0.51 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.64 1qni h ARG 444 Cb 1.25 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.72 1qni h ARG 444 CO 0.63 0.23 0.00 -0.40 -1.51 0.00 0.00 179.97 178.92 1qni n ASP 445 N -4.78 0.00 0.01 -3.80 5.68 -1.26 -3.34 116.55 109.05 1qni n ASP 445 Ca 0.29 -0.92 0.12 0.00 -0.50 0.00 0.00 54.79 53.78 1qni n ASP 445 Cb 0.98 -0.01 0.14 0.00 -1.14 0.00 0.00 41.12 41.09 1qni n ASP 445 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1qni n GLN 446 N -1.01 0.08 -4.79 0.11 6.02 0.48 -4.85 117.38 113.42 1qni n GLN 446 Ca 0.23 0.01 -0.33 0.00 -0.01 0.00 0.00 57.00 56.89 1qni n GLN 446 Cb 0.11 -1.53 -0.13 0.00 1.02 0.00 0.00 30.24 29.70 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 -3.05 3.16 -0.47 5.09 -1.09 -1.21 -3.63 121.20 119.99 1qni s ILE 447 Ca 0.09 -0.65 0.03 0.00 -2.23 0.00 0.00 60.65 57.88 1qni s ILE 447 Cb 0.16 -2.29 0.12 0.00 -1.58 0.00 0.00 42.46 38.88 1qni s ILE 447 CO 0.75 0.56 0.21 -0.54 -1.23 0.00 0.00 174.94 174.68 1qni s LYS 448 N -0.17 1.88 0.66 2.79 1.02 -1.26 -5.02 119.74 119.64 1qni s LYS 448 Ca 0.00 -2.33 -0.12 0.00 0.02 0.00 0.00 55.97 53.54 1qni s LYS 448 Cb -0.13 -3.34 -0.01 0.00 -0.52 0.00 0.00 37.83 33.82 1qni s LYS 448 CO 0.03 -1.06 1.05 0.99 -0.92 0.00 0.00 175.35 175.44 1qni s THR 449 N 0.19 4.20 0.07 2.17 2.01 -1.26 -4.51 115.64 118.51 1qni s THR 449 Ca 0.15 0.77 0.09 0.00 0.31 0.00 0.00 61.69 63.01 1qni s THR 449 Cb -0.23 -3.53 -0.03 0.00 0.01 0.00 0.00 72.50 68.72 1qni s THR 449 CO -0.03 -0.88 -0.25 -0.54 -0.69 0.00 0.00 174.62 172.23 1qni s LYS 450 N -4.92 1.75 -0.22 4.92 1.02 -0.21 -5.04 119.74 117.04 1qni s LYS 450 Ca 0.58 -1.15 0.10 0.00 0.02 0.00 0.00 55.97 55.52 1qni s LYS 450 Cb -0.13 -2.01 -0.21 0.00 -0.52 0.00 0.00 37.83 34.96 1qni s LYS 450 CO 0.51 0.50 -0.06 1.17 -0.92 0.00 0.00 175.35 176.56 1qni n LYS 451 N 1.46 0.67 -4.20 1.68 3.00 -1.26 -4.84 118.16 114.68 1qni n LYS 451 Ca -0.17 0.07 -0.17 0.00 -0.00 0.00 0.00 58.31 58.04 1qni n LYS 451 Cb 0.52 -1.53 -0.12 0.00 0.00 0.00 0.00 35.03 33.90 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 -2.51 0.92 0.41 3.15 -5.25 -1.26 -4.72 121.20 111.95 1qni s ILE 452 Ca -0.22 -1.09 -0.24 0.00 -0.99 0.00 0.00 60.65 58.11 1qni s ILE 452 Cb 0.07 -0.89 -0.08 0.00 2.95 0.00 0.00 42.46 44.51 1qni s ILE 452 CO 0.72 -0.18 1.10 -0.31 -1.79 0.00 0.00 174.94 174.49 1qni s TYR 453 N -1.10 3.13 -0.02 1.37 2.02 -0.71 -5.04 117.35 117.00 1qni s TYR 453 Ca -0.03 1.60 -0.18 0.00 -0.37 0.00 0.00 57.07 58.10 1qni s TYR 453 Cb -0.09 -3.24 -0.05 0.00 -0.40 0.00 0.00 41.96 38.17 1qni s TYR 453 CO 0.01 -0.98 0.50 -1.21 -1.57 0.00 0.00 175.55 172.30 1qni s GLU 454 N -2.50 4.17 0.12 -0.62 2.02 -1.26 -4.73 118.70 115.89 1qni s GLU 454 Ca 0.59 0.55 0.08 0.00 0.02 0.00 0.00 54.97 56.21 1qni s GLU 454 Cb -0.25 -3.30 0.43 0.00 0.10 0.00 0.00 34.13 31.10 1qni s GLU 454 CO 0.32 0.48 1.24 0.54 0.02 0.00 0.00 175.26 177.86 1qni n ARG 455 N 2.45 0.05 -0.58 1.61 5.12 -1.26 -1.21 116.66 122.84 1qni n ARG 455 Ca -0.10 0.55 0.07 0.00 -1.93 0.00 0.00 57.85 56.44 1qni n ARG 455 Cb 0.52 -1.67 0.29 0.00 -1.16 0.00 0.00 32.46 30.44 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 -1.78 4.25 -4.77 0.55 2.04 -1.26 -5.01 115.26 109.28 1qni n ASN 456 Ca -0.01 -3.05 -0.38 0.00 -0.44 0.00 0.00 54.58 50.70 1qni n ASN 456 Cb 0.01 -0.59 -0.00 0.00 -2.53 0.00 0.00 39.78 36.67 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 -1.69 6.13 0.49 0.53 -1.08 -0.35 -4.93 116.67 115.77 1qni s ASP 457 Ca 0.46 2.45 0.20 0.00 -0.52 0.00 0.00 52.55 55.14 1qni s ASP 457 Cb 0.37 -2.62 1.25 0.00 -1.46 0.00 0.00 42.92 40.46 1qni s ASP 457 CO 0.10 -0.95 2.06 -0.65 0.52 0.00 0.00 175.17 176.24 1qni h PRO 458 N 2.20 0.00 0.00 4.34 0.11 -1.95 -3.17 132.00 133.54 1qni h PRO 458 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1qni h PRO 458 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 1qni h PRO 458 CO 0.61 0.13 0.00 0.98 -0.21 0.00 0.00 178.00 179.51 1qni n TYR 459 N -4.08 0.00 -2.17 0.65 9.36 -1.26 -2.43 117.16 117.24 1qni n TYR 459 Ca -0.02 0.00 -0.02 0.00 3.32 0.00 0.00 57.90 61.17 1qni n TYR 459 Cb 0.21 -0.27 -0.03 0.00 -0.63 0.00 0.00 39.34 38.62 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 -1.27 0.00 0.17 2.98 1.16 -1.20 -4.90 117.46 114.40 1qni n PHE 460 Ca 0.01 -0.43 0.06 0.00 -1.87 0.00 0.00 57.45 55.22 1qni n PHE 460 Cb 0.02 0.23 0.52 0.00 -1.61 0.00 0.00 39.48 38.63 1qni n PHE 460 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1qni