#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h0h n THR 2 N 0.00 3.32 -0.55 0.00 5.66 -1.26 -5.02 114.28 116.43 1h0h n THR 2 Ca 0.00 -2.34 -0.22 0.00 -3.05 0.00 0.00 64.05 58.44 1h0h n THR 2 Cb 0.00 -0.90 -0.03 0.00 -1.55 0.00 0.00 70.33 67.85 1h0h n THR 2 CO 0.00 0.00 0.00 0.23 -3.05 0.00 0.00 175.07 172.25 1h0h n MET 3 N -0.87 0.00 -3.54 1.09 0.00 -1.26 -4.98 117.12 107.57 1h0h n MET 3 Ca 0.57 0.00 -0.28 0.00 0.00 0.00 0.00 57.70 57.99 1h0h n MET 3 Cb 1.05 -0.53 -0.03 0.00 0.00 0.00 0.00 33.22 33.71 1h0h n MET 3 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1h0h s ALA 4 N 0.27 3.74 0.13 3.04 0.00 -1.26 -5.09 121.76 122.59 1h0h s ALA 4 Ca 0.33 -0.71 -0.19 0.00 0.00 0.00 0.00 51.96 51.40 1h0h s ALA 4 Cb -0.47 -2.13 -0.07 0.00 0.00 0.00 0.00 23.12 20.45 1h0h s ALA 4 CO 0.22 0.35 0.62 -0.51 0.00 0.00 0.00 175.76 176.44 1h0h s LEU 5 N -3.42 4.44 0.27 0.00 1.43 -1.26 -4.95 118.68 115.19 1h0h s LEU 5 Ca 0.41 1.28 0.16 0.00 -1.03 0.00 0.00 54.13 54.95 1h0h s LEU 5 Cb -0.11 -3.19 0.87 0.00 0.03 0.00 0.00 46.19 43.80 1h0h s LEU 5 CO 0.29 0.17 1.46 2.29 0.23 0.00 0.00 176.35 180.79 1h0h n LYS 6 N 1.24 0.10 -0.09 1.70 2.85 -1.26 -2.72 118.16 119.98 1h0h n LYS 6 Ca -0.07 0.59 0.09 0.00 -1.05 0.00 0.00 58.31 57.87 1h0h n LYS 6 Cb 0.51 -1.92 0.13 0.00 -0.65 0.00 0.00 35.03 33.10 1h0h n LYS 6 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 1h0h n THR 7 N -2.07 0.33 -0.26 0.58 -2.24 -1.26 -4.78 114.28 104.58 1h0h n THR 7 Ca -0.01 -0.66 0.06 0.00 -2.27 0.00 0.00 64.05 61.17 1h0h n THR 7 Cb 0.10 1.09 0.19 0.00 -2.10 0.00 0.00 70.33 69.61 1h0h n THR 7 CO 0.00 0.00 0.00 1.62 -0.57 0.00 0.00 175.07 176.12 1h0h h VAL 8 N 3.40 0.50 -0.51 2.28 3.04 -1.93 -1.07 116.25 121.96 1h0h h VAL 8 Ca 0.00 -0.09 0.00 0.00 -1.01 0.00 0.00 66.70 65.60 1h0h h VAL 8 Cb 0.78 0.20 0.00 0.00 -2.01 0.00 0.00 31.29 30.26 1h0h h VAL 8 CO 0.00 0.05 0.00 0.47 -1.01 0.00 0.00 177.57 177.08 1h0h n ASP 9 N -5.16 4.56 -4.86 3.17 8.00 -1.26 -5.01 116.55 115.99 1h0h n ASP 9 Ca 0.15 -2.63 -0.31 0.00 0.71 0.00 0.00 54.79 52.72 1h0h n ASP 9 Cb 0.48 -0.55 -0.02 0.00 -0.02 0.00 0.00 41.12 41.01 1h0h n ASP 9 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1h0h s ALA 10 N -2.16 3.17 -0.04 2.24 0.00 -0.41 -4.70 121.76 119.87 1h0h s ALA 10 Ca 0.47 -0.05 -0.30 0.00 0.00 0.00 0.00 51.96 52.07 1h0h s ALA 10 Cb 0.33 -2.96 -0.03 0.00 0.00 0.00 0.00 23.12 20.45 1h0h s ALA 10 CO 0.18 -0.33 1.15 0.21 0.00 0.00 0.00 175.76 176.98 1h0h s LYS 11 N -4.40 4.40 -0.21 0.00 2.20 0.48 -4.80 119.74 117.40 1h0h s LYS 11 Ca 0.55 1.62 -0.09 0.00 -0.36 0.00 0.00 55.97 57.69 1h0h s LYS 11 Cb -0.10 -3.51 -0.04 0.00 -1.51 0.00 0.00 37.83 32.66 1h0h s LYS 11 CO 0.39 -0.35 0.11 -1.14 -0.36 0.00 0.00 175.35 174.00 1h0h s GLN 12 N 1.86 4.00 0.26 4.03 0.74 -1.26 -0.75 119.66 128.54 1h0h s GLN 12 Ca 0.55 -0.32 0.01 0.00 0.05 0.00 0.00 55.36 55.65 1h0h s GLN 12 Cb -0.24 -3.37 -0.05 0.00 1.10 0.00 0.00 33.01 30.45 1h0h s GLN 12 CO 0.23 0.14 0.09 0.95 -0.55 0.00 0.00 175.29 176.16 1h0h s THR 13 N 0.77 0.59 0.24 -0.34 -4.23 0.57 -4.97 115.64 108.27 1h0h s THR 13 Ca 0.06 -2.00 0.07 0.00 -1.18 0.00 0.00 61.69 58.64 1h0h s THR 13 Cb -0.13 -2.63 -0.04 0.00 1.34 0.00 0.00 72.50 71.05 1h0h s THR 13 CO 0.02 -0.02 0.14 0.42 -0.54 0.00 0.00 174.62 174.64 1h0h s THR 14 N -3.73 4.23 0.23 3.99 -4.23 -1.26 -0.13 115.64 114.74 1h0h s THR 14 Ca 0.37 -1.46 -0.05 0.00 -1.18 0.00 0.00 61.69 59.37 1h0h s THR 14 Cb 0.08 -3.26 0.02 0.00 1.34 0.00 0.00 72.50 70.68 1h0h s THR 14 CO 0.13 -0.32 0.39 -0.24 -0.54 0.00 0.00 174.62 174.05 1h0h n SER 15 N -0.98 -1.12 -3.87 3.99 2.88 -0.80 -2.74 113.62 110.99 1h0h n SER 15 Ca -0.08 -2.10 -0.16 0.00 -1.33 0.00 0.00 58.87 55.20 1h0h n SER 15 Cb 0.58 1.96 -0.15 0.00 -0.75 0.00 0.00 64.21 65.85 1h0h n SER 15 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 1h0h s VAL 16 N -2.57 0.21 0.29 2.46 1.01 -1.26 -0.36 120.40 120.18 1h0h s VAL 16 Ca 0.14 -0.03 -0.27 0.00 0.00 0.00 0.00 61.98 61.83 1h0h s VAL 16 Cb -0.02 -0.24 -0.15 0.00 0.00 0.00 0.00 36.38 35.98 1h0h s VAL 16 CO 0.11 0.11 0.80 0.00 0.00 0.00 0.00 175.10 176.11 1h0h n TYR 19 N 1.53 0.00 -2.04 0.00 4.01 -1.26 -4.55 117.16 114.86 1h0h n TYR 19 Ca 0.22 0.00 -0.28 0.00 -0.16 0.00 0.00 57.90 57.68 1h0h n TYR 19 Cb 0.60 0.00 0.13 0.00 -0.31 0.00 0.00 39.34 39.76 1h0h n TYR 19 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1h0h n SER 21 N -3.41 0.00 -0.20 0.00 3.41 -0.81 -3.73 113.62 108.88 1h0h n SER 21 Ca 0.12 -1.62 -0.03 0.00 -0.26 0.00 0.00 58.87 57.08 1h0h n SER 21 Cb 0.60 0.00 0.16 0.00 -0.26 0.00 0.00 64.21 64.71 1h0h n SER 21 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 1h0h h VAL 22 N 0.00 1.23 -0.03 -3.33 2.07 -1.90 -1.02 116.25 113.28 1h0h h VAL 22 Ca 0.00 -0.75 0.00 0.00 0.82 0.00 0.00 66.70 66.77 1h0h h VAL 22 Cb 0.00 0.46 0.00 0.00 -1.52 0.00 0.00 31.29 30.23 1h0h h VAL 22 CO 0.00 0.30 0.00 0.61 0.02 0.00 0.00 177.57 178.50 1h0h n GLY 23 N -0.96 0.72 3.76 2.17 0.00 -1.25 -4.78 105.19 104.86 1h0h n GLY 23 Ca 0.06 -0.70 -0.41 0.00 0.00 0.00 0.00 46.02 44.97 1h0h n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h0h s GLY 25 N -0.15 2.64 0.15 0.00 0.00 -1.26 -1.18 107.32 107.52 1h0h s GLY 25 Ca 0.54 0.33 0.10 0.00 0.00 0.00 0.00 44.72 45.69 1h0h s GLY 25 CO 0.63 0.71 -0.23 1.08 0.00 0.00 0.00 173.10 175.29 1h0h s LEU 26 N -2.24 2.37 -0.09 0.66 1.43 0.52 -1.17 118.68 120.16 1h0h s LEU 26 Ca 0.49 -0.80 0.03 0.00 -1.03 0.00 0.00 54.13 52.83 1h0h s LEU 26 Cb -0.16 -1.05 -0.01 0.00 0.03 0.00 0.00 46.19 44.99 1h0h s LEU 26 CO 0.21 0.09 -0.19 -0.63 0.23 0.00 0.00 176.35 176.06 1h0h s ILE 27 N -1.47 2.52 -0.07 -0.59 -1.09 0.30 -1.90 121.20 118.90 1h0h s ILE 27 Ca 0.15 -0.87 0.05 0.00 -2.23 0.00 0.00 60.65 57.75 1h0h s ILE 27 Cb -0.09 -1.99 -0.01 0.00 -1.58 0.00 0.00 42.46 38.79 1h0h s ILE 27 CO 0.07 0.55 -0.24 -0.69 -1.23 0.00 0.00 174.94 173.41 1h0h s VAL 28 N 0.07 2.15 -0.17 2.92 1.01 0.82 -2.17 120.40 125.04 1h0h s VAL 28 Ca -0.08 -1.02 -0.01 0.00 0.00 0.00 0.00 61.98 60.86 1h0h s VAL 28 Cb -0.15 -1.79 -0.01 0.00 0.00 0.00 0.00 36.38 34.43 1h0h s VAL 28 CO 0.05 0.57 -0.11 -1.00 0.00 0.00 0.00 175.10 174.61 1h0h s HIS 29 N -0.06 2.86 -0.08 5.22 3.76 -0.43 -0.32 115.29 126.24 1h0h s HIS 29 Ca -0.06 -0.89 0.04 0.00 -0.15 0.00 0.00 55.06 53.99 1h0h s HIS 29 Cb -0.15 -1.95 0.00 0.00 1.11 0.00 0.00 32.58 31.60 1h0h s HIS 29 CO 0.05 -0.42 -0.20 0.99 -0.85 0.00 0.00 174.74 174.31 1h0h s THR 30 N 0.90 1.73 0.09 1.30 2.01 0.07 -0.16 115.64 121.57 1h0h s THR 30 Ca -0.03 -0.84 -0.31 0.00 0.31 0.00 0.00 61.69 60.82 1h0h s THR 30 Cb -0.15 -1.51 -0.08 0.00 0.01 0.00 0.00 72.50 70.77 1h0h s THR 30 CO -0.00 0.49 1.47 -0.62 -0.69 0.00 0.00 174.62 175.27 1h0h s ASP 31 N 0.34 6.75 0.42 3.53 -1.08 -0.04 -0.39 116.67 126.21 1h0h s ASP 31 Ca -0.15 2.35 0.22 0.00 -0.52 0.00 0.00 52.55 54.46 1h0h s ASP 31 Cb -0.16 -2.58 0.89 0.00 -1.46 0.00 0.00 42.92 39.61 1h0h s ASP 31 CO 0.06 -0.74 1.82 0.11 0.52 0.00 0.00 175.17 176.95 1h0h h LYS 32 N 7.33 0.00 0.13 4.34 1.57 -1.89 0.13 116.57 128.17 1h0h h LYS 32 Ca -0.41 0.00 -0.25 0.00 -1.87 0.00 0.00 60.65 58.12 1h0h h LYS 32 Cb 1.20 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.52 1h0h h LYS 32 CO 0.89 0.28 -1.23 0.87 -0.57 0.00 0.00 179.45 179.69 1h0h h LYS 33 N 0.00 0.27 0.00 3.15 1.57 -1.97 -3.38 116.57 116.21 1h0h h LYS 33 Ca -0.00 -0.46 -0.02 0.00 -1.87 0.00 0.00 60.65 58.30 1h0h h LYS 33 Cb 0.74 0.17 -0.00 0.00 0.08 0.00 0.00 32.23 33.22 1h0h h LYS 33 CO 0.04 1.22 -0.95 1.79 -0.57 0.00 0.00 179.45 180.98 1h0h h THR 34 N -0.31 0.05 -1.29 -0.16 1.35 -1.96 -3.47 112.91 107.11 1h0h h THR 34 Ca -0.25 -1.10 -0.34 0.00 -0.55 0.00 0.00 66.41 64.17 1h0h h THR 34 Cb 1.74 1.60 -0.10 0.00 -1.73 0.00 0.00 68.15 69.65 1h0h h THR 34 CO 0.09 0.03 -0.35 0.59 -0.25 0.00 0.00 175.52 175.63 1h0h n ASN 35 N -2.74 -5.03 -4.71 5.36 3.02 0.44 -4.96 115.26 106.64 1h0h n ASN 35 Ca -0.00 0.29 -0.27 0.00 -0.03 0.00 0.00 54.58 54.57 1h0h n ASN 35 Cb 0.57 -4.05 -0.07 0.00 -0.61 0.00 0.00 39.78 35.62 1h0h n ASN 35 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1h0h s ARG 36 N -3.86 2.56 0.30 3.52 1.81 -1.25 -2.30 118.95 119.74 1h0h s ARG 36 Ca 0.00 -1.02 -0.29 0.00 -1.72 0.00 0.00 55.73 52.70 1h0h s ARG 36 Cb 0.00 -2.45 -0.10 0.00 -0.45 0.00 0.00 34.95 31.95 1h0h s ARG 36 CO 0.00 0.47 1.31 0.00 -0.68 0.00 0.00 175.30 176.40 1h0h s ALA 37 N -1.72 3.51 -0.30 2.13 0.00 -1.26 -0.86 121.76 123.25 1h0h s ALA 37 Ca 0.28 1.23 0.05 0.00 0.00 0.00 0.00 51.96 53.52 1h0h s ALA 37 Cb -0.10 -3.48 -0.03 0.00 0.00 0.00 0.00 23.12 19.52 1h0h s ALA 37 CO 0.20 -0.61 0.29 0.44 0.00 0.00 0.00 175.76 176.08 1h0h n ILE 38 N 1.20 0.00 -3.64 0.00 -5.35 0.77 -4.84 119.36 107.51 1h0h n ILE 38 Ca 0.01 -0.42 -0.11 0.00 -0.27 0.00 0.00 62.75 61.97 1h0h n ILE 38 Cb 0.42 1.02 -0.07 0.00 -1.74 0.00 0.00 39.64 39.27 1h0h n ILE 38 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 1h0h s ASN 39 N -1.19 -0.55 -0.05 7.28 2.47 -1.11 -5.01 114.94 116.77 1h0h s ASN 39 Ca 0.03 1.07 -0.02 0.00 0.42 0.00 0.00 52.86 54.35 1h0h s ASN 39 Cb 0.04 1.08 0.04 0.00 -1.45 0.00 0.00 41.25 40.96 1h0h s ASN 39 CO 0.16 -0.18 0.10 -0.69 -3.72 0.00 0.00 177.10 172.76 1h0h s VAL 40 N 0.31 -0.14 0.20 -5.21 1.01 -1.26 -1.32 120.40 114.00 1h0h s VAL 40 Ca 0.02 0.32 -0.00 0.00 0.00 0.00 0.00 61.98 62.32 1h0h s VAL 40 Cb -0.05 -0.20 0.00 0.00 0.00 0.00 0.00 36.38 36.13 1h0h s VAL 40 CO -0.04 0.13 0.26 -1.84 0.00 0.00 0.00 175.10 173.61 1h0h n GLU 41 N 4.90 0.38 -2.23 2.72 0.28 -0.92 -4.70 120.64 121.06 1h0h n GLU 41 Ca -0.12 -1.62 -0.34 0.00 -0.16 0.00 0.00 57.16 54.92 1h0h n GLU 41 Cb 0.50 1.53 -0.00 0.00 1.43 0.00 0.00 31.44 34.90 1h0h n GLU 41 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 177.13 177.17 1h0h s GLY 42 N -2.24 2.35 -0.48 -1.84 0.00 -1.24 -0.54 107.32 103.34 1h0h s GLY 42 Ca 0.17 0.56 -0.22 0.00 0.00 0.00 0.00 44.72 45.24 1h0h s GLY 42 CO 0.12 0.89 0.73 -0.35 0.00 0.00 0.00 173.10 174.49 1h0h s ASP 43 N -2.31 6.33 0.53 1.64 -1.08 -0.32 -4.32 116.67 117.15 1h0h s ASP 43 Ca 0.67 -0.41 0.36 0.00 -0.52 0.00 0.00 52.55 52.65 1h0h s ASP 43 Cb -0.18 -2.35 1.77 0.00 -1.46 0.00 0.00 42.92 40.70 1h0h s ASP 43 CO 0.30 -0.92 2.08 1.55 0.52 0.00 0.00 175.17 178.70 1h0h h PRO 44 N 9.00 0.00 0.00 4.34 0.13 -1.87 -1.53 132.00 142.07 1h0h h PRO 44 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 1h0h h PRO 44 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 1h0h h PRO 44 CO 0.96 0.00 -0.67 -0.44 -0.23 0.00 0.00 178.00 177.62 1h0h h ASP 45 N 0.00 0.00 -2.77 1.44 3.32 -1.91 -3.37 116.42 113.13 1h0h h ASP 45 Ca 0.00 -0.20 -0.53 0.00 0.02 0.00 0.00 57.03 56.32 1h0h h ASP 45 Cb 0.18 0.00 0.02 0.00 0.22 0.00 0.00 39.33 39.76 1h0h h ASP 45 CO 0.00 0.10 0.93 -2.28 -1.72 0.00 0.00 179.24 176.27 1h0h s HIS 46 N -3.19 2.68 0.33 4.55 2.46 -0.73 -4.89 115.29 116.49 1h0h s HIS 46 Ca 0.05 0.50 0.28 0.00 0.47 0.00 0.00 55.06 56.37 1h0h s HIS 46 Cb 0.13 -3.89 1.38 0.00 -0.13 0.00 0.00 32.58 30.07 1h0h s HIS 46 CO 0.73 -3.46 2.02 -1.00 -2.47 0.00 0.00 174.74 170.56 1h0h h PRO 47 N 7.82 0.00 0.03 2.88 0.13 -1.89 0.68 132.00 141.65 1h0h h PRO 47 Ca -0.42 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.71 1h0h h PRO 47 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1h0h h PRO 47 CO 0.92 0.12 -0.02 0.82 -0.23 0.00 0.00 178.00 179.62 1h0h h ILE 48 N 0.00 1.26 0.00 -3.56 2.04 -1.92 -3.40 117.51 111.93 1h0h h ILE 48 Ca -0.00 -1.74 0.00 0.00 1.00 0.00 0.00 64.86 64.12 1h0h h ILE 48 Cb 0.43 2.30 0.00 0.00 -0.74 0.00 0.00 36.82 38.81 1h0h h ILE 48 CO 0.02 0.39 -1.65 -0.46 0.00 0.00 0.00 178.15 176.45 1h0h n ASN 49 N -4.73 0.55 -2.98 1.72 6.94 -1.22 -4.98 115.26 110.56 1h0h n ASN 49 Ca -0.08 -0.26 -0.19 0.00 -0.02 0.00 0.00 54.58 54.04 1h0h n ASN 49 Cb 0.33 1.67 0.00 0.00 -2.36 0.00 0.00 39.78 39.42 1h0h n ASN 49 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 1h0h n GLU 50 N -2.00 -3.18 0.00 -3.83 1.02 0.23 -1.09 120.64 111.79 1h0h n GLU 50 Ca -0.02 0.58 0.00 0.00 -0.02 0.00 0.00 57.16 57.70 1h0h n GLU 50 Cb 0.46 -5.27 0.00 0.00 -0.02 0.00 0.00 31.44 26.61 1h0h n GLU 50 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1h0h n GLY 51 N -1.09 1.30 3.81 0.62 0.00 -0.66 -4.54 105.19 104.65 1h0h n GLY 51 Ca -0.08 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.61 1h0h n GLY 51 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1h0h s SER 52 N -2.30 6.29 -0.04 1.61 0.01 -0.25 -3.63 113.70 115.39 1h0h s SER 52 Ca 0.00 1.78 -0.10 0.00 1.31 0.00 0.00 55.95 58.94 1h0h s SER 52 Cb 0.00 -2.54 0.02 0.00 0.21 0.00 0.00 66.02 63.71 1h0h s SER 52 CO 0.00 -0.81 0.23 -0.76 0.41 0.00 0.00 173.24 172.31 1h0h s LEU 53 N -3.92 1.16 0.00 2.44 1.43 -1.26 -4.82 118.68 113.71 1h0h s LEU 53 Ca 0.63 0.14 -0.10 0.00 -1.03 0.00 0.00 54.13 53.77 1h0h s LEU 53 Cb -0.14 0.92 0.15 0.00 0.03 0.00 0.00 46.19 47.15 1h0h s LEU 53 CO 0.27 -0.29 0.87 0.00 0.23 0.00 0.00 176.35 177.44 1h0h h ALA 55 N -1.80 1.06 0.03 0.00 0.00 -1.97 -0.20 119.26 116.39 1h0h h ALA 55 Ca -0.28 0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 1h0h h ALA 55 Cb 0.79 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1h0h h ALA 55 CO 0.20 -0.24 -0.01 0.87 0.00 0.00 0.00 179.25 180.07 1h0h h LYS 56 N 0.41 -0.03 -0.54 0.00 1.57 -1.86 -2.36 116.57 113.74 1h0h h LYS 56 Ca 0.42 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 59.15 1h0h h LYS 56 Cb 0.67 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.97 1h0h h LYS 56 CO -0.43 0.18 0.10 0.78 -0.57 0.00 0.00 179.45 179.50 1h0h h GLY 57 N -0.24 0.92 2.00 3.86 0.00 -1.83 -2.17 103.07 105.62 1h0h h GLY 57 Ca -0.00 -0.56 -0.01 0.00 0.00 0.00 0.00 47.33 46.75 1h0h h GLY 57 CO 0.01 0.52 -0.07 0.00 0.00 0.00 0.00 176.54 177.00 1h0h h ALA 58 N 1.29 1.23 -0.05 3.60 0.00 -0.85 -2.43 119.26 122.05 1h0h h ALA 58 Ca 0.17 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1h0h h ALA 58 Cb 0.35 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1h0h h ALA 58 CO 0.01 0.09 0.00 -1.13 0.00 0.00 0.00 179.25 178.21 1h0h n SER 59 N -3.50 1.80 -0.34 0.00 3.41 -0.82 -4.58 113.62 109.60 1h0h n SER 59 Ca -0.02 -1.62 0.16 0.00 -0.26 0.00 0.00 58.87 57.13 1h0h n SER 59 Cb 0.20 -0.02 0.36 0.00 -0.26 0.00 0.00 64.21 64.48 1h0h n SER 59 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 1h0h h THR 60 N 2.75 0.55 -0.86 6.66 2.02 -1.47 -0.05 112.91 122.50 1h0h h THR 60 Ca 0.00 -0.19 0.15 0.00 0.77 0.00 0.00 66.41 67.14 1h0h h THR 60 Cb 0.59 -0.06 -0.10 0.00 -1.74 0.00 0.00 68.15 66.84 1h0h h THR 60 CO 0.00 0.10 0.44 -0.25 0.37 0.00 0.00 175.52 176.19 1h0h h TRP 61 N 0.56 0.78 0.00 3.16 7.01 -1.84 -1.08 115.95 124.54 1h0h h TRP 61 Ca 0.61 0.03 -0.04 0.00 2.11 0.00 0.00 58.89 61.61 1h0h h TRP 61 Cb 1.13 -0.22 -0.01 0.00 -2.10 0.00 0.00 29.16 27.97 1h0h h TRP 61 CO -0.04 0.18 -0.17 1.96 -2.79 0.00 0.00 178.44 177.58 1h0h h GLN 62 N 0.62 0.00 -0.15 2.65 4.20 -1.30 -0.94 115.11 120.20 1h0h h GLN 62 Ca 0.47 0.00 -0.05 0.00 0.06 0.00 0.00 58.65 59.13 1h0h h GLN 62 Cb 0.67 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.45 1h0h h GLN 62 CO -0.37 0.17 -0.11 1.25 -0.67 0.00 0.00 178.83 179.11 1h0h h LEU 63 N 0.00 0.35 0.09 1.46 5.85 -1.23 -3.35 115.31 118.48 1h0h h LEU 63 Ca -0.00 -0.45 -0.00 0.00 0.84 0.00 0.00 57.88 58.26 1h0h h LEU 63 Cb 0.53 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.46 1h0h h LEU 63 CO 0.02 0.72 -0.05 0.00 -0.34 0.00 0.00 178.44 178.80 1h0h h ALA 64 N 0.63 -0.13 -1.44 1.25 0.00 -1.27 -3.38 119.26 114.93 1h0h h ALA 64 Ca 0.03 -0.26 -0.74 0.00 0.00 0.00 0.00 54.91 53.93 1h0h h ALA 64 Cb 0.61 0.05 -0.17 0.00 0.00 0.00 0.00 17.79 18.28 1h0h h ALA 64 CO 0.03 -0.26 1.57 0.39 0.00 0.00 0.00 179.25 180.98 1h0h n GLU 65 N -4.87 3.44 -3.66 0.00 -0.58 -0.38 -4.91 120.64 109.68 1h0h n GLU 65 Ca -0.08 -3.75 -0.23 0.00 -0.42 0.00 0.00 57.16 52.68 1h0h n GLU 65 Cb 0.28 -3.01 -0.17 0.00 -0.57 0.00 0.00 31.44 27.97 1h0h n GLU 65 CO 0.00 0.00 0.00 1.21 -0.48 0.00 0.00 177.13 177.86 1h0h s ASN 66 N 2.25 1.75 0.05 1.62 3.84 -1.26 -4.77 114.94 118.42 1h0h s ASN 66 Ca 0.42 -0.25 0.18 0.00 0.21 0.00 0.00 52.86 53.42 1h0h s ASN 66 Cb 0.01 -0.24 0.76 0.00 -0.55 0.00 0.00 41.25 41.23 1h0h s ASN 66 CO 0.00 -0.29 1.57 -0.62 -2.79 0.00 0.00 177.10 174.98 1h0h n GLU 67 N 5.26 0.04 0.00 0.43 1.02 -1.26 -2.34 120.64 123.79 1h0h n GLU 67 Ca -0.05 0.25 0.14 0.00 -0.02 0.00 0.00 57.16 57.48 1h0h n GLU 67 Cb 0.49 -1.57 0.64 0.00 -0.02 0.00 0.00 31.44 30.98 1h0h n GLU 67 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1h0h n ARG 68 N -1.64 0.53 -2.28 3.49 1.74 -1.26 -4.73 116.66 112.52 1h0h n ARG 68 Ca 0.04 -0.14 -0.43 0.00 -0.77 0.00 0.00 57.85 56.55 1h0h n ARG 68 Cb 0.21 -1.50 -0.02 0.00 -1.02 0.00 0.00 32.46 30.13 1h0h n ARG 68 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 1h0h s ARG 69 N -2.56 4.22 0.09 5.56 0.52 -0.99 -4.59 118.95 121.20 1h0h s ARG 69 Ca 0.27 1.84 -0.31 0.00 -0.52 0.00 0.00 55.73 57.02 1h0h s ARG 69 Cb 0.20 -3.82 -0.09 0.00 0.52 0.00 0.00 34.95 31.75 1h0h s ARG 69 CO 0.49 -0.74 1.81 -2.14 0.02 0.00 0.00 175.30 174.74 1h0h s PRO 70 N 3.59 4.15 0.32 3.54 0.02 -1.26 -4.89 135.00 140.48 1h0h s PRO 70 Ca 0.61 2.53 0.12 0.00 0.02 0.00 0.00 61.00 64.28 1h0h s PRO 70 Cb -0.26 -3.72 0.54 0.00 0.02 0.00 0.00 34.50 31.08 1h0h s PRO 70 CO 0.20 -0.84 1.71 0.00 -0.33 0.00 0.00 177.00 177.74 1h0h h ALA 71 N 8.95 1.14 -2.53 -1.55 0.00 -1.93 -3.45 119.26 119.90 1h0h h ALA 71 Ca -0.46 -0.45 -0.39 0.00 0.00 0.00 0.00 54.91 53.61 1h0h h ALA 71 Cb 1.22 -0.08 -0.16 0.00 0.00 0.00 0.00 17.79 18.76 1h0h h ALA 71 CO 0.94 0.62 -0.74 -0.80 0.00 0.00 0.00 179.25 179.28 1h0h s ASN 72 N -6.84 2.06 0.65 0.00 0.01 -1.26 -0.26 114.94 109.29 1h0h s ASN 72 Ca -0.02 -0.92 -0.17 0.00 -0.71 0.00 0.00 52.86 51.04 1h0h s ASN 72 Cb 0.13 -0.06 -0.03 0.00 0.41 0.00 0.00 41.25 41.70 1h0h s ASN 72 CO 0.74 -0.21 1.00 -2.65 -1.51 0.00 0.00 177.10 174.47 1h0h n PRO 73 N 0.09 0.79 -4.67 -0.60 -0.02 -1.26 -4.78 135.00 124.56 1h0h n PRO 73 Ca -0.12 0.32 -0.24 0.00 -2.02 0.00 0.00 63.50 61.44 1h0h n PRO 73 Cb 0.59 -2.22 -0.16 0.00 -0.02 0.00 0.00 33.50 31.69 1h0h n PRO 73 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1h0h s LEU 74 N -2.63 1.90 -0.05 2.45 1.43 -0.36 -2.49 118.68 118.95 1h0h s LEU 74 Ca 0.77 -0.28 0.06 0.00 -1.03 0.00 0.00 54.13 53.64 1h0h s LEU 74 Cb -0.39 -0.80 -0.01 0.00 0.03 0.00 0.00 46.19 45.02 1h0h s LEU 74 CO 0.47 0.13 -0.23 -0.47 0.23 0.00 0.00 176.35 176.48 1h0h s TYR 75 N -0.01 2.26 -0.17 0.29 5.04 0.52 -0.18 117.35 125.11 1h0h s TYR 75 Ca -0.01 -0.63 0.01 0.00 -2.44 0.00 0.00 57.07 53.99 1h0h s TYR 75 Cb -0.09 -1.49 0.03 0.00 0.35 0.00 0.00 41.96 40.76 1h0h s TYR 75 CO 0.01 -0.18 -0.16 0.50 -1.34 0.00 0.00 175.55 174.38 1h0h s ARG 76 N -0.19 2.55 0.50 4.97 3.00 0.28 -0.25 118.95 129.81 1h0h s ARG 76 Ca -0.02 -0.76 -0.14 0.00 -1.00 0.00 0.00 55.73 53.82 1h0h s ARG 76 Cb -0.13 -2.39 -0.07 0.00 0.00 0.00 0.00 34.95 32.37 1h0h s ARG 76 CO 0.03 -0.27 0.93 0.00 0.00 0.00 0.00 175.30 175.98 1h0h s ALA 77 N 1.37 3.16 -0.09 6.12 0.00 -1.26 -1.27 121.76 129.79 1h0h s ALA 77 Ca 0.03 0.01 -0.38 0.00 0.00 0.00 0.00 51.96 51.62 1h0h s ALA 77 Cb -0.14 -2.98 -0.16 0.00 0.00 0.00 0.00 23.12 19.84 1h0h s ALA 77 CO -0.11 -0.25 1.53 -2.30 0.00 0.00 0.00 175.76 174.63 1h0h n PRO 78 N -1.72 1.14 -0.59 0.00 -0.02 -1.26 -1.38 135.00 131.17 1h0h n PRO 78 Ca 0.05 0.41 0.00 0.00 -2.02 0.00 0.00 63.50 61.94 1h0h n PRO 78 Cb 0.54 -2.07 0.00 0.00 -0.02 0.00 0.00 33.50 31.95 1h0h n PRO 78 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1h0h n GLY 79 N 3.31 1.55 3.80 -1.23 0.00 -0.78 -5.00 105.19 106.83 1h0h n GLY 79 Ca 0.22 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.89 1h0h n GLY 79 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1h0h s SER 80 N -3.27 7.15 -0.12 1.61 0.15 -0.48 -3.76 113.70 114.98 1h0h s SER 80 Ca 0.00 1.73 0.18 0.00 0.70 0.00 0.00 55.95 58.56 1h0h s SER 80 Cb 0.00 -2.55 0.70 0.00 -1.71 0.00 0.00 66.02 62.46 1h0h s SER 80 CO 0.00 -0.17 1.61 -0.90 1.20 0.00 0.00 173.24 174.98 1h0h n ASP 81 N 0.09 4.71 -3.58 5.45 5.75 -1.26 -4.78 116.55 122.94 1h0h n ASP 81 Ca 0.04 -2.49 -0.13 0.00 -0.01 0.00 0.00 54.79 52.19 1h0h n ASP 81 Cb 0.52 -0.57 -0.05 0.00 -1.03 0.00 0.00 41.12 39.99 1h0h