h ALA 461 N 0.34 1.78 -0.14 1.98 0.00 -1.51 0.46 119.26 122.17 1qni h ALA 461 Ca -0.37 -0.08 -0.13 0.00 0.00 0.00 0.00 54.91 54.33 1qni h ALA 461 Cb 1.54 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.26 1qni h ALA 461 CO -0.12 0.17 -0.49 0.66 0.00 0.00 0.00 179.25 179.47 1qni h SER 462 N 0.16 0.39 -0.16 0.00 4.64 -1.91 -1.98 113.55 114.68 1qni h SER 462 Ca 0.04 -0.19 -0.02 0.00 -0.47 0.00 0.00 61.79 61.15 1qni h SER 462 Cb 0.12 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 62.10 1qni h SER 462 CO 0.00 0.82 0.04 0.00 -0.87 0.00 0.00 176.83 176.82 1qni n ARG 464 N -4.81 0.23 -0.04 0.00 1.85 -0.93 -1.32 116.66 111.65 1qni n ARG 464 Ca -0.05 0.27 -0.16 0.00 -1.00 0.00 0.00 57.85 56.91 1qni n ARG 464 Cb 0.17 -1.81 -0.05 0.00 -1.05 0.00 0.00 32.46 29.71 1qni n ARG 464 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1qni h ALA 465 N 2.47 0.38 0.01 2.89 0.00 -0.98 0.08 119.26 124.10 1qni h ALA 465 Ca 0.00 -0.57 -0.22 0.00 0.00 0.00 0.00 54.91 54.12 1qni h ALA 465 Cb 0.62 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.37 1qni h ALA 465 CO 0.00 0.69 -0.94 0.37 0.00 0.00 0.00 179.25 179.36 1qni h GLN 466 N 0.57 0.32 -0.59 0.00 5.75 -1.08 -3.01 115.11 117.07 1qni h GLN 466 Ca -0.03 -0.36 -0.01 0.00 -0.15 0.00 0.00 58.65 58.10 1qni h GLN 466 Cb 1.32 0.11 -0.03 0.00 1.07 0.00 0.00 27.48 29.95 1qni h GLN 466 CO 0.15 1.06 0.34 0.00 -2.65 0.00 0.00 178.83 177.73 1qni h ALA 467 N 0.81 0.75 0.14 3.38 0.00 -1.12 -1.25 119.26 121.98 1qni h ALA 467 Ca -0.07 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 54.77 1qni h ALA 467 Cb 1.58 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 19.11 1qni h ALA 467 CO 0.16 0.25 -0.22 1.49 0.00 0.00 0.00 179.25 180.92 1qni h GLU 468 N 0.79 -0.41 -1.01 0.00 4.57 -0.97 0.15 114.58 117.70 1qni h GLU 468 Ca 0.21 0.03 0.09 0.00 -1.18 0.00 0.00 59.36 58.51 1qni h GLU 468 Cb 0.01 0.09 -0.08 0.00 -0.16 0.00 0.00 28.75 28.62 1qni h GLU 468 CO -0.04 -0.28 0.64 0.87 -1.18 0.00 0.00 179.01 179.03 1qni h LYS 469 N -0.43 1.06 -0.00 1.92 1.57 -1.37 1.00 116.57 120.32 1qni h LYS 469 Ca 0.02 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1qni h LYS 469 Cb 0.44 -0.24 0.00 0.00 0.08 0.00 0.00 32.23 32.51 1qni h LYS 469 CO -0.10 0.70 -0.01 -0.25 -0.57 0.00 0.00 179.45 179.22 1qni n ASP 470 N -4.56 0.20 -3.04 0.86 8.00 -0.49 -4.92 116.55 112.60 1qni n ASP 470 Ca 0.17 -0.87 -0.18 0.00 0.71 0.00 0.00 54.79 54.62 1qni n ASP 470 Cb 0.27 -0.05 0.07 0.00 -0.02 0.00 0.00 41.12 41.38 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 1.09 -0.27 3.35 0.44 0.00 0.34 -5.02 105.19 105.13 1qni n GLY 471 Ca 0.21 0.07 -0.31 0.00 0.00 0.00 0.00 46.02 45.99 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 2.27 -0.53 1.61 -7.23 -0.00 -5.02 120.40 108.23 1qni s VAL 472 Ca 0.37 -1.13 -0.18 0.00 -1.81 0.00 0.00 61.98 59.23 1qni s VAL 472 Cb -0.16 -1.84 0.09 0.00 0.56 0.00 0.00 36.38 35.03 1qni s VAL 472 CO 0.60 0.51 0.58 -0.89 -0.31 0.00 0.00 175.10 175.59 1qni s THR 473 N -0.70 4.99 0.38 5.32 2.01 -1.26 -4.42 115.64 121.97 1qni s THR 473 Ca 0.11 -0.93 0.14 0.00 0.31 0.00 0.00 61.69 61.32 1qni s THR 473 Cb -0.10 -4.32 0.36 0.00 0.01 0.00 0.00 72.50 68.44 1qni s THR 473 CO 0.00 -0.86 1.83 -0.07 -0.69 0.00 0.00 174.62 174.84 1qni h LEU 474 N 9.44 0.53 0.00 4.42 3.38 -1.95 0.18 115.31 131.31 1qni h LEU 474 Ca -0.29 0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.74 1qni h LEU 474 Cb 1.10 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.81 1qni h LEU 474 CO 1.00 0.21 0.00 -0.62 0.09 0.00 0.00 178.44 179.12 1qni n GLU 475 N -4.58 0.74 0.00 1.13 4.71 -1.26 -4.23 120.64 117.15 1qni n GLU 475 Ca 0.20 0.01 0.00 0.00 -0.01 0.00 0.00 57.16 57.36 1qni n GLU 475 Cb 0.65 -1.50 0.00 0.00 -1.01 0.00 0.00 31.44 29.58 1qni n GLU 475 CO 0.00 0.00 0.00 -1.13 0.09 0.00 0.00 177.13 176.09 1qni n SER 476 N -1.08 0.00 -4.86 1.62 3.41 -0.61 -5.00 113.62 107.10 1qni n SER 476 Ca 0.19 0.00 -0.31 0.00 -0.26 0.00 0.00 58.87 58.49 1qni n SER 476 Cb 0.13 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.05 1qni n SER 476 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1qni s ASP 477 N 0.00 6.54 -0.37 4.04 1.01 0.52 -5.00 116.67 123.41 1qni s ASP 477 Ca 0.00 1.34 0.02 0.00 0.71 0.00 0.00 52.55 54.62 1qni s ASP 477 Cb 0.00 -2.41 0.15 0.00 1.01 0.00 0.00 42.92 41.67 1qni s ASP 477 CO 0.00 -0.52 0.29 0.20 0.21 0.00 0.00 175.17 175.35 1qni s ASN 478 N -3.21 2.11 0.28 0.27 0.01 -1.26 -4.15 114.94 109.00 1qni