n ASP 81 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1h0h s GLN 82 N -1.92 1.05 0.59 0.11 -2.07 -1.26 -5.05 119.66 111.11 1h0h s GLN 82 Ca 0.50 -0.35 -0.16 0.00 -1.82 0.00 0.00 55.36 53.53 1h0h s GLN 82 Cb 0.33 0.47 -0.04 0.00 -1.09 0.00 0.00 33.01 32.68 1h0h s GLN 82 CO 0.23 -0.39 1.06 -1.58 -1.32 0.00 0.00 175.29 173.29 1h0h s TRP 83 N -2.79 2.99 -0.08 9.60 0.23 -1.26 -4.64 118.94 123.00 1h0h s TRP 83 Ca -0.03 1.51 0.02 0.00 -2.03 0.00 0.00 56.10 55.57 1h0h s TRP 83 Cb -0.00 -3.01 0.02 0.00 0.03 0.00 0.00 33.47 30.50 1h0h s TRP 83 CO -0.04 -1.10 -0.12 -2.00 0.96 0.00 0.00 176.95 174.65 1h0h s GLU 84 N -4.05 1.70 0.31 4.98 2.12 0.66 -4.91 118.70 119.50 1h0h s GLU 84 Ca 0.64 -0.39 -0.29 0.00 0.36 0.00 0.00 54.97 55.28 1h0h s GLU 84 Cb -0.16 -1.46 -0.10 0.00 0.26 0.00 0.00 34.13 32.67 1h0h s GLU 84 CO 0.36 -0.03 1.23 -1.21 -0.54 0.00 0.00 175.26 175.08 1h0h s GLU 85 N 0.85 4.46 0.08 4.30 2.02 -1.26 -0.35 118.70 128.80 1h0h s GLU 85 Ca -0.11 2.07 0.01 0.00 0.02 0.00 0.00 54.97 56.96 1h0h s GLU 85 Cb -0.15 -3.12 -0.04 0.00 0.10 0.00 0.00 34.13 30.92 1h0h s GLU 85 CO 0.01 -0.05 -0.06 0.15 0.02 0.00 0.00 175.26 175.34 1h0h s LYS 86 N -1.64 0.75 0.62 1.61 -0.14 -1.04 -4.90 119.74 115.01 1h0h s LYS 86 Ca 0.47 -1.27 -0.15 0.00 -1.36 0.00 0.00 55.97 53.67 1h0h s LYS 86 Cb -0.37 -0.10 -0.03 0.00 -1.68 0.00 0.00 37.83 35.66 1h0h s LYS 86 CO 0.48 -0.04 1.06 -1.54 -0.76 0.00 0.00 175.35 174.55 1h0h s SER 87 N -2.92 5.68 0.24 2.83 1.04 -1.26 -4.10 113.70 115.21 1h0h s SER 87 Ca 0.09 1.78 -0.07 0.00 0.48 0.00 0.00 55.95 58.24 1h0h s SER 87 Cb 0.05 -2.53 0.25 0.00 0.10 0.00 0.00 66.02 63.89 1h0h s SER 87 CO -0.06 -1.24 1.91 -0.50 0.98 0.00 0.00 173.24 174.33 1h0h h TRP 88 N 0.20 1.17 -0.49 5.02 4.06 -1.99 -1.57 115.95 122.36 1h0h h TRP 88 Ca -0.46 0.03 -0.04 0.00 2.06 0.00 0.00 58.89 60.48 1h0h h TRP 88 Cb 1.22 -0.40 -0.02 0.00 -1.00 0.00 0.00 29.16 28.96 1h0h h TRP 88 CO 0.59 0.72 0.16 -0.44 -3.56 0.00 0.00 178.44 175.92 1h0h h ASP 89 N 1.25 0.70 -0.23 -3.49 3.32 -1.99 0.37 116.42 116.36 1h0h h ASP 89 Ca 0.35 -0.20 -0.00 0.00 0.02 0.00 0.00 57.03 57.20 1h0h h ASP 89 Cb -0.11 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.25 1h0h h ASP 89 CO -0.09 0.71 0.13 -0.25 -1.72 0.00 0.00 179.24 178.03 1h0h h TRP 90 N 0.65 0.30 -0.21 4.55 7.01 -1.88 -1.21 115.95 125.16 1h0h h TRP 90 Ca 0.16 -0.00 -0.01 0.00 2.11 0.00 0.00 58.89 61.15 1h0h h TRP 90 Cb 0.25 -0.10 -0.01 0.00 -2.10 0.00 0.00 29.16 27.20 1h0h h TRP 90 CO 0.01 0.24 0.10 0.52 -2.79 0.00 0.00 178.44 176.52 1h0h h MET 91 N 0.27 0.31 -0.59 2.65 2.86 -1.01 -0.38 114.93 119.05 1h0h h MET 91 Ca 0.08 -0.05 -0.05 0.00 -2.06 0.00 0.00 59.70 57.62 1h0h h MET 91 Cb 0.03 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 31.61 1h0h h MET 91 CO -0.01 0.33 0.17 -0.07 1.06 0.00 0.00 176.91 178.39 1h0h h LEU 92 N 0.21 0.86 -0.49 1.22 3.38 -0.86 -0.45 115.31 119.19 1h0h h LEU 92 Ca 0.07 -0.21 -0.15 0.00 0.09 0.00 0.00 57.88 57.68 1h0h h LEU 92 Cb 0.12 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 1h0h h LEU 92 CO -0.01 0.85 -0.39 0.44 0.09 0.00 0.00 178.44 179.42 1h0h h ASP 93 N 0.83 0.87 -0.25 -0.43 3.32 -1.17 -1.70 116.42 117.89 1h0h h ASP 93 Ca 0.19 -0.39 -0.06 0.00 0.02 0.00 0.00 57.03 56.78 1h0h h ASP 93 Cb 0.30 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.60 1h0h h ASP 93 CO -0.00 1.15 -0.09 0.74 -1.72 0.00 0.00 179.24 179.32 1h0h h THR 94 N 0.67 1.29 -0.74 0.35 2.02 -0.88 -1.74 112.91 113.87 1h0h h THR 94 Ca 0.06 -1.13 0.02 0.00 0.77 0.00 0.00 66.41 66.13 1h0h h THR 94 Cb 0.95 1.51 -0.04 0.00 -1.74 0.00 0.00 68.15 68.84 1h0h h THR 94 CO 0.09 0.35 0.48 0.40 0.37 0.00 0.00 175.52 177.21 1h0h h ILE 95 N 0.23 1.15 -0.69 3.11 2.04 -1.09 0.51 117.51 122.76 1h0h h ILE 95 Ca 0.06 -0.33 0.06 0.00 1.00 0.00 0.00 64.86 65.65 1h0h h ILE 95 Cb 0.57 0.10 -0.06 0.00 -0.74 0.00 0.00 36.82 36.70 1h0h h ILE 95 CO 0.03 0.17 0.39 0.00 0.00 0.00 0.00 178.15 178.75 1h0h h ALA 96 N 1.29 0.93 -0.69 1.87 0.00 -1.07 0.34 119.26 121.95 1h0h h ALA 96 Ca 0.28 0.01 -0.07 0.00 0.00 0.00 0.00 54.91 55.14 1h0h h ALA 96 Cb -0.05 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 1h0h h ALA 96 CO -0.09 0.07 0.14 0.93 0.00 0.00 0.00 179.25 180.31 1h0h h GLU 97 N 0.72 1.11 -0.42 0.00 5.08 -0.64 -0.83 114.58 119.61 1h0h h GLU 97 Ca 0.31 -0.28 -0.04 0.00 -1.00 0.00 0.00 59.36 58.35 1h0h h GLU 97 Cb 0.19 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.28 1h0h h GLU 97 CO -0.18 1.00 0.12 0.00 -1.00 0.00 0.00 179.01 178.94 1h0h h ARG 98 N 1.05 0.66 -0.24 2.33 2.47 0.62 -1.48 114.38 119.79 1h0h h ARG 98 Ca 0.21 -0.15 -0.01 0.00 -1.26 0.00 0.00 59.98 58.77 1h0h h ARG 98 Cb 0.40 -0.09 -0.01 0.00 -1.65 0.00 0.00 29.97 28.62 1h0h h ARG 98 CO 0.01 0.66 0.10 0.28 0.56 0.00 0.00 179.97 181.58 1h0h h VAL 99 N 0.54 1.17 -0.18 2.04 2.07 -0.19 -1.17 116.25 120.52 1h0h h VAL 99 Ca 0.13 -0.50 0.01 0.00 0.82 0.00 0.00 66.70 67.16 1h0h h VAL 99 Cb 0.29 1.05 -0.01 0.00 -1.52 0.00 0.00 31.29 31.09 1h0h h VAL 99 CO -0.00 0.17 0.09 0.00 0.02 0.00 0.00 177.57 177.84 1h0h h ALA 100 N 0.94 0.21 -0.29 1.67 0.00 -1.00 -0.30 119.26 120.49 1h0h h ALA 100 Ca 0.08 0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.82 1h0h h ALA 100 Cb 0.17 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 1h0h h ALA 100 CO -0.01 -0.33 -0.52 -0.22 0.00 0.00 0.00 179.25 178.17 1h0h h LYS 101 N 0.19 0.83 -0.18 0.00 3.64 -1.23 -1.84 116.57 117.98 1h0h h LYS 101 Ca 0.07 -0.51 -0.22 0.00 -1.27 0.00 0.00 60.65 58.73 1h0h h LYS 101 Cb 0.01 0.05 0.01 0.00 -0.41 0.00 0.00 32.23 31.89 1h0h h LYS 101 CO -0.05 1.14 -0.73 1.15 -2.27 0.00 0.00 179.45 178.69 1h0h h THR 102 N 0.65 1.28 0.02 1.00 2.02 -1.13 -1.44 112.91 115.31 1h0h h THR 102 Ca 0.02 -1.93 0.02 0.00 0.77 0.00 0.00 66.41 65.29 1h0h h THR 102 Cb 1.11 1.92 -0.03 0.00 -1.74 0.00 0.00 68.15 69.41 1h0h h THR 102 CO 0.11 0.62 -0.14 -0.09 0.37 0.00 0.00 175.52 176.39 1h0h h ARG 103 N 0.56 -0.24 -0.73 6.66 2.43 -1.06 -2.04 114.38 119.95 1h0h h ARG 103 Ca -0.04 0.02 0.05 0.00 -0.81 0.00 0.00 59.98 59.20 1h0h h ARG 103 Cb 1.36 0.05 -0.05 0.00 -0.42 0.00 0.00 29.97 30.91 1h0h h ARG 103 CO 0.15 -0.16 0.44 1.49 -1.51 0.00 0.00 179.97 180.38 1h0h h GLU 104 N -0.25 0.80 0.00 0.20 4.57 -1.19 -0.43 114.58 118.28 1h0h h GLU 104 Ca 0.04 -0.05 -0.03 0.00 -1.18 0.00 0.00 59.36 58.15 1h0h h GLU 104 Cb 0.30 -0.18 -0.00 0.00 -0.16 0.00 0.00 28.75 28.71 1h0h h GLU 104 CO -0.12 0.53 -0.13 0.00 -1.18 0.00 0.00 179.01 178.10 1h0h h ALA 105 N 1.35 1.07 -0.04 2.92 0.00 -0.92 -3.14 119.26 120.49 1h0h h ALA 105 Ca 0.31 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1h0h h ALA 105 Cb 0.13 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1h0h h ALA 105 CO -0.16 0.16 0.00 0.25 0.00 0.00 0.00 179.25 179.51 1h0h n THR 106 N -3.34 1.60 -3.21 0.00 -2.24 -0.80 -5.03 114.28 101.26 1h0h n THR 106 Ca -0.00 -1.76 -0.39 0.00 -2.27 0.00 0.00 64.05 59.62 1h0h n THR 106 Cb 0.34 0.03 -0.06 0.00 -2.10 0.00 0.00 70.33 68.54 1h0h n THR 106 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1h0h s PHE 107 N -2.18 3.75 -0.20 4.78 5.36 -0.23 -1.60 117.98 127.67 1h0h s PHE 107 Ca 0.22 1.27 -0.01 0.00 -0.96 0.00 0.00 56.93 57.46 1h0h s PHE 107 Cb 0.19 -2.58 0.01 0.00 -0.34 0.00 0.00 43.02 40.30 1h0h s PHE 107 CO 0.03 0.46 -0.14 0.08 -1.46 0.00 0.00 175.22 174.19 1h0h s VAL 108 N -0.63 2.56 0.00 3.12 1.01 0.10 -4.98 120.40 121.58 1h0h s VAL 108 Ca 0.31 -0.79 0.00 0.00 0.00 0.00 0.00 61.98 61.50 1h0h s VAL 108 Cb -0.19 -2.13 0.00 0.00 0.00 0.00 0.00 36.38 34.06 1h0h s VAL 108 CO 0.19 0.48 0.00 0.35 0.00 0.00 0.00 175.10 176.12 1h0h n THR 109 N 4.68 0.00 -3.87 3.92 -2.24 -1.26 -1.50 114.28 114.02 1h0h n THR 109 Ca -0.20 0.34 -0.35 0.00 -2.27 0.00 0.00 64.05 61.57 1h0h n THR 109 Cb 0.50 -1.05 -0.08 0.00 -2.10 0.00 0.00 70.33 67.60 1h0h n THR 109 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1h0h s LYS 110 N -0.67 3.99 0.75 -0.78 1.02 -1.26 0.36 119.74 123.14 1h0h s LYS 110 Ca 0.00 -0.26 -0.13 0.00 0.02 0.00 0.00 55.97 55.60 1h0h s LYS 110 Cb 0.00 -3.30 0.17 0.00 -0.52 0.00 0.00 37.83 34.18 1h0h s LYS 110 CO 0.00 0.36 1.00 0.27 -0.92 0.00 0.00 175.35 176.06 1h0h n ASN 111 N 3.29 -0.02 0.26 2.83 0.23 -0.04 -4.88 115.26 116.93 1h0h n ASN 111 Ca -0.17 -1.35 0.14 0.00 -0.53 0.00 0.00 54.58 52.68 1h0h n ASN 111 Cb 0.52 -0.77 0.66 0.00 -2.08 0.00 0.00 39.78 38.12 1h0h n ASN 111 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1h0h h ALA 112 N -1.88 1.09 -0.01 -2.53 0.00 -1.99 -1.40 119.26 112.54 1h0h h ALA 112 Ca -0.32 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.48 1h0h h ALA 112 Cb 0.90 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.67 1h0h h ALA 112 CO 0.23 0.14 0.00 1.63 0.00 0.00 0.00 179.25 181.25 1h0h n LYS 113 N -3.36 1.25 -0.73 0.00 5.02 -1.26 -4.89 118.16 114.19 1h0h n LYS 113 Ca -0.01 -0.36 0.00 0.00 -2.02 0.00 0.00 58.31 55.92 1h0h n LYS 113 Cb 0.31 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.83 1h0h n LYS 113 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1h0h n GLY 114 N 1.06 0.63 3.83 0.72 0.00 -0.53 -5.05 105.19 105.85 1h0h n GLY 114 Ca 0.22 -0.04 -0.38 0.00 0.00 0.00 0.00 46.02 45.82 1h0h n GLY 114 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1h0h s GLN 115 N -0.33 4.03 -0.22 1.61 -0.21 -1.26 -4.81 119.66 118.48 1h0h s GLN 115 Ca 0.00 0.55 -0.29 0.00 0.02 0.00 0.00 55.36 55.64 1h0h s GLN 115 Cb 0.00 -3.21 -0.00 0.00 1.00 0.00 0.00 33.01 30.80 1h0h s GLN 115 CO 0.00 0.66 1.18 0.08 -2.12 0.00 0.00 175.29 175.09 1h0h s VAL 116 N -1.12 4.40 -0.00 1.09 1.01 -1.26 -0.86 120.40 123.66 1h0h s VAL 116 Ca 0.27 1.68 0.00 0.00 0.00 0.00 0.00 61.98 63.93 1h0h s VAL 116 Cb -0.18 -4.15 -0.00 0.00 0.00 0.00 0.00 36.38 32.05 1h0h s VAL 116 CO 0.16 -0.23 0.00 1.33 0.00 0.00 0.00 175.10 176.36 1h0h n VAL 117 N 5.52 0.00 -4.04 2.92 0.24 0.16 -4.85 118.33 118.28 1h0h n VAL 117 Ca 0.13 -0.00 -0.45 0.00 -2.04 0.00 0.00 64.34 61.98 1h0h n VAL 117 Cb 0.46 -0.42 0.02 0.00 -1.47 0.00 0.00 33.84 32.43 1h0h n VAL 117 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 1h0h n ASN 118 N -1.81 -4.28 -4.08 -1.34 