s ASN 478 Ca 0.55 -2.17 0.05 0.00 -0.71 0.00 0.00 52.86 50.58 1qni s ASN 478 Cb -0.10 -0.09 -0.06 0.00 0.41 0.00 0.00 41.25 41.41 1qni s ASN 478 CO 0.33 -0.27 -0.02 -0.54 -1.51 0.00 0.00 177.10 175.09 1qni s LYS 479 N 0.99 1.54 -0.11 -0.60 1.02 -0.77 -4.98 119.74 116.83 1qni s LYS 479 Ca 0.21 -1.80 -0.01 0.00 0.02 0.00 0.00 55.97 54.39 1qni s LYS 479 Cb -0.16 -1.01 0.03 0.00 -0.52 0.00 0.00 37.83 36.17 1qni s LYS 479 CO -0.03 -0.04 -0.04 0.08 -0.92 0.00 0.00 175.35 174.40 1qni s VAL 480 N -3.13 0.82 -0.17 3.17 1.01 -1.26 -0.94 120.40 119.90 1qni s VAL 480 Ca 0.31 -0.23 -0.01 0.00 0.00 0.00 0.00 61.98 62.05 1qni s VAL 480 Cb 0.05 -0.93 -0.01 0.00 0.00 0.00 0.00 36.38 35.50 1qni s VAL 480 CO 0.12 0.27 -0.12 -0.63 0.00 0.00 0.00 175.10 174.74 1qni s ILE 481 N 1.78 2.93 -0.27 2.22 1.01 0.12 -4.99 121.20 123.99 1qni s ILE 481 Ca 0.04 -0.68 -0.10 0.00 0.00 0.00 0.00 60.65 59.91 1qni s ILE 481 Cb -0.13 -2.26 -0.05 0.00 0.01 0.00 0.00 42.46 40.03 1qni s ILE 481 CO -0.07 0.50 0.17 -0.13 0.00 0.00 0.00 174.94 175.41 1qni s ARG 482 N 0.89 3.93 -0.60 2.79 0.52 -1.26 -1.11 118.95 124.10 1qni s ARG 482 Ca -0.03 -0.33 0.06 0.00 -0.52 0.00 0.00 55.73 54.91 1qni s ARG 482 Cb -0.15 -3.61 0.23 0.00 0.52 0.00 0.00 34.95 31.94 1qni s ARG 482 CO -0.00 -0.15 0.63 -3.47 0.02 0.00 0.00 175.30 172.32 1qni n ASP 483 N 4.95 2.73 0.00 0.23 2.03 0.99 -5.02 116.55 122.46 1qni n ASP 483 Ca -0.14 -3.20 0.00 0.00 0.52 0.00 0.00 54.79 51.97 1qni n ASP 483 Cb 0.52 -0.68 0.00 0.00 -0.72 0.00 0.00 41.12 40.24 1qni n ASP 483 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1qni n GLY 484 N 1.33 1.49 0.07 0.27 0.00 -1.26 -1.39 105.19 105.69 1qni n GLY 484 Ca 0.26 0.05 0.12 0.00 0.00 0.00 0.00 46.02 46.45 1qni n GLY 484 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1qni h ASN 485 N 0.00 0.00 -3.11 1.61 2.35 -1.96 -3.46 115.58 111.00 1qni h ASN 485 Ca 0.00 -0.22 -0.60 0.00 -0.55 0.00 0.00 56.30 54.94 1qni h ASN 485 Cb 0.00 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 38.31 1qni h ASN 485 CO 0.00 0.11 -0.16 -0.54 -1.65 0.00 0.00 177.43 175.18 1qni s LYS 486 N -3.18 4.05 -0.08 0.81 1.02 -0.48 0.10 119.74 121.97 1qni s LYS 486 Ca 0.06 0.47 -0.02 0.00 0.02 0.00 0.00 55.97 56.50 1qni s LYS 486 Cb 0.13 -3.27 0.03 0.00 -0.52 0.00 0.00 37.83 34.21 1qni s LYS 486 CO 0.73 0.58 0.01 0.08 -0.92 0.00 0.00 175.35 175.83 1qni s VAL 487 N -0.75 0.35 -0.21 3.17 1.01 -0.21 -0.01 120.40 123.75 1qni s VAL 487 Ca 0.25 0.07 -0.04 0.00 0.00 0.00 0.00 61.98 62.26 1qni s VAL 487 Cb -0.17 -0.56 -0.01 0.00 0.00 0.00 0.00 36.38 35.64 1qni s VAL 487 CO 0.14 0.20 -0.03 -0.13 0.00 0.00 0.00 175.10 175.27 1qni s ARG 488 N 1.98 3.44 -0.19 2.72 0.52 -0.27 -0.47 118.95 126.69 1qni s ARG 488 Ca 0.04 -0.60 -0.03 0.00 -0.52 0.00 0.00 55.73 54.63 1qni s ARG 488 Cb -0.13 -3.02 -0.01 0.00 0.52 0.00 0.00 34.95 32.31 1qni s ARG 488 CO -0.05 -0.13 -0.06 0.08 0.02 0.00 0.00 175.30 175.15 1qni s VAL 489 N 1.32 3.37 -0.21 3.52 1.01 0.74 -0.71 120.40 129.45 1qni s VAL 489 Ca 0.04 -0.51 -0.03 0.00 0.00 0.00 0.00 61.98 61.47 1qni s VAL 489 Cb -0.14 -2.50 -0.01 0.00 0.00 0.00 0.00 36.38 33.73 1qni s VAL 489 CO -0.01 0.46 -0.06 -0.31 0.00 0.00 0.00 175.10 175.18 1qni s TYR 490 N 1.03 2.94 0.13 5.22 1.51 -0.12 0.47 117.35 128.53 1qni s TYR 490 Ca 0.00 -0.90 0.08 0.00 -1.01 0.00 0.00 57.07 55.24 1qni s TYR 490 Cb -0.15 -2.07 -0.04 0.00 -0.11 0.00 0.00 41.96 39.60 1qni s TYR 490 CO -0.00 -0.50 -0.19 -1.64 -1.11 0.00 0.00 175.55 172.10 1qni s MET 491 N 1.31 1.17 0.20 -0.62 -1.94 0.31 -1.84 119.30 117.89 1qni s MET 491 Ca 0.04 -1.25 0.09 0.00 -1.71 0.00 0.00 55.69 52.85 1qni s MET 491 Cb -0.14 -1.33 -0.04 0.00 2.01 0.00 0.00 34.83 35.33 1qni s MET 491 CO -0.03 0.29 -0.05 -0.08 -0.01 0.00 0.00 175.02 175.15 1qni s THR 492 N -1.55 3.39 -0.02 2.05 -1.32 -1.26 -1.28 115.64 115.66 1qni s THR 492 Ca 0.10 -1.67 0.00 0.00 -1.21 0.00 0.00 61.69 58.91 1qni s THR 492 Cb -0.08 -2.72 0.02 0.00 -1.51 0.00 0.00 72.50 68.21 1qni s THR 492 CO 0.05 -0.18 0.02 -0.94 -2.21 0.00 0.00 174.62 171.36 1qni s SER 493 N -3.08 0.12 0.10 8.08 1.04 0.19 0.35 113.70 120.50 1qni s SER 493 Ca 0.27 0.02 -0.13 0.00 0.48 0.00 0.00 55.95 56.59 1qni s SER 493 Cb -0.08 -0.08 0.02 0.00 0.10 0.00 0.00 66.02 65.98 1qni s SER 493 CO 0.17 -0.09 0.32 0.68 0.98 0.00 0.00 173.24 175.30 1qni s VAL 494 N 0.82 0.10 0.00 5.02 -7.23 -0.84 -1.03 120.40 117.24 1qni s VAL 494 Ca -0.07 -0.78 0.00 0.00 -1.81 0.00 0.00 61.98 59.32 1qni s VAL 494 Cb -0.10 -1.19 0.00 