3.02 -0.74 -0.50 115.26 105.53 1h0h n ASN 118 Ca -0.00 -1.27 -0.22 0.00 -0.03 0.00 0.00 54.58 53.06 1h0h n ASN 118 Cb 0.31 -1.84 -0.15 0.00 -0.61 0.00 0.00 39.78 37.49 1h0h n ASN 118 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 1h0h s ARG 119 N -7.27 1.12 -0.35 3.52 3.52 -0.56 -3.81 118.95 115.12 1h0h s ARG 119 Ca 0.49 -0.45 -0.19 0.00 -0.13 0.00 0.00 55.73 55.45 1h0h s ARG 119 Cb -0.26 -1.06 -0.00 0.00 -1.56 0.00 0.00 34.95 32.07 1h0h s ARG 119 CO 0.96 0.24 0.56 0.00 -0.81 0.00 0.00 175.30 176.26 1h0h n ASP 121 N 5.87 0.70 -0.70 0.00 8.00 -0.63 -4.30 116.55 125.50 1h0h n ASP 121 Ca -0.03 0.17 0.11 0.00 0.71 0.00 0.00 54.79 55.74 1h0h n ASP 121 Cb 0.49 0.04 0.05 0.00 -0.02 0.00 0.00 41.12 41.68 1h0h n ASP 121 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1h0h n GLY 122 N 1.34 0.45 3.26 0.44 0.00 -1.26 -4.69 105.19 104.74 1h0h n GLY 122 Ca 0.04 -0.61 -0.29 0.00 0.00 0.00 0.00 46.02 45.15 1h0h n GLY 122 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1h0h s ILE 123 N -2.01 1.85 0.10 -0.61 1.01 -1.26 0.16 121.20 120.44 1h0h s ILE 123 Ca 0.22 -0.99 0.03 0.00 0.00 0.00 0.00 60.65 59.91 1h0h s ILE 123 Cb 0.17 -1.55 -0.04 0.00 0.01 0.00 0.00 42.46 41.06 1h0h s ILE 123 CO 0.37 0.52 -0.09 0.00 0.00 0.00 0.00 174.94 175.74 1h0h s ALA 124 N -0.45 1.11 -0.01 9.38 0.00 -0.64 -4.54 121.76 126.60 1h0h s ALA 124 Ca 0.06 -1.23 0.00 0.00 0.00 0.00 0.00 51.96 50.80 1h0h s ALA 124 Cb -0.10 0.05 0.01 0.00 0.00 0.00 0.00 23.12 23.08 1h0h s ALA 124 CO -0.00 -0.07 -0.00 0.45 0.00 0.00 0.00 175.76 176.14 1h0h s SER 125 N -2.58 0.18 -0.03 0.00 0.15 -0.29 -1.07 113.70 110.06 1h0h s SER 125 Ca 0.07 -0.01 0.07 0.00 0.70 0.00 0.00 55.95 56.78 1h0h s SER 125 Cb -0.01 -0.07 -0.02 0.00 -1.71 0.00 0.00 66.02 64.21 1h0h s SER 125 CO -0.01 -0.04 -0.24 0.68 1.20 0.00 0.00 173.24 174.83 1h0h s VAL 126 N 0.41 1.96 0.00 4.45 -7.23 -0.57 -1.17 120.40 118.25 1h0h s VAL 126 Ca -0.04 -1.04 0.00 0.00 -1.81 0.00 0.00 61.98 59.09 1h0h s VAL 126 Cb -0.06 -1.64 0.00 0.00 0.56 0.00 0.00 36.38 35.25 1h0h s VAL 126 CO -0.01 0.55 0.00 0.61 -0.31 0.00 0.00 175.10 175.94 1h0h n GLY 127 N 2.66 3.34 3.63 2.32 0.00 0.13 -0.92 105.19 116.36 1h0h n GLY 127 Ca -0.16 -1.77 -0.12 0.00 0.00 0.00 0.00 46.02 43.97 1h0h n GLY 127 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1h0h s SER 128 N 0.00 -0.77 0.15 1.61 0.15 -1.25 -4.81 113.70 108.78 1h0h s SER 128 Ca 0.00 1.41 0.14 0.00 0.70 0.00 0.00 55.95 58.19 1h0h s SER 128 Cb 0.00 1.40 0.66 0.00 -1.71 0.00 0.00 66.02 66.37 1h0h s SER 128 CO 0.00 -0.24 1.42 0.00 1.20 0.00 0.00 173.24 175.62 1h0h n ALA 129 N 3.05 1.24 0.40 5.45 0.00 -1.26 -1.89 120.51 127.50 1h0h n ALA 129 Ca -0.15 0.07 0.13 0.00 0.00 0.00 0.00 53.44 53.49 1h0h n ALA 129 Cb 0.56 -1.21 0.44 0.00 0.00 0.00 0.00 19.45 19.24 1h0h n ALA 129 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1h0h h ALA 130 N 2.13 1.00 -2.26 0.00 0.00 -1.88 -3.22 119.26 115.03 1h0h h ALA 130 Ca 0.00 0.00 -0.48 0.00 0.00 0.00 0.00 54.91 54.43 1h0h h ALA 130 Cb 0.11 0.00 0.01 0.00 0.00 0.00 0.00 17.79 17.91 1h0h h ALA 130 CO 0.00 0.00 0.25 -1.64 0.00 0.00 0.00 179.25 177.86 1h0h s MET 131 N -3.31 3.86 0.78 0.00 1.00 -0.79 -4.98 119.30 115.86 1h0h s MET 131 Ca 0.06 0.71 -0.11 0.00 0.00 0.00 0.00 55.69 56.35 1h0h s MET 131 Cb 0.09 -2.26 0.07 0.00 0.00 0.00 0.00 34.83 32.72 1h0h s MET 131 CO 0.55 -0.16 1.12 -0.51 0.00 0.00 0.00 175.02 176.02 1h0h s ASP 132 N -3.12 4.21 0.23 3.03 1.01 -1.26 -4.77 116.67 115.99 1h0h s ASP 132 Ca 0.55 1.97 -0.06 0.00 0.71 0.00 0.00 52.55 55.72 1h0h s ASP 132 Cb -0.10 -2.54 0.37 0.00 1.01 0.00 0.00 42.92 41.66 1h0h s ASP 132 CO 0.31 -2.24 1.76 0.78 0.21 0.00 0.00 175.17 176.00 1h0h h ASN 133 N -1.06 0.41 0.10 0.27 2.35 -1.12 0.20 115.58 116.73 1h0h h ASN 133 Ca -0.44 0.07 -0.11 0.00 -0.55 0.00 0.00 56.30 55.28 1h0h h ASN 133 Cb 1.25 0.01 -0.01 0.00 0.05 0.00 0.00 38.32 39.62 1h0h h ASN 133 CO 0.49 0.22 -0.35 -0.33 -1.65 0.00 0.00 177.43 175.81 1h0h h GLU 134 N 0.56 0.36 -0.17 0.81 3.07 -1.92 -1.53 114.58 115.75 1h0h h GLU 134 Ca 0.37 -0.16 -0.09 0.00 -0.50 0.00 0.00 59.36 58.98 1h0h h GLU 134 Cb 0.45 -0.01 -0.00 0.00 -0.84 0.00 0.00 28.75 28.34 1h0h h GLU 134 CO -0.31 0.67 -0.25 0.93 -1.40 0.00 0.00 179.01 178.66 1h0h h GLU 135 N 0.31 0.47 -0.68 2.33 5.08 -1.69 -2.88 114.58 117.52 1h0h h GLU 135 Ca 0.04 -0.28 0.04 0.00 -1.00 0.00 0.00 59.36 58.16 1h0h h GLU 135 Cb 0.77 0.02 -0.05 0.00 0.50 0.00 0.00 28.75 30.00 1h0h h GLU 135 CO 0.06 0.87 0.41 0.00 -1.00 0.00 0.00 179.01 179.35 1h0h h TRP 137 N 0.78 0.22 0.00 0.00 7.01 -1.33 -0.71 115.95 121.93 1h0h h TRP 137 Ca 0.28 -0.04 -0.04 0.00 2.11 0.00 0.00 58.89 61.20 1h0h h TRP 137 Cb 0.08 -0.06 -0.01 0.00 -2.10 0.00 0.00 29.16 27.07 1h0h h TRP 137 CO -0.06 0.43 -0.21 -0.84 -2.79 0.00 0.00 178.44 174.97 1h0h h ILE 138 N -0.04 0.66 -0.05 2.65 3.07 -1.42 -1.95 117.51 120.42 1h0h h ILE 138 Ca 0.04 -0.90 -0.03 0.00 1.55 0.00 0.00 64.86 65.52 1h0h h ILE 138 Cb 0.33 1.57 -0.00 0.00 -0.27 0.00 0.00 36.82 38.46 1h0h h ILE 138 CO 0.00 0.20 -0.07 0.22 -1.05 0.00 0.00 178.15 177.46 1h0h h TYR 139 N 0.00 0.17 -0.54 0.16 3.20 -0.42 -1.26 116.97 118.28 1h0h h TYR 139 Ca -0.00 -0.06 -0.01 0.00 3.14 0.00 0.00 58.73 61.81 1h0h h TYR 139 Cb 0.56 -0.03 -0.03 0.00 1.54 0.00 0.00 36.73 38.77 1h0h h TYR 139 CO 0.00 0.63 0.31 -0.56 -1.64 0.00 0.00 178.16 176.90 1h0h h GLN 140 N -0.33 0.73 -0.36 1.82 -0.00 -1.09 -1.44 115.11 114.44 1h0h h GLN 140 Ca 0.01 -0.07 -0.04 0.00 -0.00 0.00 0.00 58.65 58.55 1h0h h GLN 140 Cb 0.60 -0.15 -0.01 0.00 -0.00 0.00 0.00 27.48 27.92 1h0h h GLN 140 CO 0.02 0.53 0.08 0.00 -0.00 0.00 0.00 178.83 179.45 1h0h h ALA 141 N 1.60 0.48 0.09 0.06 0.00 -1.15 -0.92 119.26 119.42 1h0h h ALA 141 Ca 0.19 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1h0h h ALA 141 Cb -0.00 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.65 1h0h h ALA 141 CO -0.03 0.17 -0.04 2.35 0.00 0.00 0.00 179.25 181.69 1h0h h TRP 142 N 0.44 -0.11 -0.61 0.00 7.01 -0.92 -0.53 115.95 121.23 1h0h h TRP 142 Ca 0.11 -0.00 0.05 0.00 2.11 0.00 0.00 58.89 61.16 1h0h h TRP 142 Cb 0.33 0.04 -0.05 0.00 -2.10 0.00 0.00 29.16 27.38 1h0h h TRP 142 CO 0.02 0.03 0.33 -0.07 -2.79 0.00 0.00 178.44 175.95 1h0h h LEU 143 N -0.22 0.48 -0.94 0.65 3.38 -1.21 -1.24 115.31 116.21 1h0h h LEU 143 Ca -0.01 0.03 -0.06 0.00 0.09 0.00 0.00 57.88 57.93 1h0h h LEU 143 Cb 0.19 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.85 1h0h h LEU 143 CO 0.02 0.32 0.11 0.03 0.09 0.00 0.00 178.44 179.01 1h0h h ARG 144 N 0.62 0.89 -0.04 1.13 3.08 -1.02 -1.05 114.38 117.98 1h0h h ARG 144 Ca 0.27 -0.20 -0.05 0.00 0.07 0.00 0.00 59.98 60.06 1h0h h ARG 144 Cb 0.16 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.08 1h0h h ARG 144 CO -0.17 0.81 -0.23 0.66 -1.07 0.00 0.00 179.97 179.97 1h0h h SER 145 N 0.85 0.06 0.87 7.04 4.64 -0.25 0.32 113.55 127.07 1h0h h SER 145 Ca 0.18 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.49 1h0h h SER 145 Cb 0.35 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.42 1h0h h SER 145 CO 0.00 0.30 0.00 0.18 -0.87 0.00 0.00 176.83 176.44 1h0h n LEU 146 N -4.24 0.20 0.00 5.97 4.77 -0.55 -3.38 117.00 119.78 1h0h n LEU 146 Ca -0.02 0.53 0.00 0.00 -0.03 0.00 0.00 56.01 56.49 1h0h n LEU 146 Cb 0.30 -0.48 0.00 0.00 -2.33 0.00 0.00 43.42 40.91 1h0h n LEU 146 CO 0.38 -0.18 0.00 0.61 -1.33 0.00 0.00 177.39 176.87 1h0h n GLY 147 N 0.79 0.75 3.77 -0.72 0.00 0.11 -4.50 105.19 105.39 1h0h n GLY 147 Ca 0.05 -0.15 -0.38 0.00 0.00 0.00 0.00 46.02 45.54 1h0h n GLY 147 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1h0h s LEU 148 N 0.00 4.10 0.00 0.99 1.02 -0.46 0.02 118.68 124.36 1h0h s LEU 148 Ca 0.00 2.41 0.00 0.00 0.02 0.00 0.00 54.13 56.56 1h0h s LEU 148 Cb 0.00 -4.10 0.00 0.00 0.02 0.00 0.00 46.19 42.11 1h0h s LEU 148 CO 0.00 -0.86 0.00 0.33 0.02 0.00 0.00 176.35 175.84 1h0h n PHE 149 N -0.21 0.00 -2.31 0.29 7.35 -1.26 -4.56 117.46 116.76 1h0h n PHE 149 Ca 0.06 0.00 -0.35 0.00 -0.76 0.00 0.00 57.45 56.40 1h0h n PHE 149 Cb 0.46 0.00 -0.04 0.00 0.35 0.00 0.00 39.48 40.26 1h0h n PHE 149 CO 0.00 0.00 0.00 0.71 -0.76 0.00 0.00 176.76 176.71 1h0h s TYR 150 N -1.92 2.25 -0.19 -5.13 2.02 -1.26 -4.58 117.35 108.54 1h0h s TYR 150 Ca 0.00 -0.30 -0.01 0.00 -0.37 0.00 0.00 57.07 56.38 1h0h s TYR 150 Cb 0.00 -4.37 0.05 0.00 -0.40 0.00 0.00 41.96 37.24 1h0h s TYR 150 CO 0.00 -1.69 -0.01 0.42 -1.57 0.00 0.00 175.55 172.70 1h0h s ILE 151 N 7.61 0.86 0.21 2.71 1.01 -1.26 -1.14 121.20 131.20 1h0h s ILE 151 Ca 0.59 -0.67 -0.03 0.00 0.00 0.00 0.00 60.65 60.55 1h0h s ILE 151 Cb -0.01 -1.22 -0.03 0.00 0.01 0.00 0.00 42.46 41.21 1h0h s ILE 151 CO 0.02 -0.08 0.19 -1.61 0.00 0.00 0.00 174.94 173.46 1h0h s GLU 152 N 1.72 1.27 0.09 2.79 0.41 -0.32 -1.02 118.70 123.63 1h0h s GLU 152 Ca -0.01 -1.58 -0.05 0.00 -0.41 0.00 0.00 54.97 52.92 1h0h s GLU 152 Cb -0.17 0.30 0.02 0.00 -1.78 0.00 0.00 34.13 32.50 1h0h s GLU 152 CO -0.07 -0.44 0.26 -2.39 -0.49 0.00 0.00 175.26 172.13 1h0h n HIS 153 N -0.30 -1.12 -0.30 1.61 1.44 -1.09 -0.69 115.22 114.79 1h0h n HIS 153 Ca 0.02 -0.46 0.05 0.00 -2.01 0.00 0.00 57.72 55.32 1h0h n HIS 153 Cb 0.65 0.23 0.12 0.00 0.12 0.00 0.00 29.99 31.11 1h0h n HIS 153 CO 0.00 0.00 0.00 1.04 -2.81 0.00 0.00 176.34 174.57 1h0h n GLN 154 N -0.18 -0.07 0.12 -1.40 3.00 -1.26 -1.87 117.38 115.71 1h0h n GLN 154 Ca -0.02 1.29 0.20 0.00 -0.01 0.00 0.00 57.00 58.46 1h0h n GLN 154 Cb 0.17 -1.93 0.75 0.00 0.00 0.00 0.00 30.24 29.22 1h0h n GLN 154 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1h0h h ALA 155 N 1.66 2.03 -0.93 -1.58 0.00 -1.94 -0.37 119.26 118.13 1h0h h ALA 155 Ca 0.40 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.30 1h0h h ALA 155 Cb 0.63 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.40 1h0h h ALA 155 CO -0.85 -0.63 0.59 -0.09 0.00 0.00 0.00 179.25 178.27 1h0h h ARG 156 N 0.00 1.24 0.00 0.00 9.65 -1.76 -0.92 114.38 122.59 1h0h h ARG 156 Ca 0.17 -0.09 0.00 0.00 -1.10 0.00 0.00 59.98 58.96 1h0h h ARG 156 Cb 1.05 -0.27 0.00 0.00 -1.39 0.00 0.00 29.97 29.36 1h0h h ARG 156 CO -0.00 0.85 0.00 -0.89 2.80 0.00 0.00 179.97 182.72 1h0h