0.00 0.56 0.00 0.00 36.38 35.65 1qni s VAL 494 CO -0.02 -0.43 0.00 0.00 -0.31 0.00 0.00 175.10 174.34 1qni n ALA 495 N -0.06 0.00 -1.05 1.32 0.00 -1.26 -0.56 120.51 118.91 1qni n ALA 495 Ca -0.16 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.03 1qni n ALA 495 Cb 0.63 0.00 0.07 0.00 0.00 0.00 0.00 19.45 20.14 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 12.94 2.19 -3.83 0.00 -0.04 -1.26 -4.92 135.00 140.08 1qni n PRO 496 Ca 0.00 -2.38 -0.12 0.00 -0.04 0.00 0.00 63.50 60.96 1qni n PRO 496 Cb 0.00 -1.93 -0.13 0.00 -0.04 0.00 0.00 33.50 31.40 1qni n PRO 496 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 1qni s GLN 497 N -2.75 0.12 0.31 0.54 -0.21 0.28 -3.95 119.66 114.00 1qni s GLN 497 Ca 0.47 0.15 -0.15 0.00 0.02 0.00 0.00 55.36 55.84 1qni s GLN 497 Cb 0.37 0.06 -0.09 0.00 1.00 0.00 0.00 33.01 34.35 1qni s GLN 497 CO 0.00 -0.02 0.74 0.71 -2.12 0.00 0.00 175.29 174.60 1qni s TYR 498 N 0.07 3.40 -2.00 0.91 2.02 -1.26 -1.98 117.35 118.51 1qni s TYR 498 Ca -0.00 1.24 0.15 0.00 -0.37 0.00 0.00 57.07 58.09 1qni s TYR 498 Cb -0.01 -2.55 0.91 0.00 -0.40 0.00 0.00 41.96 39.92 1qni s TYR 498 CO 0.00 0.12 1.33 0.41 -1.57 0.00 0.00 175.55 175.83 1qni n GLY 499 N -0.26 -0.50 3.20 0.71 0.00 0.16 -4.58 105.19 103.91 1qni n GLY 499 Ca 0.03 -0.10 -0.12 0.00 0.00 0.00 0.00 46.02 45.83 1qni n GLY 499 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1qni s MET 500 N -2.00 0.35 -0.05 1.61 -2.45 -1.26 -4.88 119.30 110.62 1qni s MET 500 Ca 0.23 0.56 0.07 0.00 -1.25 0.00 0.00 55.69 55.31 1qni s MET 500 Cb 0.11 0.07 0.11 0.00 1.25 0.00 0.00 34.83 36.37 1qni s MET 500 CO 0.18 -0.10 1.03 0.25 1.05 0.00 0.00 175.02 177.42 1qni n THR 501 N 3.54 1.23 -3.64 10.11 -2.24 -1.26 -4.86 114.28 117.15 1qni n THR 501 Ca -0.18 -1.38 -0.03 0.00 -2.27 0.00 0.00 64.05 60.19 1qni n THR 501 Cb 0.56 0.24 -0.07 0.00 -2.10 0.00 0.00 70.33 68.97 1qni n THR 501 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1qni s ASP 502 N -1.67 -0.41 -0.11 3.42 -1.08 -1.26 -1.96 116.67 113.60 1qni s ASP 502 Ca 0.13 0.68 -0.22 0.00 -0.52 0.00 0.00 52.55 52.61 1qni s ASP 502 Cb 0.11 1.05 0.05 0.00 -1.46 0.00 0.00 42.92 42.68 1qni s ASP 502 CO 0.01 -0.11 0.55 0.72 0.52 0.00 0.00 175.17 176.86 1qni s PHE 503 N 1.02 -0.54 0.06 -5.34 -0.71 -1.11 -4.99 117.98 106.37 1qni s PHE 503 Ca -0.06 1.11 0.04 0.00 -1.04 0.00 0.00 56.93 56.98 1qni s PHE 503 Cb -0.04 0.25 -0.04 0.00 -1.21 0.00 0.00 43.02 41.99 1qni s PHE 503 CO -0.13 -0.43 0.01 0.15 -1.34 0.00 0.00 175.22 173.48 1qni s LYS 504 N -0.57 2.65 0.29 1.99 1.02 -1.26 -1.24 119.74 122.62 1qni s LYS 504 Ca -0.07 -0.75 -0.06 0.00 0.02 0.00 0.00 55.97 55.11 1qni s LYS 504 Cb -0.03 -2.60 -0.01 0.00 -0.52 0.00 0.00 37.83 34.68 1qni s LYS 504 CO 0.05 0.57 0.43 0.14 -0.92 0.00 0.00 175.35 175.62 1qni s VAL 505 N -1.25 0.00 0.08 3.17 -7.23 -0.44 -4.95 120.40 109.78 1qni s VAL 505 Ca 0.24 -1.59 0.06 0.00 -1.81 0.00 0.00 61.98 58.88 1qni s VAL 505 Cb -0.12 -2.48 -0.04 0.00 0.56 0.00 0.00 36.38 34.31 1qni s VAL 505 CO 0.16 0.00 -0.07 -0.54 -0.31 0.00 0.00 175.10 174.34 1qni s LYS 506 N -3.52 2.31 0.04 4.82 1.02 -1.26 -1.44 119.74 121.71 1qni s LYS 506 Ca 0.29 -0.91 -0.38 0.00 0.02 0.00 0.00 55.97 54.99 1qni s LYS 506 Cb 0.01 -2.40 -0.17 0.00 -0.52 0.00 0.00 37.83 34.75 1qni s LYS 506 CO 0.15 0.54 1.34 -1.91 -0.92 0.00 0.00 175.35 174.55 1qni n GLU 507 N 0.90 0.96 -0.27 1.68 2.13 -0.24 -0.62 120.64 125.19 1qni n GLU 507 Ca -0.13 0.35 0.00 0.00 0.66 0.00 0.00 57.16 58.03 1qni n GLU 507 Cb 0.52 -1.97 0.00 0.00 0.27 0.00 0.00 31.44 30.26 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 2.52 1.38 3.77 8.31 0.00 -0.27 -4.66 105.19 116.24 1qni n GLY 508 Ca 0.19 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.84 1qni n GLY 508 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1qni s ASP 509 N -3.12 6.10 -0.49 1.61 1.01 0.21 -4.67 116.67 117.33 1qni s ASP 509 Ca 0.00 2.44 -0.22 0.00 0.71 0.00 0.00 52.55 55.48 1qni s ASP 509 Cb 0.00 -2.62 0.04 0.00 1.01 0.00 0.00 42.92 41.35 1qni s ASP 509 CO 0.00 -0.97 0.78 -0.70 0.21 0.00 0.00 175.17 174.49 1qni s GLU 510 N -2.59 3.31 -0.19 8.23 2.12 0.11 -1.28 118.70 128.40 1qni s GLU 510 Ca 0.63 -0.35 -0.09 0.00 0.36 0.00 0.00 54.97 55.52 1qni s GLU 510 Cb -0.32 -4.01 -0.05 0.00 0.26 0.00 0.00 34.13 30.01 1qni s GLU 510 CO 0.40 -1.23 0.11 0.08 -0.54 0.00 0.00 175.26 174.07 1qni s VAL 511 N 3.28 5.19 -0.18 3.70 1.01 0.17 -1.04 120.40 132.53 1qni s VAL 511 Ca 0.26 0.11 0.01 0.00 0.00 0.00 0.00 61.98 62.36 1qni s VAL 511 Cb -0.14 -3.36 0.03 0.00 0.00 0.00 0.00 36.38 32.91 1qni s VAL 511 CO 0.19 0.45 -0.18 -0.89 0.00 0.00 0.00 175.10 174.67 1qni s THR 512 N 0.36 1.96 -0.17 3.92 2.01 0.38 -0.79 115.64 123.31 1qni s THR 512 Ca 0.06 -0.96 -0.06 0.00 0.31 0.00 0.00 61.69 61.05 1qni s THR 512 Cb -0.11 -1.83 -0.03 0.00 0.01 0.00 0.00 72.50 70.53 1qni s THR 512 CO -0.01 0.45 0.02 -0.69 -0.69 0.00 0.00 174.62 173.69 1qni s VAL 513 N 1.31 4.36 -0.22 3.82 1.01 -0.35 -0.18 120.40 130.15 1qni s VAL 513 Ca 0.03 -0.19 -0.04 0.00 0.00 0.00 0.00 61.98 61.79 1qni s VAL 513 Cb -0.14 -2.94 -0.01 0.00 0.00 0.00 0.00 36.38 33.29 1qni s VAL 513 CO -0.12 0.47 -0.04 -0.31 0.00 0.00 0.00 175.10 175.11 1qni s TYR 514 N 0.38 2.96 -0.08 5.22 1.51 0.18 -2.25 117.35 125.26 1qni s TYR 514 Ca -0.00 -0.91 0.00 0.00 -1.01 0.00 0.00 57.07 55.15 1qni s TYR 514 Cb -0.13 -2.10 -0.03 0.00 -0.11 0.00 0.00 41.96 39.59 1qni s TYR 514 CO 0.01 -0.52 -0.08 0.42 -1.11 0.00 0.00 175.55 174.27 1qni s ILE 515 N 1.42 3.61 -0.13 2.71 -1.09 -0.21 -0.53 121.20 126.98 1qni s ILE 515 Ca 0.05 -0.50 0.01 0.00 -2.23 0.00 0.00 60.65 57.98 1qni s ILE 515 Cb -0.14 -2.49 0.02 0.00 -1.58 0.00 0.00 42.46 38.27 1qni s ILE 515 CO -0.03 0.58 -0.15 -0.89 -1.23 0.00 0.00 174.94 173.22 1qni s THR 516 N -0.55 1.57 -0.49 2.92 2.01 -0.40 -1.49 115.64 119.21 1qni s THR 516 Ca 0.08 -0.66 -0.21 0.00 0.31 0.00 0.00 61.69 61.21 1qni s THR 516 Cb -0.12 -1.45 0.04 0.00 0.01 0.00 0.00 72.50 70.99 1qni s THR 516 CO 0.02 0.46 0.72 0.21 -0.69 0.00 0.00 174.62 175.34 1qni s ASN 517 N 1.19 6.30 0.08 3.53 3.84 -0.88 0.53 114.94 129.54 1qni s ASN 517 Ca -0.02 -0.50 0.27 0.00 0.21 0.00 0.00 52.86 52.82 1qni s ASN 517 Cb -0.14 -2.35 0.94 0.00 -0.55 0.00 0.00 41.25 39.16 1qni s ASN 517 CO -0.06 -0.94 1.77 0.18 -2.79 0.00 0.00 177.10 175.27 1qni n LEU 518 N 6.57 0.38 -4.76 3.21 4.77 -0.19 -0.57 117.00 126.42 1qni n LEU 518 Ca -0.02 0.45 -0.41 0.00 -0.03 0.00 0.00 56.01 55.99 1qni n LEU 518 Cb 0.47 -0.39 -0.02 0.00 -2.33 0.00 0.00 43.42 41.16 1qni n LEU 518 CO 0.57 -0.05 1.16 -1.81 -1.33 0.00 0.00 177.39 175.92 1qni s ASP 519 N -3.60 6.49 0.00 -1.43 1.01 -1.25 -4.80 116.67 113.09 1qni s ASP 519 Ca 0.12 2.86 0.07 0.00 0.71 0.00 0.00 52.55 56.31 1qni s ASP 519 Cb 0.16 -2.64 0.14 0.00 1.01 0.00 0.00 42.92 41.60 1qni s ASP 519 CO 0.59 -0.81 0.99 0.23 0.21 0.00 0.00 175.17 176.38 1qni n MET 520 N 1.77 1.72 -2.73 8.23 2.81 -1.26 -3.41 117.12 124.25 1qni n MET 520 Ca 0.06 -1.48 -0.41 0.00 -1.81 0.00 0.00 57.70 54.06 1qni n MET 520 Cb 0.39 -1.16 -0.05 0.00 -0.71 0.00 0.00 33.22 31.69 1qni n MET 520 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 1qni s VAL 521 N -0.84 4.44 0.31 2.03 1.01 -1.26 -4.99 120.40 121.10 1qni s VAL 521 Ca 0.13 2.08 -0.29 0.00 0.00 0.00 0.00 61.98 63.89 1qni s VAL 521 Cb 0.07 -4.32 -0.12 0.00 0.00 0.00 0.00 36.38 32.01 1qni s VAL 521 CO 0.10 0.34 1.43 -0.62 0.00 0.00 0.00 175.10 176.35 1qni n GLU 522 N 2.61 2.35 -0.87 2.72 1.02 -1.26 -2.65 120.64 124.57 1qni n GLU 522 Ca 0.02 0.83 0.00 0.00 -0.02 0.00 0.00 57.16 57.99 1qni n GLU 522 Cb 0.49 -2.51 0.00 0.00 -0.02 0.00 0.00 31.44 29.40 1qni n GLU 522 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1qni n ASP 523 N 1.38 0.00 -4.29 1.62 -0.08 -1.26 -4.94 116.55 108.98 1qni n ASP 523 Ca 0.07 0.00 -0.43 0.00 -1.51 0.00 0.00 54.79 52.91 1qni n ASP 523 Cb 0.36 -0.59 0.00 0.00 2.34 0.00 0.00 41.12 43.23 1qni n ASP 523 CO 0.00 0.00 0.00 0.52 0.12 0.00 0.00 177.20 177.84 1qni n VAL 524 N -2.00 4.18 -3.31 5.18 0.31 -1.08 -4.97 118.33 116.64 1qni n VAL 524 Ca 0.00 -4.44 -0.38 0.00 -0.01 0.00 0.00 64.34 59.51 1qni n VAL 524 Cb 0.00 -2.43 -0.06 0.00 -0.91 0.00 0.00 33.84 30.44 1qni n VAL 524 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 1qni s THR 525 N 1.80 4.78 0.40 2.52 2.01 -1.26 -4.19 115.64 121.70 1qni s THR 525 Ca 0.44 1.11 0.08 0.00 0.31 0.00 0.00 61.69 63.63 1qni s THR 525 Cb 0.02 -3.85 -0.04 0.00 0.01 0.00 0.00 72.50 68.65 1qni s THR 525 CO 0.01 0.49 0.24 -1.00 -0.69 0.00 0.00 174.62 173.67 1qni s HIS 526 N -1.19 2.67 0.20 4.92 3.76 -0.26 -4.59 115.29 120.80 1qni s HIS 526 Ca 0.30 -0.52 0.04 0.00 -0.15 0.00 0.00 55.06 54.74 1qni s HIS 526 Cb -0.18 -1.98 -0.02 0.00 1.11 0.00 0.00 32.58 31.52 1qni s HIS 526 CO 0.19 0.11 0.15 0.41 -0.85 0.00 0.00 174.74 174.74 1qni n GLY 527 N -1.33 3.42 3.62 -2.22 0.00 -1.26 -1.08 105.19 106.34 1qni n GLY 527 Ca 0.00 -1.85 -0.05 0.00 0.00 0.00 0.00 46.02 44.13 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 -2.73 -1.17 -0.04 1.61 5.36 -0.99 -4.34 117.98 115.69 1qni s PHE 528 Ca 0.21 2.19 0.00 0.00 -0.96 0.00 0.00 56.93 58.37 1qni s PHE 528 Cb 0.01 0.69 0.03 0.00 -0.34 0.00 0.00 43.02 43.41 1qni s PHE 528 CO 0.15 -0.58 -0.01 0.00 -1.46 0.00 0.00 175.22 173.31 1qni s MET 530 N 1.05 3.47 0.21 0.00 1.75 -1.18 -0.38 119.30 124.23 1qni s MET 530 Ca -0.09 -0.64 -0.32 0.00 -1.25 0.00 0.00 55.69 53.39 1qni s MET 530 Cb -0.14 -3.67 -0.14 0.00 2.84 0.00 0.00 34.83 33.73 1qni s MET 530 CO -0.01 -0.40 1.46 0.28 -0.65 0.00 0.00 175.02 175.70 1qni n VAL 531 N 5.04 0.65 -2.09 10.11 0.31 0.18 -2.47 118.33 130.06 1qni n VAL 531 Ca -0.13 -0.16 -0.21 0.00 -0.01 0.00 0.00 64.34 63.82 1qni n VAL 531 Cb 0.50 -1.49 -0.04 0.00 -0.91 0.00 0.00 33.84 31.90 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 2.53 -5.77 -0.31 4.52 3.02 -1.26 -4.79 115.26 113.21 1qni n ASN 532 Ca 0.13 0.19 0.05 0.00 -0.03 0.00 0.00 54.58 54.92 1qni n ASN 532 Cb 0.30 -4.90 0.06 0.00 -0.61 0.00 0.00 39.78 34.64 1qni n ASN 532 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1qni n HIS 533 N -3.39 0.00 -4.23 3.10 8.25 -1.03 -4.98 115.22 112.94 1qni n HIS 533 Ca -0.23 -0.46 -0.35 0.00 -0.26 0.00 0.00 57.72 56.41 1qni n HIS 533 Cb 0.69 -0.10 -0.06 0.00 1.12 0.00 0.00 29.99 31.64 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 -0.66 -0.33 3.00 -1.41 0.00 -1.26 -4.94 105.19 99.59 1qni n GLY 534 Ca 0.07 0.22 -0.19 0.00 0.00 0.00 0.00 46.02 46.13 1qni n GLY 534 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1qni s VAL 535 N -4.12 0.72 -0.17 1.61 1.01 -1.26 -5.07 120.40 113.12 1qni s VAL 535 Ca 0.14 -0.35 -0.29 0.00 0.00 0.00 0.00 61.98 61.48 1qni s VAL 535 Cb -0.08 -0.62 0.10 0.00 0.00 0.00 0.00 36.38 35.78 1qni s VAL 535 CO 0.99 0.22 0.87 -0.55 0.00 0.00 0.00 175.10 176.62 1qni s SER 536 N 0.01 -0.53 0.16 3.32 0.15 -1.25 -3.09 113.70 112.47 1qni s SER 536 Ca 0.00 0.74 -0.21 0.00 0.70 0.00 0.00 55.95 57.19 1qni s SER 536 Cb -0.06 0.66 0.06 0.00 -1.71 0.00 0.00 66.02 64.97 1qni s SER 536 CO -0.00 -0.37 0.55 0.00 1.20 0.00 0.00 173.24 174.61 1qni s MET 537 N -0.65 1.25 0.01 5.44 0.23 -0.89 -3.93 119.30 120.77 1qni s MET 537 Ca -0.03 -0.58 -0.02 0.00 -1.03 0.00 0.00 55.69 54.03 1qni s MET 537 Cb -0.02 0.55 -0.04 0.00 -1.53 0.00 0.00 34.83 33.80 1qni s MET 537 CO 0.03 -0.53 0.18 -2.00 -2.03 0.00 0.00 175.02 170.66 1qni s GLU 538 N -3.78 3.39 -0.38 3.16 2.12 -0.87 -2.35 118.70 119.99 1qni s GLU 538 Ca 0.02 -0.38 0.02 0.00 0.36 0.00 0.00 54.97 55.00 1qni s GLU 538 Cb -0.00 -3.05 0.15 0.00 0.26 0.00 0.00 34.13 31.49 1qni s GLU 538 CO -0.11 0.65 0.32 0.42 -0.54 0.00 0.00 175.26 176.00 1qni s ILE 539 N -1.36 -0.05 0.96 -3.70 1.09 -0.24 -4.69 121.20 113.20 1qni s ILE 539 Ca 0.29 -1.59 -0.13 0.00 -1.10 0.00 0.00 60.65 58.11 1qni s ILE 539 Cb -0.13 -0.92 0.16 0.00 -1.06 0.00 0.00 42.46 40.52 1qni s ILE 539 CO 0.21 -0.85 1.14 -0.44 -0.10 0.00 0.00 174.94 174.90 1qni s SER 540 N 0.99 3.10 -0.35 3.58 0.01 -1.26 -1.11 113.70 118.67 1qni s SER 540 Ca 0.21 0.91 -0.43 0.00 1.31 0.00 0.00 55.95 57.95 1qni s SER 540 Cb -0.14 -1.43 -0.17 0.00 0.21 0.00 0.00 66.02 64.49 1qni s SER 540 CO -0.04 -2.80 1.68 -2.65 0.41 0.00 0.00 173.24 169.84 1qni n PRO 541 N -3.92 0.73 -1.13 12.44 -0.02 -1.26 -1.07 135.00 140.77 1qni n PRO 541 Ca 0.08 0.27 -0.04 0.00 -2.02 0.00 0.00 63.50 61.78 1qni n PRO 541 Cb 0.59 -1.88 -0.02 0.00 -0.02 0.00 0.00 33.50 32.17 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 4.82 -0.96 -3.70 -0.52 1.13 0.27 -1.74 117.38 116.68 1qni n GLN 542 Ca 0.28 0.51 -0.30 0.00 -1.94 0.00 0.00 57.00 55.56 1qni n GLN 542 Cb 0.06 -4.38 -0.04 0.00 0.11 0.00 0.00 30.24 25.99 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 -1.80 3.56 -0.09 -1.09 0.74 -0.23 -4.61 119.66 116.13 1qni s GLN 543 Ca 0.00 -0.23 0.04 0.00 0.05 0.00 0.00 55.36 55.22 1qni s GLN 543 Cb 0.00 -2.86 -0.01 0.00 1.10 0.00 0.00 33.01 31.25 1qni s GLN 543 CO 0.00 0.44 -0.22 0.99 -0.55 0.00 0.00 175.29 175.95 1qni s THR 544 N -1.75 2.25 0.06 -0.34 2.01 -1.26 -2.07 115.64 114.55 1qni s THR 544 Ca 0.39 -0.97 0.03 0.00 0.31 0.00 0.00 61.69 61.45 1qni s THR 544 Cb -0.12 -1.86 -0.03 0.00 0.01 0.00 0.00 72.50 70.50 1qni s THR 544 CO 0.27 0.56 -0.09 0.00 -0.69 0.00 0.00 174.62 174.67 1qni s ALA 545 N 0.13 0.80 0.05 7.40 0.00 -0.56 -4.73 121.76 124.85 1qni s ALA 545 Ca -0.12 -0.92 -0.00 0.00 0.00 0.00 0.00 51.96 50.92 1qni s ALA 545 Cb -0.16 0.03 -0.03 0.00 0.00 0.00 0.00 23.12 22.95 1qni s ALA 545 CO 0.06 -0.01 -0.04 -1.54 0.00 0.00 0.00 175.76 174.24 1qni s SER 546 N -1.87 0.54 -0.11 0.00 1.04 -1.26 -1.04 113.70 110.99 1qni s SER 546 Ca -0.04 -0.84 -0.10 0.00 0.48 0.00 0.00 55.95 55.45 1qni s SER 546 Cb -0.08 0.15 0.03 0.00 0.10 0.00 0.00 66.02 66.22 1qni s SER 546 CO 0.00 -0.48 0.30 0.54 0.98 0.00 0.00 173.24 174.58 1qni s VAL 547 N -3.07 -0.00 -0.03 5.02 0.11 -0.95 -1.44 120.40 120.02 1qni s VAL 547 Ca 0.01 0.01 0.07 0.00 -2.93 0.00 0.00 61.98 59.13 1qni s VAL 547 Cb 0.02 -0.42 -0.02 0.00 -1.53 0.00 0.00 36.38 34.43 1qni s VAL 547 CO -0.06 0.00 -0.24 0.28 -3.33 0.00 0.00 175.10 171.75 1qni s THR 548 N 0.24 1.92 0.14 5.04 -1.32 -1.26 -1.21 115.64 119.19 1qni s THR 548 Ca -0.01 -1.02 -0.10 0.00 -1.21 0.00 0.00 61.69 59.35 1qni s THR 548 Cb -0.03 -1.60 -0.00 0.00 -1.51 0.00 0.00 72.50 69.36 1qni s THR 548 CO -0.00 0.54 0.29 0.72 -2.21 0.00 0.00 174.62 173.96 1qni s PHE 549 N -0.41 0.24 -0.16 9.09 -0.71 0.03 -4.99 117.98 121.07 1qni s PHE 549 Ca 0.05 -0.62 -0.13 0.00 -1.04 0.00 0.00 56.93 55.19 1qni s PHE 549 Cb -0.11 0.01 -0.05 0.00 -1.21 0.00 0.00 43.02 41.66 1qni s PHE 549 CO 0.01 -0.69 0.27 0.99 -1.34 0.00 0.00 175.22 174.46 1qni s THR 550 N -3.92 5.31 -0.03 -4.49 2.01 -1.26 -0.66 115.64 112.61 1qni s THR 550 Ca 0.12 0.51 -0.30 0.00 0.31 0.00 0.00 61.69 62.33 1qni s THR 550 Cb 0.03 -3.61 -0.07 0.00 0.01 0.00 0.00 72.50 68.87 1qni s THR 550 CO -0.04 0.41 1.74 0.00 -0.69 0.00 0.00 174.62 176.05 1qni s ALA 551 N 0.33 3.61 1.00 7.40 0.00 -0.40 -4.91 121.76 128.78 1qni s ALA 551 Ca 0.16 1.05 0.00 0.00 0.00 0.00 0.00 51.96 53.17 1qni s ALA 551 Cb -0.13 -3.77 0.00 0.00 0.00 0.00 0.00 23.12 19.22 1qni s ALA 551 CO 0.04 -1.45 0.00 0.41 0.00 0.00 0.00 175.76 174.76 1qni n GLY 552 N 4.25 -2.97 3.73 0.00 0.00 -1.26 -1.11 105.19 107.82 1qni n GLY 552 Ca 0.18 -1.26 -0.35 0.00 0.00 0.00 0.00 46.02 44.59 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 -0.01 2.28 0.38 1.61 -2.85 -1.26 -4.20 119.74 115.69 1qni s LYS 553 Ca 0.00 1.84 -0.26 0.00 -1.00 0.00 0.00 55.97 56.55 1qni s LYS 553 Cb 0.00 -1.84 -0.12 0.00 -2.06 0.00 0.00 37.83 33.81 1qni s LYS 553 CO 0.00 -1.75 1.00 -0.35 0.10 0.00 0.00 175.35 174.35 1qni n PRO 554 N -2.46 1.36 -1.02 1.78 -0.04 -1.26 -4.89 135.00 128.47 1qni n PRO 554 Ca 0.14 0.48 0.00 0.00 -0.04 0.00 0.00 63.50 64.08 1qni n PRO 554 Cb 0.50 -1.97 0.00 0.00 -0.04 0.00 0.00 33.50 31.98 1qni n PRO 554 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1qni n GLY 555 N 1.20 0.20 3.81 0.55 0.00 0.86 -4.98 105.19 106.82 1qni n GLY 555 Ca 0.09 -1.77 -0.39 0.00 0.00 0.00 0.00 46.02 43.96 1qni n GLY 555 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1qni s VAL 556 N -1.74 4.73 -0.14 1.61 1.01 -1.26 -1.44 120.40 123.17 1qni s VAL 556 Ca 0.00 1.24 -0.04 0.00 0.00 0.00 0.00 61.98 63.18 1qni s VAL 556 Cb 0.00 -3.91 0.06 0.00 0.00 0.00 0.00 36.38 32.53 1qni s VAL 556 CO 0.00 0.55 0.11 -0.31 0.00 0.00 0.00 175.10 175.45 1qni s TYR 557 N -1.05 0.06 0.50 5.22 2.02 -0.56 -5.00 117.35 118.54 1qni s TYR 557 Ca 0.29 -0.03 -0.19 0.00 -0.37 0.00 0.00 57.07 56.77 1qni s TYR 557 Cb -0.20 -0.56 -0.08 0.00 -0.40 0.00 0.00 41.96 40.72 1qni s TYR 557 CO 0.19 -0.44 1.01 -1.58 -1.57 0.00 0.00 175.55 173.16 1qni s TRP 558 N 2.19 3.18 0.05 2.71 0.52 -1.26 -0.34 118.94 125.99 1qni s TRP 558 Ca 0.03 1.55 0.05 0.00 0.02 0.00 0.00 56.10 57.76 1qni s TRP 558 Cb -0.15 -2.94 -0.02 0.00 -1.15 0.00 0.00 33.47 29.21 1qni s TRP 558 CO -0.08 -0.59 -0.15 1.52 0.02 0.00 0.00 176.95 177.67 1qni s TYR 559 N -2.26 1.29 0.20 -1.98 -0.85 -0.35 -0.65 117.35 112.74 1qni s TYR 559 Ca 0.63 -0.39 -0.14 0.00 -0.52 0.00 0.00 57.07 56.65 1qni s TYR 559 Cb -0.13 -0.75 0.01 0.00 0.38 0.00 0.00 41.96 41.47 1qni s TYR 559 CO 0.24 0.05 0.45 1.52 -1.52 0.00 0.00 175.55 176.29 1qni s TYR 560 N -0.98 0.12 -0.04 -3.49 1.13 0.48 -1.32 117.35 113.25 1qni s TYR 560 Ca 0.01 -0.48 -0.28 0.00 -1.41 0.00 0.00 57.07 54.92 1qni s TYR 560 Cb -0.09 0.23 -0.03 0.00 -1.10 0.00 0.00 41.96 40.98 1qni s TYR 560 CO 0.02 -0.88 0.89 0.00 -2.51 0.00 0.00 175.55 173.07 1qni n ASN 562 N 4.10 3.83 -4.01 0.00 2.04 -1.26 -4.85 115.26 115.11 1qni n ASN 562 Ca 0.04 -2.59 -0.31 0.00 -0.44 0.00 0.00 54.58 51.28 1qni n ASN 562 Cb 0.51 -0.46 -0.15 0.00 -2.53 0.00 0.00 39.78 37.15 1qni n ASN 562 CO 0.00 0.00 0.00 0.86 -0.44 0.00 0.00 177.26 177.68 1qni s TRP 563 N -2.07 3.41 -0.32 -2.53 -0.11 -1.26 -4.91 118.94 111.16 1qni s TRP 563 Ca 0.38 -2.66 -0.36 0.00 1.22 0.00 0.00 56.10 54.68 1qni s TRP 563 Cb 0.27 -2.49 -0.12 0.00 -1.50 0.00 0.00 33.47 29.63 1qni s TRP 563 CO 0.14 -0.91 2.11 0.34 -4.62 0.00 0.00 176.95 174.01 1qni n PHE 564 N 4.36 1.72 -0.19 5.86 -0.00 -1.26 -4.61 117.46 123.34 1qni n PHE 564 Ca -0.02 0.28 0.00 0.00 -0.00 0.00 0.00 57.45 57.71 1qni n PHE 564 Cb 0.42 -2.53 0.00 0.00 -0.00 0.00 0.00 39.48 37.37 1qni n PHE 564 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1qni s HIS 566 N -0.29 -0.18 0.45 0.00 5.65 -1.26 -4.97 115.29 114.69 1qni s HIS 566 Ca 0.00 -0.00 0.14 0.00 0.25 0.00 0.00 55.06 55.45 1qni s HIS 566 Cb 0.00 0.57 1.02 0.00 -1.18 0.00 0.00 32.58 33.00 1qni s HIS 566 CO 0.00 -0.56 2.00 0.00 -0.65 0.00 0.00 174.74 175.54 1qni h ALA 567 N 2.00 1.72 -0.61 1.58 0.00 -1.99 -2.02 119.26 119.94 1qni h ALA 567 Ca -0.23 -0.15 -0.26 0.00 0.00 0.00 0.00 54.91 54.27 1qni h ALA 567 Cb 1.22 -0.03 -0.15 0.00 0.00 0.00 0.00 17.79 18.83 1qni h ALA 567 CO 0.27 0.21 0.33 1.28 0.00 0.00 0.00 179.25 181.34 1qni n LEU 568 N -4.34 5.24 -0.14 0.00 4.77 -1.26 -4.61 117.00 116.66 1qni n LEU 568 Ca -0.02 -2.74 -0.04 0.00 -0.03 0.00 0.00 56.01 53.18 1qni n LEU 568 Cb 0.23 -0.71 0.03 0.00 -2.33 0.00 0.00 43.42 40.65 1qni n LEU 568 CO 0.36 0.78 0.81 -0.74 -1.33 0.00 0.00 177.39 177.27 1qni h HIS 569 N 1.29 -0.14 -0.23 -1.77 2.76 -1.71 -1.63 115.15 113.73 1qni h HIS 569 Ca 0.32 0.04 0.07 0.00 -2.20 0.00 0.00 60.37 58.59 1qni h HIS 569 Cb 2.09 0.13 -0.01 0.00 1.55 0.00 0.00 27.41 31.17 1qni h HIS 569 CO 1.01 -0.15 0.18 0.52 -1.30 0.00 0.00 177.93 178.19 1qni h MET 570 N 0.05 0.00 -0.10 5.26 2.86 -1.86 -0.25 114.93 120.89 1qni h MET 570 Ca 0.22 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.86 1qni h MET 570 Cb 0.33 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.99 1qni h MET 570 CO -0.42 0.00 0.00 0.39 1.06 0.00 0.00 176.91 177.94 1qni n GLU 571 N -4.26 1.78 -2.56 1.72 4.71 -0.62 -4.59 120.64 116.80 1qni n GLU 571 Ca 0.02 -1.15 -0.43 0.00 -0.01 0.00 0.00 57.16 55.59 1qni n GLU 571 Cb 0.32 -1.44 0.00 0.00 -1.01 0.00 0.00 31.44 29.31 1qni n GLU 571 CO 0.00 0.00 0.00 -0.12 0.09 0.00 0.00 177.13 177.10 1qni n MET 572 N 0.38 3.24 -4.12 3.49 1.56 -0.11 -4.89 117.12 116.68 1qni n MET 572 Ca 0.18 -3.38 -0.22 0.00 -0.27 0.00 0.00 57.70 54.00 1qni n MET 572 Cb 0.37 -3.29 -0.06 0.00 2.15 0.00 0.00 33.22 32.39 1qni n MET 572 CO 0.00 0.00 0.00 1.33 -0.73 0.00 0.00 175.97 176.57 1qni n VAL 573 N 5.44 0.00 -3.75 1.12 0.24 -1.26 -2.33 118.33 117.78 1qni n VAL 573 Ca 0.45 -2.09 -0.03 0.00 -2.04 0.00 0.00 64.34 60.64 1qni n VAL 573 Cb 0.43 0.73 -0.01 0.00 -1.47 0.00 0.00 33.84 33.53 1qni n VAL 573 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1qni s GLY 574 N -3.21 -0.21 -0.07 7.63 0.00 -0.43 -4.77 107.32 106.26 1qni s GLY 574 Ca 0.17 0.14 0.00 0.00 0.00 0.00 0.00 44.72 45.04 1qni s GLY 574 CO 0.12 0.39 -0.06 0.50 0.00 0.00 0.00 173.10 174.05 1qni s ARG 575 N -2.98 1.13 -0.22 2.90 0.52 -0.83 -1.21 118.95 118.26 1qni s ARG 575 Ca 0.14 -0.16 -0.13 0.00 -0.52 0.00 0.00 55.73 55.05 1qni s ARG 575 Cb -0.01 -1.16 -0.04 0.00 0.52 0.00 0.00 34.95 34.26 1qni s ARG 575 CO 0.02 -0.15 0.29 1.41 0.02 0.00 0.00 175.30 176.89 1qni s MET 576 N 1.25 4.12 -0.33 3.54 -2.45 0.54 -2.76 119.30 123.22 1qni s MET 576 Ca -0.05 -0.02 -0.11 0.00 -1.25 0.00 0.00 55.69 54.26 1qni s MET 576 Cb -0.14 -3.54 -0.01 0.00 1.25 0.00 0.00 34.83 32.39 1qni s MET 576 CO -0.02 0.00 0.19 -0.51 1.05 0.00 0.00 175.02 175.73 1qni s LEU 577 N 1.21 4.33 -0.26 4.11 1.43 -0.37 -1.49 118.68 127.63 1qni s LEU 577 Ca 0.14 -0.53 -0.10 0.00 -1.03 0.00 0.00 54.13 52.60 1qni s LEU 577 Cb -0.14 -2.06 -0.05 0.00 0.03 0.00 0.00 46.19 43.97 1qni s LEU 577 CO 0.06 -0.23 0.16 -0.69 0.23 0.00 0.00 176.35 175.89 1qni s VAL 578 N 1.65 5.24 0.23 -1.59 1.01 -0.52 -1.32 120.40 125.10 1qni s VAL 578 Ca 0.05 0.14 0.08 0.00 0.00 0.00 0.00 61.98 62.25 1qni s VAL 578 Cb -0.17 -3.47 -0.04 0.00 0.00 0.00 0.00 36.38 32.70 1qni s VAL 578 CO 0.08 0.30 0.08 -1.83 0.00 0.00 0.00 175.10 173.73 1qni s GLU 579 N 1.42 2.59 0.17 2.72 -1.05 -0.52 -0.10 118.70 123.93 1qni s GLU 579 Ca 0.07 -1.18 -0.32 0.00 -0.15 0.00 0.00 54.97 53.39 1qni s GLU 579 Cb -0.15 -2.38 -0.12 0.00 -0.44 0.00 0.00 34.13 31.04 1qni s GLU 579 CO 0.07 0.41 1.75 0.00 0.95 0.00 0.00 175.26 178.45 1qni n ALA 580 N -0.79 2.48 0.81 -0.84 0.00 -1.26 -1.07 120.51 119.84 1qni n ALA 580 Ca -0.08 0.37 0.07 0.00 0.00 0.00 0.00 53.44 53.80 1qni n ALA 580 Cb 0.57 -2.53 0.39 0.00 0.00 0.00 0.00 19.45 17.88 1qni n ALA 580 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50