n ILE 157 N -4.40 1.02 0.00 1.20 5.41 -0.15 -3.82 119.36 118.61 1h0h n ILE 157 Ca 0.10 0.26 0.00 0.00 1.00 0.00 0.00 62.75 64.12 1h0h n ILE 157 Cb 0.03 -1.07 0.00 0.00 -0.71 0.00 0.00 39.64 37.90 1h0h n ILE 157 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 176.55 177.96 1h0h n HIS 159 N -1.66 0.00 -0.20 1.39 8.25 -0.40 -4.76 115.22 117.85 1h0h n HIS 159 Ca 0.03 0.00 -0.02 0.00 -0.26 0.00 0.00 57.72 57.47 1h0h n HIS 159 Cb 0.17 0.00 0.19 0.00 1.12 0.00 0.00 29.99 31.47 1h0h n HIS 159 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1h0h h SER 160 N 0.00 0.88 0.02 0.41 4.64 -1.53 -1.22 113.55 116.75 1h0h h SER 160 Ca 0.00 -0.09 -0.11 0.00 -0.47 0.00 0.00 61.79 61.11 1h0h h SER 160 Cb 0.22 -0.23 -0.01 0.00 -0.31 0.00 0.00 62.40 62.07 1h0h h SER 160 CO 0.00 0.75 -0.35 0.00 -0.87 0.00 0.00 176.83 176.36 1h0h h ALA 161 N 1.39 1.00 -0.29 5.18 0.00 -1.89 -2.24 119.26 122.40 1h0h h ALA 161 Ca 0.24 -0.40 -0.05 0.00 0.00 0.00 0.00 54.91 54.69 1h0h h ALA 161 Cb 0.10 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1h0h h ALA 161 CO -0.03 0.60 -0.03 1.15 0.00 0.00 0.00 179.25 180.94 1h0h h THR 162 N 0.39 1.27 -0.30 0.00 2.02 -1.67 -1.19 112.91 113.43 1h0h h THR 162 Ca 0.04 -1.01 -0.00 0.00 0.77 0.00 0.00 66.41 66.21 1h0h h THR 162 Cb 0.80 1.35 -0.01 0.00 -1.74 0.00 0.00 68.15 68.54 1h0h h THR 162 CO 0.06 0.32 0.18 0.58 0.37 0.00 0.00 175.52 177.04 1h0h h VAL 163 N 0.31 1.11 0.03 3.16 2.07 -1.19 0.02 116.25 121.76 1h0h h VAL 163 Ca 0.08 -0.25 0.02 0.00 0.82 0.00 0.00 66.70 67.37 1h0h h VAL 163 Cb 0.49 0.73 -0.03 0.00 -1.52 0.00 0.00 31.29 30.96 1h0h h VAL 163 CO 0.02 0.10 -0.15 0.00 0.02 0.00 0.00 177.57 177.57 1h0h h ALA 164 N 1.07 -0.20 -0.21 1.67 0.00 -1.28 -0.87 119.26 119.43 1h0h h ALA 164 Ca 0.11 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.94 1h0h h ALA 164 Cb 0.01 0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 1h0h h ALA 164 CO -0.02 -0.65 -0.14 0.00 0.00 0.00 0.00 179.25 178.44 1h0h h ALA 165 N 0.66 0.30 -0.00 0.00 0.00 -1.10 -2.70 119.26 116.42 1h0h h ALA 165 Ca 0.04 -0.32 -0.16 0.00 0.00 0.00 0.00 54.91 54.47 1h0h h ALA 165 Cb 0.31 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1h0h h ALA 165 CO -0.12 0.19 -0.77 -0.07 0.00 0.00 0.00 179.25 178.47 1h0h h LEU 166 N 0.17 0.02 -0.92 0.00 3.38 -0.99 -2.44 115.31 114.52 1h0h h LEU 166 Ca 0.04 -0.01 -0.11 0.00 0.09 0.00 0.00 57.88 57.89 1h0h h LEU 166 Cb 0.66 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.39 1h0h h LEU 166 CO 0.04 0.78 -0.49 0.00 0.09 0.00 0.00 178.44 178.86 1h0h h ALA 167 N 1.22 1.10 -0.03 1.53 0.00 -0.98 0.34 119.26 122.43 1h0h h ALA 167 Ca -0.01 -0.46 -0.00 0.00 0.00 0.00 0.00 54.91 54.44 1h0h h ALA 167 Cb 1.37 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 19.07 1h0h h ALA 167 CO 0.10 0.63 0.01 1.49 0.00 0.00 0.00 179.25 181.48 1h0h h GLU 168 N 0.10 0.05 -0.14 0.00 4.57 -1.35 0.29 114.58 118.10 1h0h h GLU 168 Ca 0.00 -0.01 -0.07 0.00 -1.18 0.00 0.00 59.36 58.10 1h0h h GLU 168 Cb 0.90 -0.01 -0.00 0.00 -0.16 0.00 0.00 28.75 29.48 1h0h h GLU 168 CO 0.07 0.27 -0.19 0.77 -1.18 0.00 0.00 179.01 178.74 1h0h h SER 169 N -0.18 0.40 0.00 1.04 0.02 -1.20 -3.39 113.55 110.24 1h0h h SER 169 Ca 0.01 -0.52 0.00 0.00 -0.84 0.00 0.00 61.79 60.44 1h0h h SER 169 Cb 0.24 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 62.67 1h0h h SER 169 CO 0.00 0.85 -0.72 -1.22 -1.14 0.00 0.00 176.83 174.60 1h0h n TYR 170 N -4.51 0.00 0.00 3.45 4.01 0.12 -0.43 117.16 119.80 1h0h n TYR 170 Ca -0.07 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.67 1h0h n TYR 170 Cb 0.40 -0.03 0.00 0.00 -0.31 0.00 0.00 39.34 39.40 1h0h n TYR 170 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1h0h n GLY 171 N 1.90 1.93 3.10 2.72 0.00 0.09 -4.58 105.19 110.34 1h0h n GLY 171 Ca -0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 1h0h n GLY 171 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1h0h s ARG 172 N -0.72 0.63 0.00 1.61 0.52 -1.26 -4.82 118.95 114.91 1h0h s ARG 172 Ca 0.00 -1.04 0.26 0.00 -0.52 0.00 0.00 55.73 54.43 1h0h s ARG 172 Cb 0.00 -0.10 0.60 0.00 0.52 0.00 0.00 34.95 35.98 1h0h s ARG 172 CO 0.00 -0.02 1.49 0.41 0.02 0.00 0.00 175.30 177.19 1h0h n GLY 173 N 0.65 0.34 3.85 -3.53 0.00 -1.26 -2.81 105.19 102.43 1h0h n GLY 173 Ca -0.17 -0.55 -0.31 0.00 0.00 0.00 0.00 46.02 44.98 1h0h n GLY 173 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h0h s ALA 174 N -2.08 2.96 0.23 4.61 0.00 -1.26 -4.47 121.76 121.74 1h0h s ALA 174 Ca 0.31 -0.03 -0.32 0.00 0.00 0.00 0.00 51.96 51.93 1h0h s ALA 174 Cb 0.20 -3.11 -0.12 0.00 0.00 0.00 0.00 23.12 20.09 1h0h s ALA 174 CO 0.36 -0.86 1.63 -0.12 0.00 0.00 0.00 175.76 176.77 1h0h n MET 175 N -2.86 2.56 0.09 0.00 0.00 -1.26 -4.87 117.12 110.78 1h0h n MET 175 Ca 0.06 0.92 -0.04 0.00 -0.00 0.00 0.00 57.70 58.64 1h0h n MET 175 Cb 0.54 -2.72 -0.02 0.00 0.00 0.00 0.00 33.22 31.03 1h0h n MET 175 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 175.97 177.76 1h0h h THR 176 N 3.57 1.56 0.00 1.12 1.35 -1.78 -3.46 112.91 115.27 1h0h h THR 176 Ca -0.45 -2.93 0.00 0.00 -0.55 0.00 0.00 66.41 62.48 1h0h h THR 176 Cb 1.23 2.60 0.00 0.00 -1.73 0.00 0.00 68.15 70.24 1h0h h THR 176 CO 0.88 0.83 0.00 0.59 -0.25 0.00 0.00 175.52 177.57 1h0h n ASN 177 N -3.47 0.00 -3.68 5.36 4.13 -1.26 -1.63 115.26 114.71 1h0h n ASN 177 Ca -0.00 0.00 -0.09 0.00 1.68 0.00 0.00 54.58 56.17 1h0h n ASN 177 Cb 0.82 0.00 -0.02 0.00 -1.54 0.00 0.00 39.78 39.04 1h0h n ASN 177 CO 0.00 0.00 0.00 -1.38 0.28 0.00 0.00 177.26 176.16 1h0h s HIS 178 N 4.07 -0.32 0.15 3.10 -3.43 -1.26 -4.61 115.29 112.98 1h0h s HIS 178 Ca 0.00 -0.02 -0.22 0.00 -0.80 0.00 0.00 55.06 54.02 1h0h s HIS 178 Cb 0.00 0.64 0.02 0.00 -1.43 0.00 0.00 32.58 31.82 1h0h s HIS 178 CO 0.00 -1.05 1.65 -1.49 -2.00 0.00 0.00 174.74 171.85 1h0h h TRP 179 N 2.00 -0.51 -0.14 0.38 4.06 -1.95 -1.89 115.95 117.90 1h0h h TRP 179 Ca -0.25 0.03 -0.00 0.00 2.06 0.00 0.00 58.89 60.73 1h0h h TRP 179 Cb 1.27 0.26 -0.01 0.00 -1.00 0.00 0.00 29.16 29.68 1h0h h TRP 179 CO 0.35 -0.27 0.07 0.82 -3.56 0.00 0.00 178.44 175.85 1h0h h ILE 180 N -0.20 1.05 0.00 1.49 2.04 -1.94 -2.11 117.51 117.84 1h0h h ILE 180 Ca 0.13 -0.13 0.00 0.00 1.00 0.00 0.00 64.86 65.85 1h0h h ILE 180 Cb 0.40 0.86 0.00 0.00 -0.74 0.00 0.00 36.82 37.34 1h0h h ILE 180 CO -0.34 0.06 0.00 -0.78 0.00 0.00 0.00 178.15 177.08 1h0h h ASP 181 N 0.20 0.00 -0.04 1.72 3.58 -1.57 -2.07 116.42 118.23 1h0h h ASP 181 Ca 0.05 0.00 0.01 0.00 0.42 0.00 0.00 57.03 57.51 1h0h h ASP 181 Cb 0.01 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.06 1h0h h ASP 181 CO -0.01 0.00 0.04 -0.07 -2.88 0.00 0.00 179.24 176.32 1h0h h LEU 182 N 0.00 0.00 -2.91 2.28 3.38 -1.43 -1.10 115.31 115.53 1h0h h LEU 182 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1h0h h LEU 182 Cb 0.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.93 1h0h h LEU 182 CO 0.00 0.00 0.00 0.07 0.09 0.00 0.00 178.44 178.60 1h0h h LYS 183 N 0.00 0.00 -0.02 1.13 2.10 -1.44 -2.18 116.57 116.16 1h0h h LYS 183 Ca 0.02 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.67 1h0h h LYS 183 Cb 0.10 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.43 1h0h h LYS 183 CO -0.00 0.00 -0.10 0.09 -2.00 0.00 0.00 179.45 177.44 1h0h n ASN 184 N -3.07 1.71 -4.77 7.07 3.02 -0.42 -4.09 115.26 114.71 1h0h n ASN 184 Ca -0.03 -1.45 -0.38 0.00 -0.03 0.00 0.00 54.58 52.69 1h0h n ASN 184 Cb 0.08 0.07 -0.04 0.00 -0.61 0.00 0.00 39.78 39.28 1h0h n ASN 184 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1h0h s SER 185 N -2.15 7.00 -0.04 6.41 0.15 -0.82 -4.37 113.70 119.88 1h0h s SER 185 Ca 0.31 2.09 0.12 0.00 0.70 0.00 0.00 55.95 59.18 1h0h s SER 185 Cb 0.20 -2.60 -0.23 0.00 -1.71 0.00 0.00 66.02 61.68 1h0h s SER 185 CO 0.39 -0.32 0.66 0.47 1.20 0.00 0.00 173.24 175.64 1h0h n ASP 186 N 0.45 0.93 -3.69 5.45 8.00 0.50 -4.64 116.55 123.55 1h0h n ASP 186 Ca 0.02 0.42 -0.15 0.00 0.71 0.00 0.00 54.79 55.79 1h0h n ASP 186 Cb 0.48 -0.10 -0.15 0.00 -0.02 0.00 0.00 41.12 41.33 1h0h n ASP 186 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1h0h s VAL 187 N -2.60 -0.23 -0.28 2.53 1.01 -1.15 -1.81 120.40 117.87 1h0h s VAL 187 Ca -0.05 0.30 -0.06 0.00 0.00 0.00 0.00 61.98 62.17 1h0h s VAL 187 Cb 0.08 -0.31 0.01 0.00 0.00 0.00 0.00 36.38 36.16 1h0h s VAL 187 CO 0.82 0.13 0.06 -0.63 0.00 0.00 0.00 175.10 175.47 1h0h s ILE 188 N 2.04 3.82 -0.32 2.22 1.01 -0.30 -1.18 121.20 128.48 1h0h s ILE 188 Ca -0.00 -0.70 -0.11 0.00 0.00 0.00 0.00 60.65 59.84 1h0h s ILE 188 Cb -0.12 -2.95 -0.01 0.00 0.01 0.00 0.00 42.46 39.39 1h0h s ILE 188 CO -0.06 0.12 0.20 -0.22 0.00 0.00 0.00 174.94 174.98 1h0h s LEU 189 N 1.48 4.30 -0.39 2.97 2.96 0.11 -1.28 118.68 128.84 1h0h s LEU 189 Ca 0.03 -0.46 -0.10 0.00 -0.22 0.00 0.00 54.13 53.38 1h0h s LEU 189 Cb -0.17 -2.07 0.05 0.00 0.50 0.00 0.00 46.19 44.50 1h0h s LEU 189 CO 0.01 -0.21 0.22 -0.04 -1.32 0.00 0.00 176.35 175.01 1h0h s MET 190 N 1.67 2.71 -0.06 1.98 -1.94 0.20 -0.04 119.30 123.82 1h0h s MET 190 Ca 0.05 -1.25 -0.03 0.00 -1.71 0.00 0.00 55.69 52.75 1h0h s MET 190 Cb -0.17 -3.72 0.04 0.00 2.01 0.00 0.00 34.83 32.98 1h0h s MET 190 CO 0.08 -0.81 0.11 1.41 -0.01 0.00 0.00 175.02 175.81 1h0h s MET 191 N 1.48 -0.01 -0.18 2.03 0.00 -0.68 -1.44 119.30 120.51 1h0h s MET 191 Ca 0.02 0.46 0.00 0.00 0.00 0.00 0.00 55.69 56.17 1h0h s MET 191 Cb -0.21 -0.36 0.00 0.00 0.00 0.00 0.00 34.83 34.27 1h0h s MET 191 CO 0.04 -0.30 0.00 0.41 0.00 0.00 0.00 175.02 175.17 1h0h n GLY 192 N 5.19 0.34 3.55 2.11 0.00 -1.23 -4.35 105.19 110.80 1h0h n GLY 192 Ca -0.07 -0.84 -0.09 0.00 0.00 0.00 0.00 46.02 45.02 1h0h n GLY 192 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1h0h s SER 193 N -2.92 -0.11 -0.41 1.61 1.04 -1.26 -1.82 113.70 109.83 1h0h s SER 193 Ca 0.00 -0.83 0.09 0.00 0.48 0.00 0.00 55.95 55.70 1h0h s SER 193 Cb 0.00 0.57 0.32 0.00 0.10 0.00 0.00 66.02 67.01 1h0h s SER 193 CO 0.00 -1.10 0.85 -3.20 0.98 0.00 0.00 173.24 170.77 1h0h n ASN 194 N -0.35 -0.59 0.25 7.02 5.15 -1.26 -4.96 115.26 120.52 1h0h n ASN 194 Ca -0.04 -3.23 0.11 0.00 -0.60 0.00 0.00 54.58 50.82 1h0h n ASN 194 Cb 0.62 0.42 0.72 0.00 -0.53 0.00 0.00 39.78 41.00 1h0h n ASN 194 CO 0.00 0.00 0.00 -0.65 1.40 0.00 0.00 177.26 178.01 1h0h h PRO 195 N 3.19 0.00 0.00 1.20 0.11 -1.94 -0.58 132.00 133.97 1h0h h PRO 195 Ca 0.01 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.11 1h0h h PRO 195 Cb 1.01 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.12 1h0h h PRO 195 CO 0.36 0.00 -0.06 0.00 -0.21 0.00 0.00 178.00 178.09 1h0h h ALA 196 N 1.98 1.49 0.00 -0.75 0.00 -1.88 0.30 119.26 120.41 1h0h h ALA 196 Ca 0.01 -0.06 -0.34 0.00 0.00 0.00 0.00 54.91 54.53 1h0h h ALA 196 Cb 0.06 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 17.78 1h0h h ALA 196 CO -0.00 0.08 -2.27 0.39 0.00 0.00 0.00 179.25 177.45 1h0h n GLU 197 N -3.88 0.64 0.00 0.00 1.02 -0.46 -4.17 120.64 113.79 1h0h n GLU 197 Ca -0.03 0.11 0.11 0.00 -0.02 0.00 0.00 57.16 57.33 1h0h n GLU 197 Cb 0.15 -1.45 -0.12 0.00 -0.02 0.00 0.00 31.44 30.00 1h0h n GLU 197 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1h0h n ASN 198 N -3.09 0.45 -3.05 1.62 3.02 -0.35 -4.04 115.26 109.81 1h0h n ASN 198 Ca -0.38 -0.36 -0.15 0.00 -0.03 0.00 0.00 54.58 53.66 1h0h n ASN 198 Cb 0.94 1.45 -0.01 0.00 -0.61 0.00 0.00 39.78 41.56 1h0h n ASN 198 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1h0h n HIS 199 N -1.97 -0.05 -0.20 3.10 8.25 0.05 -4.85 115.22 119.55 1h0h n HIS 199 Ca -0.00 -3.45 0.00 0.00 -0.26 0.00 0.00 57.72 54.01 1h0h n HIS 199 Cb 0.47 -0.15 0.09 0.00 1.12 0.00 0.00 29.99 31.51 1h0h n HIS 199 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 1h0h h PRO 200 N 2.98 0.07 0.00 -0.41 0.11 -1.61 0.11 132.00 133.25 1h0h h PRO 200 Ca 0.04 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.15 1h0h h PRO 200 Cb 1.02 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.12 1h0h h PRO 200 CO 0.45 0.05 0.00 0.82 -0.21 0.00 0.00 178.00 179.11 1h0h h ILE 201 N 0.08 0.00 -0.50 4.15 5.03 -1.89 -0.67 117.51 123.70 1h0h h ILE 201 Ca 0.31 -0.10 0.14 0.00 -0.12 0.00 0.00 64.86 65.09 1h0h h ILE 201 Cb 0.49 0.86 -0.02 0.00 -3.03 0.00 0.00 36.82 35.13 1h0h h ILE 201 CO -0.55 0.00 0.36 0.77 -0.68 0.00 0.00 178.15 178.05 1h0h h SER 202 N 0.00 0.02 0.62 1.72 4.64 -1.07 -1.02 113.55 118.46 1h0h h SER 202 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1h0h h SER 202 Cb 0.12 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 1h0h h SER 202 CO 0.00 0.01 0.00 -0.26 -0.87 0.00 0.00 176.83 175.71 1h0h h PHE 203 N 0.02 0.00 -0.50 4.77 -1.00 -1.27 -0.87 116.94 118.08 1h0h h PHE 203 Ca 0.24 0.00 0.04 0.00 2.81 0.00 0.00 57.97 61.06 1h0h h PHE 203 Cb 0.92 0.00 -0.04 0.00 3.61 0.00 0.00 35.95 40.44 1h0h h PHE 203 CO -0.00 0.00 0.26 -0.22 -1.61 0.00 0.00 178.31 176.74 1h0h h LYS 204 N 0.00 0.50 0.19 1.51 3.64 -1.36 -0.37 116.57 120.68 1h0h h LYS 204 Ca 0.00 -0.03 -0.33 0.00 -1.27 0.00 0.00 60.65 59.02 1h0h h LYS 204 Cb 0.31 -0.11 0.02 0.00 -0.41 0.00 0.00 32.23 32.03 1h0h h LYS 204 CO 0.00 0.33 -1.55 -1.49 -2.27 0.00 0.00 179.45 174.47 1h0h h TRP 205 N 0.52 0.72 -0.72 1.91 4.06 -1.43 -2.02 115.95 118.99 1h0h h TRP 205 Ca 0.22 -0.53 -0.02 0.00 2.06 0.00 0.00 58.89 60.62 1h0h h TRP 205 Cb 0.10 -0.03 -0.03 0.00 -1.00 0.00 0.00 29.16 28.20 1h0h h TRP 205 CO -0.09 1.53 0.36 0.28 -3.56 0.00 0.00 178.44 176.96 1h0h h VAL 206 N 0.11 1.23 -0.13 1.49 2.07 -1.20 -1.10 116.25 118.73 1h0h h VAL 206 Ca -0.27 -0.63 -0.12 0.00 0.82 0.00 0.00 66.70 66.51 1h0h h VAL 206 Cb 2.09 0.32 -0.01 0.00 -1.52 0.00 0.00 31.29 32.17 1h0h h VAL 206 CO 0.21 0.27 -0.43 0.24 0.02 0.00 0.00 177.57 177.88 1h0h h MET 207 N 1.01 0.29 -0.20 1.57 2.86 -1.07 -1.79 114.93 117.60 1h0h h MET 207 Ca 0.25 -0.15 -0.08 0.00 -2.06 0.00 0.00 59.70 57.66 1h0h h MET 207 Cb 0.09 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.74 1h0h h MET 207 CO -0.03 0.68 -0.22 0.00 1.06 0.00 0.00 176.91 178.40 1h0h h ARG 208 N 0.24 0.36 -0.32 1.72 3.08 -0.72 -0.10 114.38 118.64 1h0h h ARG 208 Ca 0.02 -0.12 -0.04 0.00 0.07 0.00 0.00 59.98 59.91 1h0h h ARG 208 Cb 0.86 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.87 1h0h h ARG 208 CO 0.07 0.57 0.06 0.00 -1.07 0.00 0.00 179.97 179.60 1h0h h ALA 209 N 1.45 0.43 -0.97 0.04 0.00 -0.83 -2.56 119.26 116.81 1h0h h ALA 209 Ca 0.05 -0.19 0.07 0.00 0.00 0.00 0.00 54.91 54.84 1h0h h ALA 209 Cb 0.57 -0.12 -0.07 0.00 0.00 0.00 0.00 17.79 18.17 1h0h h ALA 209 CO 0.04 0.12 0.62 -0.22 0.00 0.00 0.00 179.25 179.81 1h0h h LYS 210 N 0.36 1.09 0.00 0.00 3.64 -0.87 0.17 116.57 120.96 1h0h h LYS 210 Ca 0.10 -0.07 -0.01 0.00 -1.27 0.00 0.00 60.65 59.40 1h0h h LYS 210 Cb 0.33 -0.25 -0.00 0.00 -0.41 0.00 0.00 32.23 31.90 1h0h h LYS 210 CO 0.00 0.72 -0.07 -0.44 -2.27 0.00 0.00 179.45 177.40 1h0h h ASP 211 N 1.12 0.00 -0.04 4.20 3.32 -0.88 -0.17 116.42 123.97 1h0h h ASP 211 Ca 0.43 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.48 1h0h h ASP 211 Cb 0.19 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.74 1h0h h ASP 211 CO -0.18 0.07 0.00 0.29 -1.72 0.00 0.00 179.24 177.70 1h0h n LYS 212 N -4.01 1.71 0.00 3.56 5.02 0.51 -4.89 118.16 120.06 1h0h n LYS 212 Ca -0.03 -1.04 0.00 0.00 -2.02 0.00 0.00 58.31 55.22 1h0h n LYS 212 Cb 0.15 -1.47 0.00 0.00 -0.02 0.00 0.00 35.03 33.70 1h0h n LYS 212 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1h0h n GLY 213 N 1.18 1.16 3.77 0.72 0.00 -0.08 -5.09 105.19 106.86 1h0h n GLY 213 Ca 0.18 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.86 1h0h n GLY 213 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h0h s ALA 214 N -2.00 2.62 -0.19 4.61 0.00 -0.59 -4.97 121.76 121.24 1h0h s ALA 214 Ca 0.00 0.78 -0.12 0.00 0.00 0.00 0.00 51.96 52.62 1h0h s ALA 214 Cb 0.00 -3.36 -0.05 0.00 0.00 0.00 0.00 23.12 19.71 1h0h s ALA 214 CO 0.00 -0.95 0.21 0.99 0.00 0.00 0.00 175.76 176.02 1h0h s THR 215 N -1.90 5.35 -0.16 0.00 2.01 -0.75 -4.46 115.64 115.73 1h0h s THR 215 Ca 0.72 0.36 -0.04 0.00 0.31 0.00 0.00 61.69 63.04 1h0h s THR 215 Cb -0.24 -3.55 -0.03 0.00 0.01 0.00 0.00 72.50 68.69 1h0h s THR 215 CO 0.31 0.40 -0.02 -0.76 -0.69 0.00 0.00 174.62 173.87 1h0h s LEU 216 N 0.52 3.36 -0.05 4.42 1.43 -1.26 -1.14 118.68 125.95 1h0h s LEU 216 Ca 0.12 -0.09 0.04 0.00 -1.03 0.00 0.00 54.13 53.17 1h0h s LEU 216 Cb -0.12 -1.82 -0.00 0.00 0.03 0.00 0.00 46.19 44.28 1h0h s LEU 216 CO 0.01 0.17 -0.18 -0.63 0.23 0.00 0.00 176.35 175.95 1h0h s ILE 217 N 0.39 1.52 -0.14 -0.59 1.01 -0.40 -0.66 121.20 122.33 1h0h s ILE 217 Ca -0.02 -0.76 0.01 0.00 0.00 0.00 0.00 60.65 59.88 1h0h s ILE 217 Cb -0.14 -1.31 0.02 0.00 0.01 0.00 0.00 42.46 41.03 1h0h s ILE 217 CO 0.02 0.44 -0.17 -2.28 0.00 0.00 0.00 174.94 172.95 1h0h s HIS 218 N 0.10 2.34 -0.25 3.97 2.46 -0.18 -0.63 115.29 123.11 1h0h s HIS 218 Ca -0.06 -1.24 -0.00 0.00 0.47 0.00 0.00 55.06 54.22 1h0h s HIS 218 Cb -0.13 -1.66 0.04 0.00 -0.13 0.00 0.00 32.58 30.70 1h0h s HIS 218 CO 0.03 -0.63 -0.08 0.08 -2.47 0.00 0.00 174.74 171.68 1h0h s VAL 219 N 1.15 2.61 -0.27 0.89 1.01 -0.52 -0.82 120.40 124.45 1h0h s VAL 219 Ca -0.01 -1.26 -0.25 0.00 0.00 0.00 0.00 61.98 60.46 1h0h s VAL 219 Cb -0.14 -2.39 0.09 0.00 0.00 0.00 0.00 36.38 33.94 1h0h s VAL 219 CO -0.06 0.11 0.86 -0.62 0.00 0.00 0.00 175.10 175.39 1h0h s ASP 220 N 1.24 -0.61 0.45 3.32 -1.08 -0.71 -3.56 116.67 115.73 1h0h s ASP 220 Ca -0.03 1.16 0.30 0.00 -0.52 0.00 0.00 52.55 53.46 1h0h s ASP 220 Cb -0.18 1.17 1.61 0.00 -1.46 0.00 0.00 42.92 44.06 1h0h s ASP 220 CO -0.05 -0.21 1.90 1.55 0.52 0.00 0.00 175.17 178.88 1h0h h PRO 221 N 4.58 0.00 -6.35 4.34 0.13 -1.83 -3.30 132.00 129.57 1h0h h PRO 221 Ca -0.28 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.25 1h0h h PRO 221 Cb 1.17 0.00 -0.21 0.00 0.13 0.00 0.00 31.00 32.09 1h0h h PRO 221 CO 0.08 0.00 -0.83 1.03 -0.23 0.00 0.00 178.00 178.06 1h0h s ARG 222 N -3.76 1.26 -0.17 0.86 0.52 -1.26 -4.69 118.95 111.70 1h0h s ARG 222 Ca -0.03 -1.29 -0.19 0.00 -0.52 0.00 0.00 55.73 53.70 1h0h s ARG 222 Cb 0.09 -1.55 -0.03 0.00 0.52 0.00 0.00 34.95 33.97 1h0h s ARG 222 CO 0.27 0.35 0.53 -0.47 0.02 0.00 0.00 175.30 176.00 1h0h s TYR 223 N -1.35 3.42 0.12 -0.53 6.14 -0.46 -4.98 117.35 119.71 1h0h s TYR 223 Ca 0.11 0.85 0.01 0.00 0.64 0.00 0.00 57.07 58.68 1h0h s TYR 223 Cb -0.09 -2.66 -0.00 0.00 0.42 0.00 0.00 41.96 39.63 1h0h s TYR 223 CO 0.06 -0.02 0.02 0.25 0.64 0.00 0.00 175.55 176.50 1h0h n THR 224 N 4.27 0.00 -0.07 4.34 -2.24 -1.26 -4.83 114.28 114.49 1h0h n THR 224 Ca -0.05 -0.65 0.02 0.00 -2.27 0.00 0.00 64.05 61.10 1h0h n THR 224 Cb 0.51 0.19 0.34 0.00 -2.10 0.00 0.00 70.33 69.27 1h0h n THR 224 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 1h0h h ARG 225 N 0.00 0.69 -0.27 -0.78 3.08 -1.97 -1.65 114.38 113.49 1h0h h ARG 225 Ca -0.10 -0.06 0.02 0.00 0.07 0.00 0.00 59.98 59.91 1h0h h ARG 225 Cb 0.34 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.22 1h0h h ARG 225 CO 0.16 0.50 0.12 1.15 -1.07 0.00 0.00 179.97 180.83 1h0h h THR 226 N 0.70 0.98 -0.57 2.04 2.02 -1.91 -3.16 112.91 113.01 1h0h h THR 226 Ca 0.18 -0.09 0.11 0.00 0.77 0.00 0.00 66.41 67.38 1h0h h THR 226 Cb 0.00 0.69 -0.03 0.00 -1.74 0.00 0.00 68.15 67.07 1h0h h THR 226 CO -0.03 0.05 0.39 0.28 0.37 0.00 0.00 175.52 176.58 1h0h h SER 227 N 0.27 0.27 -0.53 4.18 0.02 -1.67 -2.00 113.55 114.08 1h0h h SER 227 Ca 0.11 0.01 0.15 0.00 -0.84 0.00 0.00 61.79 61.22 1h0h h SER 227 Cb 0.04 -0.05 -0.02 0.00 0.14 0.00 0.00 62.40 62.51 1h0h h SER 227 CO -0.08 0.16 0.48 0.71 -1.14 0.00 0.00 176.83 176.96 1h0h h THR 228 N 0.29 0.46 -0.02 -2.27 1.35 -1.50 -0.99 112.91 110.23 1h0h h THR 228 Ca 0.27 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.13 1h0h h THR 228 Cb 0.66 0.63 0.00 0.00 -1.73 0.00 0.00 68.15 67.71 1h0h h THR 228 CO -0.06 0.00 -0.26 0.29 -0.25 0.00 0.00 175.52 175.24 1h0h n LYS 229 N -3.91 1.72 -3.43 4.72 4.76 -0.75 -4.98 118.16 116.28 1h0h n LYS 229 Ca 0.10 -1.43 -0.35 0.00 -2.87 0.00 0.00 58.31 53.76 1h0h n LYS 229 Cb 0.70 -1.47 -0.06 0.00 -1.84 0.00 0.00 35.03 32.36 1h0h n LYS 229 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1h0h h ASP 231 N 3.60 0.45 -3.31 0.00 3.32 -1.21 -3.43 116.42 115.85 1h0h h ASP 231 Ca -0.49 -0.26 -0.52 0.00 0.02 0.00 0.00 57.03 55.79 1h0h h ASP 231 Cb 1.19 -0.13 -0.35 0.00 0.22 0.00 0.00 39.33 40.26 1h0h h ASP 231 CO 0.66 0.95 -0.81 -0.76 -1.72 0.00 0.00 179.24 177.56 1h0h s LEU 232 N -8.11 1.42 -0.12 1.55 1.43 -0.84 -5.02 118.68 108.97 1h0h s LEU 232 Ca -0.06 -0.30 0.02 0.00 -1.03 0.00 0.00 54.13 52.77 1h0h s LEU 232 Cb 0.11 -0.82 -0.00 0.00 0.03 0.00 0.00 46.19 45.51 1h0h s LEU 232 CO 0.82 -0.04 -0.19 -0.47 0.23 0.00 0.00 176.35 176.70 1h0h s TYR 233 N 1.17 2.68 -0.12 0.29 5.04 -1.26 -1.01 117.35 124.15 1h0h s TYR 233 Ca -0.05 -0.98 -0.00 0.00 -2.44 0.00 0.00 57.07 53.60 1h0h s TYR 233 Cb -0.14 -1.79 0.02 0.00 0.35 0.00 0.00 41.96 40.40 1h0h s TYR 233 CO -0.02 -0.40 -0.10 0.00 -1.34 0.00 0.00 175.55 173.69 1h0h s ALA 234 N 0.50 1.45 0.38 3.97 0.00 0.00 -4.98 121.76 123.10 1h0h s ALA 234 Ca -0.13 -0.63 -0.24 0.00 0.00 0.00 0.00 51.96 50.97 1h0h s ALA 234 Cb -0.17 -0.92 -0.10 0.00 0.00 0.00 0.00 23.12 21.93 1h0h s ALA 234 CO 0.05 -0.37 0.99 -1.25 0.00 0.00 0.00 175.76 175.18 1h0h s PRO 235 N 1.58 4.32 0.03 0.00 0.04 -1.25 -1.73 135.00 137.98 1h0h s PRO 235 Ca 0.04 1.34 -0.09 0.00 0.04 0.00 0.00 61.00 62.33 1h0h s PRO 235 Cb -0.13 -2.53 0.00 0.00 0.04 0.00 0.00 34.50 31.88 1h0h s PRO 235 CO -0.08 0.03 0.19 -0.48 0.04 0.00 0.00 177.00 176.69 1h0h s LEU 236 N -2.59 1.40 0.30 -3.56 2.34 -1.24 -4.24 118.68 111.09 1h0h s LEU 236 Ca 0.56 -0.35 -0.29 0.00 0.06 0.00 0.00 54.13 54.12 1h0h s LEU 236 Cb -0.17 0.91 -0.10 0.00 -0.56 0.00 0.00 46.19 46.27 1h0h s LEU 236 CO 0.22 -0.53 1.30 -0.60 -1.06 0.00 0.00 176.35 175.68 1h0h s ARG 237 N -2.40 4.38 -0.12 1.48 3.52 0.15 -3.53 118.95 122.44 1h0h s ARG 237 Ca -0.06 2.16 -0.40 0.00 -0.13 0.00 0.00 55.73 57.29 1h0h s ARG 237 Cb -0.02 -3.10 -0.18 0.00 -1.56 0.00 0.00 34.95 30.09 1h0h s ARG 237 CO -0.03 -0.17 1.40 0.43 -0.81 0.00 0.00 175.30 176.12 1h0h n SER 238 N 1.21 1.28 -0.01 -2.12 7.64 -1.26 -1.63 113.62 118.73 1h0h n SER 238 Ca 0.01 1.13 -0.00 0.00 1.01 0.00 0.00 58.87 61.02 1h0h n SER 238 Cb 0.42 -1.05 -0.00 0.00 -1.01 0.00 0.00 64.21 62.57 1h0h n SER 238 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1h0h n GLY 239 N 2.87 0.41 0.86 0.23 0.00 -1.26 -4.89 105.19 103.41 1h0h n GLY 239 Ca 0.23 -0.02 0.12 0.00 0.00 0.00 0.00 46.02 46.35 1h0h n GLY 239 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1h0h n SER 240 N -0.16 2.66 -0.29 1.61 3.41 -0.65 -4.58 113.62 115.61 1h0h n SER 240 Ca -0.00 -1.87 0.12 0.00 -0.26 0.00 0.00 58.87 56.86 1h0h n SER 240 Cb 0.10 -0.06 0.28 0.00 -0.26 0.00 0.00 64.21 64.27 1h0h n SER 240 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1h0h h ASP 241 N 3.93 0.26 -0.68 4.04 5.19 -1.91 -1.08 116.42 126.17 1h0h h ASP 241 Ca 0.00 0.15 0.10 0.00 -0.62 0.00 0.00 57.03 56.67 1h0h h ASP 241 Cb 0.84 0.15 -0.04 0.00 0.18 0.00 0.00 39.33 40.46 1h0h h ASP 241 CO 0.00 -0.01 0.45 0.40 -3.12 0.00 0.00 179.24 176.96 1h0h h ILE 242 N 0.37 0.90 -0.30 0.35 2.04 -1.94 0.31 117.51 119.23 1h0h h ILE 242 Ca 0.53 -0.18 -0.05 0.00 1.00 0.00 0.00 64.86 66.16 1h0h h ILE 242 Cb 0.98 0.34 -0.01 0.00 -0.74 0.00 0.00 36.82 37.39 1h0h h ILE 242 CO -0.53 0.09 -0.01 0.00 0.00 0.00 0.00 178.15 177.71 1h0h h ALA 243 N 1.66 0.41 -0.18 1.87 0.00 -1.55 1.00 119.26 122.47 1h0h h ALA 243 Ca 0.32 -0.24 0.02 0.00 0.00 0.00 0.00 54.91 55.01 1h0h h ALA 243 Cb 0.55 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 1h0h h ALA 243 CO -0.10 0.17 0.04 0.35 0.00 0.00 0.00 179.25 179.70 1h0h h PHE 244 N 0.33 0.07 -0.39 0.00 3.04 -1.20 -0.31 116.94 118.49 1h0h h PHE 244 Ca 0.09 0.01 -0.14 0.00 3.98 0.00 0.00 57.97 61.90 1h0h h PHE 244 Cb 0.45 -0.00 -0.01 0.00 2.56 0.00 0.00 35.95 38.95 1h0h h PHE 244 CO 0.04 0.03 -0.31 -0.07 -2.02 0.00 0.00 178.31 175.97 1h0h h LEU 245 N 0.12 0.94 -1.06 0.59 3.38 -0.86 -2.28 115.31 116.13 1h0h h LEU 245 Ca 0.08 -0.45 -0.09 0.00 0.09 0.00 0.00 57.88 57.52 1h0h h LEU 245 Cb 0.07 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 1h0h h LEU 245 CO -0.10 1.19 -0.28 0.78 0.09 0.00 0.00 178.44 180.12 1h0h h ASN 246 N 0.70 0.32 -0.50 -0.43 4.21 -0.71 -1.36 115.58 117.81 1h0h h ASN 246 Ca 0.07 -0.11 -0.06 0.00 1.21 0.00 0.00 56.30 57.42 1h0h h ASN 246 Cb 0.89 -0.09 -0.03 0.00 -1.12 0.00 0.00 38.32 37.98 1h0h h ASN 246 CO 0.08 0.60 0.12 1.23 -1.29 0.00 0.00 177.43 178.17 1h0h h GLY 247 N 1.03 0.93 1.12 2.83 0.00 -0.92 -1.36 103.07 106.70 1h0h h GLY 247 Ca 0.04 -0.56 -0.06 0.00 0.00 0.00 0.00 47.33 46.75 1h0h h GLY 247 CO 0.05 0.52 0.19 1.98 0.00 0.00 0.00 176.54 179.28 1h0h h MET 248 N 0.83 1.10 -0.53 4.80 1.85 -0.76 -1.73 114.93 120.49 1h0h h MET 248 Ca 0.18 -0.25 -0.01 0.00 -0.61 0.00 0.00 59.70 59.02 1h0h h MET 248 Cb 0.33 -0.15 -0.03 0.00 0.43 0.00 0.00 31.60 32.18 1h0h h MET 248 CO 0.00 0.95 0.31 1.15 -0.40 0.00 0.00 176.91 178.93 1h0h h THR 249 N 1.05 1.17 -0.28 -0.77 2.02 -0.67 0.16 112.91 115.59 1h0h h THR 249 Ca 0.22 -0.39 0.03 0.00 0.77 0.00 0.00 66.41 67.04 1h0h h THR 249 Cb 0.34 0.47 -0.03 0.00 -1.74 0.00 0.00 68.15 67.19 1h0h h THR 249 CO -0.00 0.17 0.10 0.50 0.37 0.00 0.00 175.52 176.67 1h0h h LYS 250 N 0.71 0.23 -0.34 6.66 3.64 -1.10 -0.80 116.57 125.57 1h0h h LYS 250 Ca 0.19 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.55 1h0h h LYS 250 Cb 0.01 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.76 1h0h h LYS 250 CO -0.03 0.15 0.20 -0.92 -2.27 0.00 0.00 179.45 176.58 1h0h h TYR 251 N 0.23 0.45 -0.27 1.91 3.20 -0.76 0.16 116.97 121.88 1h0h h TYR 251 Ca 0.12 -0.00 0.04 0.00 3.14 0.00 0.00 58.73 62.02 1h0h h TYR 251 Cb 0.08 -0.15 -0.04 0.00 1.54 0.00 0.00 36.73 38.17 1h0h h TYR 251 CO -0.12 0.33 0.06 0.82 -1.64 0.00 0.00 178.16 177.61 1h0h h ILE 252 N 0.43 0.87 -0.28 1.81 2.04 -0.40 -1.06 117.51 120.92 1h0h h ILE 252 Ca 0.12 -0.06 -0.08 0.00 1.00 0.00 0.00 64.86 65.85 1h0h h ILE 252 Cb 0.02 0.70 -0.01 0.00 -0.74 0.00 0.00 36.82 36.79 1h0h h ILE 252 CO -0.02 0.03 -0.12 -0.07 0.00 0.00 0.00 178.15 177.96 1h0h h LEU 253 N 0.16 0.59 -0.67 1.44 3.38 -0.81 -1.35 115.31 118.06 1h0h h LEU 253 Ca 0.13 -0.40 -0.13 0.00 0.09 0.00 0.00 57.88 57.56 1h0h h LEU 253 Cb 0.13 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 1h0h h LEU 253 CO -0.16 0.86 -0.40 -0.33 0.09 0.00 0.00 178.44 178.50 1h0h h GLU 254 N 0.32 0.57 -0.46 1.13 5.08 -0.60 -2.89 114.58 117.74 1h0h h GLU 254 Ca 0.06 -0.29 0.00 0.00 -1.00 0.00 0.00 59.36 58.13 1h0h h GLU 254 Cb 0.63 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.89 1h0h h GLU 254 CO 0.04 0.88 0.00 1.63 -1.00 0.00 0.00 179.01 180.55 1h0h n LYS 255 N -4.03 2.08 -3.90 2.33 4.76 -0.41 -4.93 118.16 114.05 1h0h n LYS 255 Ca -0.02 -1.67 -0.27 0.00 -2.87 0.00 0.00 58.31 53.48 1h0h n LYS 255 Cb 0.51 -1.37 0.00 0.00 -1.84 0.00 0.00 35.03 32.34 1h0h n LYS 255 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 1h0h n GLU 256 N 0.86 -4.24 0.00 1.97 1.02 -1.03 -4.87 120.64 114.35 1h0h n GLU 256 Ca 0.16 0.51 0.13 0.00 -0.02 0.00 0.00 57.16 57.93 1h0h n GLU 256 Cb 0.40 -5.00 0.32 0.00 -0.02 0.00 0.00 31.44 27.14 1h0h n GLU 256 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1h0h n LEU 257 N -4.42 1.35 -4.81 -4.62 4.77 -0.54 -4.93 117.00 103.80 1h0h n LEU 257 Ca -0.18 -0.41 -0.31 0.00 -0.03 0.00 0.00 56.01 55.07 1h0h n LEU 257 Cb 0.63 -0.08 0.06 0.00 -2.33 0.00 0.00 43.42 41.69 1h0h n LEU 257 CO 0.75 0.25 0.71 -0.72 -1.33 0.00 0.00 177.39 177.04 1h0h s TYR 258 N -2.40 3.06 -0.66 -1.77 -0.85 -1.25 -4.40 117.35 109.08 1h0h s TYR 258 Ca 0.26 1.41 -0.19 0.00 -0.52 0.00 0.00 57.07 58.03 1h0h s TYR 258 Cb 0.19 -2.91 0.11 0.00 0.38 0.00 0.00 41.96 39.74 1h0h s TYR 258 CO 0.49 -1.31 0.80 0.12 -1.52 0.00 0.00 175.55 174.13 1h0h s PHE 259 N -3.04 3.03 0.13 -3.49 5.36 0.41 -4.96 117.98 115.41 1h0h s PHE 259 Ca 0.58 -1.04 -0.24 0.00 -0.96 0.00 0.00 56.93 55.28 1h0h s PHE 259 Cb -0.14 -4.07 -0.02 0.00 -0.34 0.00 0.00 43.02 38.45 1h0h s PHE 259 CO 0.55 -1.35 1.65 -0.22 -1.46 0.00 0.00 175.22 174.39 1h0h h LYS 260 N 9.09 -0.27 -0.74 10.12 3.64 -1.92 -0.57 116.57 135.92 1h0h h LYS 260 Ca -0.21 0.02 0.04 0.00 -1.27 0.00 0.00 60.65 59.23 1h0h h LYS 260 Cb 1.07 0.06 -0.05 0.00 -0.41 0.00 0.00 32.23 32.91 1h0h h LYS 260 CO 1.09 -0.18 0.46 -0.44 -2.27 0.00 0.00 179.45 178.10 1h0h h ASP 261 N -0.28 0.74 -0.20 4.20 5.19 -1.99 0.83 116.42 124.90 1h0h h ASP 261 Ca 0.09 0.01 -0.01 0.00 -0.62 0.00 0.00 57.03 56.50 1h0h h ASP 261 Cb 0.42 -0.15 -0.01 0.00 0.18 0.00 0.00 39.33 39.77 1h0h h ASP 261 CO -0.27 0.50 0.09 0.22 -3.12 0.00 0.00 179.24 176.66 1h0h h TYR 262 N 0.87 0.30 -0.67 4.55 5.03 -1.88 -0.89 116.97 124.29 1h0h h TYR 262 Ca 0.30 -0.02 0.05 0.00 2.58 0.00 0.00 58.73 61.64 1h0h h TYR 262 Cb 0.06 -0.09 -0.05 0.00 1.55 0.00 0.00 36.73 38.20 1h0h h TYR 262 CO -0.04 0.33 0.39 0.28 -1.32 0.00 0.00 178.16 177.79 1h0h h VAL 263 N 0.18 1.01 -0.13 1.81 2.07 -0.42 -0.05 116.25 120.73 1h0h h VAL 263 Ca 0.07 -0.25 -0.03 0.00 0.82 0.00 0.00 66.70 67.31 1h0h h VAL 263 Cb 0.15 0.22 -0.00 0.00 -1.52 0.00 0.00 31.29 30.13 1h0h h VAL 263 CO -0.01 0.13 -0.02 0.58 0.02 0.00 0.00 177.57 178.28 1h0h h VAL 264 N 0.73 1.27 -0.44 2.57 2.07 -0.72 -2.83 116.25 118.91 1h0h h VAL 264 Ca 0.29 -0.91 -0.14 0.00 0.82 0.00 0.00 66.70 66.76 1h0h h VAL 264 Cb 0.13 1.61 -0.01 0.00 -1.52 0.00 0.00 31.29 31.50 1h0h h VAL 264 CO -0.15 0.27 -0.26 0.78 0.02 0.00 0.00 177.57 178.22 1h0h h ASN 265 N -0.04 0.96 0.00 0.57 2.35 -0.89 -3.39 115.58 115.14 1h0h h ASN 265 Ca 0.04 -0.38 0.00 0.00 -0.55 0.00 0.00 56.30 55.41 1h0h h ASN 265 Cb 0.42 -0.27 0.00 0.00 0.05 0.00 0.00 38.32 38.52 1h0h h ASN 265 CO 0.01 1.16 0.00 -1.22 -1.65 0.00 0.00 177.43 175.73 1h0h n TYR 266 N -4.09 0.00 -4.57 1.19 4.01 -0.05 -4.81 117.16 108.83 1h0h n TYR 266 Ca -0.00 -0.05 -0.26 0.00 -0.16 0.00 0.00 57.90 57.43 1h0h n TYR 266 Cb 0.48 -0.00 -0.11 0.00 -0.31 0.00 0.00 39.34 39.39 1h0h n TYR 266 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 1h0h s THR 267 N -0.09 1.82 -0.66 -0.72 -4.23 -1.07 -1.07 115.64 109.61 1h0h s THR 267 Ca 0.00 -2.02 0.05 0.00 -1.18 0.00 0.00 61.69 58.55 1h0h s THR 267 Cb 0.00 -2.91 0.33 0.00 1.34 0.00 0.00 72.50 71.26 1h0h s THR 267 CO 0.00 -0.02 1.03 -0.46 -0.54 0.00 0.00 174.62 174.63 1h0h n ASN 268 N -0.88 2.95 -0.30 3.99 6.94 0.91 -4.39 115.26 124.49 1h0h n ASN 268 Ca -0.04 -2.40 0.27 0.00 -0.02 0.00 0.00 54.58 52.39 1h0h n ASN 268 Cb 0.67 -0.58 0.61 0.00 -2.36 0.00 0.00 39.78 38.11 1h0h n ASN 268 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1h0h h ALA 269 N 2.73 2.57 0.00 -2.53 0.00 -1.85 0.16 119.26 120.35 1h0h h ALA 269 Ca 0.02 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1h0h h ALA 269 Cb 1.15 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1h0h h ALA 269 CO 0.22 -0.93 -0.29 -1.13 0.00 0.00 0.00 179.25 177.11 1h0h n SER 270 N -4.44 0.42 -4.75 0.00 3.41 -1.26 -1.23 113.62 105.76 1h0h n SER 270 Ca 0.24 0.18 -0.41 0.00 -0.26 0.00 0.00 58.87 58.62 1h0h n SER 270 Cb 0.99 -0.16 -0.01 0.00 -0.26 0.00 0.00 64.21 64.76 1h0h n SER 270 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 1h0h s PHE 271 N -3.05 2.79 -0.24 7.33 0.40 0.04 -0.36 117.98 124.89 1h0h s PHE 271 Ca 0.11 0.91 -0.23 0.00 -0.60 0.00 0.00 56.93 57.11 1h0h s PHE 271 Cb 0.16 -4.00 -0.01 0.00 0.51 0.00 0.00 43.02 39.68 1h0h s PHE 271 CO 0.63 -3.27 0.76 0.42 0.70 0.00 0.00 175.22 174.46 1h0h s ILE 272 N -0.21 4.89 0.19 0.64 -1.09 -0.40 -1.12 121.20 124.11 1h0h s ILE 272 Ca 0.60 1.42 -0.22 0.00 -2.23 0.00 0.00 60.65 60.22 1h0h s ILE 272 Cb -0.46 -4.05 -0.08 0.00 -1.58 0.00 0.00 42.46 36.28 1h0h s ILE 272 CO 0.49 -0.03 0.75 -0.69 -1.23 0.00 0.00 174.94 174.24 1h0h s VAL 273 N 2.65 4.47 0.98 2.92 1.01 0.06 -0.52 120.40 131.98 1h0h s VAL 273 Ca 0.32 1.49 -0.11 0.00 0.00 0.00 0.00 61.98 63.68 1h0h s VAL 273 Cb -0.15 -3.99 0.18 0.00 0.00 0.00 0.00 36.38 32.42 1h0h s VAL 273 CO 0.08 0.36 1.10 -0.83 0.00 0.00 0.00 175.10 175.81 1h0h s GLY 274 N -1.40 1.63 0.19 4.51 0.00 -0.13 -4.57 107.32 107.55 1h0h s GLY 274 Ca 0.39 0.25 0.20 0.00 0.00 0.00 0.00 44.72 45.56 1h0h s GLY 274 CO 0.23 0.77 1.61 1.18 0.00 0.00 0.00 173.10 176.89 1h0h n GLU 275 N -4.35 0.13 0.26 2.90 1.02 -1.26 -2.23 120.64 117.11 1h0h n GLU 275 Ca 0.08 0.41 0.15 0.00 -0.02 0.00 0.00 57.16 57.79 1h0h n GLU 275 Cb 0.53 -1.77 0.63 0.00 -0.02 0.00 0.00 31.44 30.81 1h0h n GLU 275 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 1h0h h GLY 276 N 1.90 0.00 -3.73 0.62 0.00 -1.91 -3.44 103.07 96.51 1h0h h GLY 276 Ca 0.00 0.00 -0.51 0.00 0.00 0.00 0.00 47.33 46.82 1h0h h GLY 276 CO 0.00 0.00 0.57 -0.12 0.00 0.00 0.00 176.54 176.99 1h0h s PHE 277 N -3.68 3.21 0.11 5.60 5.36 -0.79 -4.76 117.98 123.02 1h0h s PHE 277 Ca 0.01 1.52 -0.26 0.00 -0.96 0.00 0.00 56.93 57.25 1h0h s PHE 277 Cb 0.09 -3.51 0.07 0.00 -0.34 0.00 0.00 43.02 39.33 1h0h s PHE 277 CO 0.57 -1.38 0.85 0.00 -1.46 0.00 0.00 175.22 173.80 1h0h s ALA 278 N -1.19 -1.67 -0.17 11.12 0.00 -1.26 -4.98 121.76 123.61 1h0h s ALA 278 Ca 0.49 0.48 -0.09 0.00 0.00 0.00 0.00 51.96 52.84 1h0h s ALA 278 Cb -0.36 0.61 0.06 0.00 0.00 0.00 0.00 23.12 23.44 1h0h s ALA 278 CO 0.47 -0.86 0.40 0.12 0.00 0.00 0.00 175.76 175.89 1h0h s PHE 279 N -3.36 -0.63 -0.14 0.00 5.36 -1.26 -1.05 117.98 116.91 1h0h s PHE 279 Ca 0.08 1.31 -0.04 0.00 -0.96 0.00 0.00 56.93 57.31 1h0h s PHE 279 Cb -0.02 0.26 0.07 0.00 -0.34 0.00 0.00 43.02 42.99 1h0h s PHE 279 CO -0.04 -0.37 0.25 -2.00 -1.46 0.00 0.00 175.22 171.60 1h0h s GLU 280 N 1.64 0.14 -1.48 10.12 2.56 -0.27 -4.94 118.70 126.47 1h0h s GLU 280 Ca -0.08 0.65 -0.07 0.00 0.00 0.00 0.00 54.97 55.47 1h0h s GLU 280 Cb -0.09 -0.23 0.05 0.00 2.00 0.00 0.00 34.13 35.87 1h0h s GLU 280 CO -0.13 -0.35 0.65 0.39 -0.56 0.00 0.00 175.26 175.27 1h0h n GLU 281 N 5.34 -3.95 0.00 4.30 -0.58 -1.26 -1.36 120.64 123.13 1h0h n GLU 281 Ca -0.06 0.47 0.00 0.00 -0.42 0.00 0.00 57.16 57.15 1h0h n GLU 281 Cb 0.50 -4.94 0.00 0.00 -0.57 0.00 0.00 31.44 26.42 1h0h n GLU 281 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1h0h n GLY 282 N -1.73 1.82 3.47 0.62 0.00 -1.26 -3.31 105.19 104.80 1h0h n GLY 282 Ca -0.16 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.53 1h0h n GLY 282 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1h0h s LEU 283 N 0.00 3.13 0.85 0.99 1.43 -0.47 -4.90 118.68 119.71 1h0h s LEU 283 Ca 0.00 -0.17 -0.12 0.00 -1.03 0.00 0.00 54.13 52.81 1h0h s LEU 283 Cb 0.00 -1.74 0.10 0.00 0.03 0.00 0.00 46.19 44.58 1h0h s LEU 283 CO 0.00 0.18 1.12 -0.36 0.23 0.00 0.00 176.35 177.52 1h0h s PHE 284 N 0.32 2.69 0.86 0.29 0.08 -1.26 -1.12 117.98 119.84 1h0h s PHE 284 Ca -0.05 0.96 -0.11 0.00 0.12 0.00 0.00 56.93 57.85 1h0h s PHE 284 Cb -0.14 -3.29 0.11 0.00 -0.57 0.00 0.00 43.02 39.13 1h0h s PHE 284 CO 0.04 -2.06 1.11 0.00 -0.10 0.00 0.00 175.22 174.20 1h0h s ALA 285 N -3.26 1.73 -0.12 5.36 0.00 -0.21 -3.74 121.76 121.52 1h0h s ALA 285 Ca 0.62 0.31 0.00 0.00 0.00 0.00 0.00 51.96 52.90 1h0h s ALA 285 Cb -0.14 -3.32 0.00 0.00 0.00 0.00 0.00 23.12 19.65 1h0h s ALA 285 CO 0.53 -2.31 0.00 0.41 0.00 0.00 0.00 175.76 174.39 1h0h n GLY 286 N -0.60 0.50 3.72 0.00 0.00 -1.26 -4.71 105.19 102.85 1h0h n GLY 286 Ca 0.09 -0.45 -0.42 0.00 0.00 0.00 0.00 46.02 45.25 1h0h n GLY 286 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1h0h s TYR 287 N -1.98 3.65 -0.35 1.61 5.04 -1.25 -0.06 117.35 124.02 1h0h s TYR 287 Ca 0.00 1.64 -0.10 0.00 -2.44 0.00 0.00 57.07 56.18 1h0h s TYR 287 Cb 0.00 -3.17 0.02 0.00 0.35 0.00 0.00 41.96 39.16 1h0h s TYR 287 CO 0.00 -0.24 0.17 1.21 -1.34 0.00 0.00 175.55 175.36 1h0h s ASN 288 N 0.70 5.60 0.41 4.32 3.84 -0.36 -4.97 114.94 124.48 1h0h s ASN 288 Ca 0.52 -0.89 0.19 0.00 0.21 0.00 0.00 52.86 52.89 1h0h s ASN 288 Cb -0.24 -1.99 0.86 0.00 -0.55 0.00 0.00 41.25 39.33 1h0h s ASN 288 CO 0.29 -0.32 1.83 0.07 -2.79 0.00 0.00 177.10 176.18 1h0h h LYS 289 N 8.38 0.00 -0.14 0.43 2.10 -1.96 0.39 116.57 125.78 1h0h h LYS 289 Ca -0.27 0.00 -0.14 0.00 -2.00 0.00 0.00 60.65 58.24 1h0h h LYS 289 Cb 1.11 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.45 1h0h h LYS 289 CO 0.64 0.32 -0.45 0.93 -2.00 0.00 0.00 179.45 178.90 1h0h h GLU 290 N 0.00 0.54 0.00 0.07 5.08 -1.96 -3.28 114.58 115.04 1h0h h GLU 290 Ca -0.00 -0.40 0.00 0.00 -1.00 0.00 0.00 59.36 57.95 1h0h h GLU 290 Cb 0.71 0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.03 1h0h h GLU 290 CO 0.04 1.02 -0.78 0.25 -1.00 0.00 0.00 179.01 178.54 1h0h n THR 291 N -4.25 0.05 -3.75 1.13 -2.24 -1.18 -4.95 114.28 99.08 1h0h n THR 291 Ca -0.07 -0.07 -0.27 0.00 -2.27 0.00 0.00 64.05 61.38 1h0h n THR 291 Cb 0.57 0.45 0.05 0.00 -2.10 0.00 0.00 70.33 69.30 1h0h n THR 291 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1h0h n ARG 292 N -1.63 -6.71 -4.24 -0.78 1.74 0.14 -4.99 116.66 100.19 1h0h n ARG 292 Ca 0.04 0.71 -0.19 0.00 -0.77 0.00 0.00 57.85 57.65 1h0h n ARG 292 Cb 0.36 -5.68 -0.13 0.00 -1.02 0.00 0.00 32.46 26.00 1h0h n ARG 292 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1h0h s LYS 293 N -6.43 0.86 0.08 5.56 1.02 -1.14 -4.32 119.74 115.38 1h0h s LYS 293 Ca 0.59 -0.86 -0.05 0.00 0.02 0.00 0.00 55.97 55.67 1h0h s LYS 293 Cb -0.28 -0.86 -0.05 0.00 -0.52 0.00 0.00 37.83 36.12 1h0h s LYS 293 CO 0.78 0.20 0.31 0.71 -0.92 0.00 0.00 175.35 176.44 1h0h s TYR 294 N -1.09 3.52 -0.60 3.18 2.02 -1.26 -1.22 117.35 121.90 1h0h s TYR 294 Ca -0.01 0.52 -0.22 0.00 -0.37 0.00 0.00 57.07 56.99 1h0h s TYR 294 Cb -0.09 -1.97 0.06 0.00 -0.40 0.00 0.00 41.96 39.57 1h0h s TYR 294 CO 0.02 0.52 0.89 0.34 -1.57 0.00 0.00 175.55 175.75 1h0h s ASP 295 N -2.18 6.23 0.34 2.29 -1.08 0.92 -4.91 116.67 118.28 1h0h s ASP 295 Ca 0.35 -0.83 0.26 0.00 -0.52 0.00 0.00 52.55 51.81 1h0h s ASP 295 Cb -0.13 -2.40 1.15 0.00 -1.46 0.00 0.00 42.92 40.08 1h0h s ASP 295 CO 0.22 -1.28 1.79 0.11 0.52 0.00 0.00 175.17 176.53 1h0h h LYS 296 N 9.39 0.00 0.00 4.34 1.57 -1.91 -2.60 116.57 127.35 1h0h h LYS 296 Ca -0.28 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.50 1h0h h LYS 296 Cb 1.08 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.39 1h0h h LYS 296 CO 1.12 0.00 -0.01 0.66 -0.57 0.00 0.00 179.45 180.64 1h0h h SER 297 N 0.00 0.00 0.42 0.86 4.64 -1.93 0.15 113.55 117.70 1h0h h SER 297 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1h0h h SER 297 Cb 0.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 1h0h h SER 297 CO 0.00 0.01 0.00 0.11 -0.87 0.00 0.00 176.83 176.08 1h0h h LYS 298 N 0.00 0.00 -0.25 4.77 1.79 -1.81 -2.67 116.57 118.41 1h0h h LYS 298 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1h0h h LYS 298 Cb 0.10 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.75 1h0h h LYS 298 CO 0.00 0.00 0.00 0.91 -1.08 0.00 0.00 179.45 179.28 1h0h n TRP 299 N -2.60 0.31 -1.08 -1.35 8.01 0.53 -1.89 117.44 119.37 1h0h n TRP 299 Ca -0.00 -0.16 -0.31 0.00 -1.31 0.00 0.00 57.50 55.72 1h0h n TRP 299 Cb 0.15 -0.00 0.13 0.00 -2.01 0.00 0.00 31.31 29.58 1h0h n TRP 299 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1h0h s GLY 300 N -1.66 1.66 0.44 6.99 0.00 -1.01 -4.70 107.32 109.04 1h0h s GLY 300 Ca 0.34 0.26 -0.21 0.00 0.00 0.00 0.00 44.72 45.11 1h0h s GLY 300 CO 0.31 0.67 0.97 -1.36 0.00 0.00 0.00 173.10 173.69 1h0h s PHE 301 N -2.83 3.26 -0.09 1.90 0.08 -1.26 -0.96 117.98 118.08 1h0h s PHE 301 Ca 0.63 1.61 -0.30 0.00 0.12 0.00 0.00 56.93 59.00 1h0h s PHE 301 Cb -0.19 -2.91 -0.02 0.00 -0.57 0.00 0.00 43.02 39.33 1h0h s PHE 301 CO 0.57 -0.27 1.17 -2.00 -0.10 0.00 0.00 175.22 174.60 1h0h s GLU 302 N -3.13 4.34 0.10 0.44 2.12 0.33 -4.60 118.70 118.29 1h0h s GLU 302 Ca 0.63 1.61 0.04 0.00 0.36 0.00 0.00 54.97 57.61 1h0h s GLU 302 Cb -0.11 -3.60 -0.04 0.00 0.26 0.00 0.00 34.13 30.64 1h0h s GLU 302 CO 0.15 -0.48 0.06 1.03 -0.54 0.00 0.00 175.26 175.48 1h0h s ARG 303 N 2.46 2.75 0.14 4.30 0.52 -1.26 -0.64 118.95 127.23 1h0h s ARG 303 Ca 0.54 -0.79 -0.02 0.00 -0.52 0.00 0.00 55.73 54.95 1h0h s ARG 303 Cb -0.23 -2.64 0.03 0.00 0.52 0.00 0.00 34.95 32.64 1h0h s ARG 303 CO 0.19 0.54 0.19 -0.40 0.02 0.00 0.00 175.30 175.84 1h0h n ASP 304 N 0.34 0.09 0.07 0.23 5.68 0.28 -4.85 116.55 118.40 1h0h n ASP 304 Ca -0.09 -1.11 0.04 0.00 -0.50 0.00 0.00 54.79 53.13 1h0h n ASP 304 Cb 0.52 -0.14 0.46 0.00 -1.14 0.00 0.00 41.12 40.83 1h0h n ASP 304 CO 0.00 0.00 0.00 -0.08 -1.33 0.00 0.00 177.20 175.79 1h0h h GLU 305 N 0.00 0.38 -0.00 0.11 4.81 -2.00 -0.34 114.58 117.53 1h0h h GLU 305 Ca -0.06 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.13 1h0h h GLU 305 Cb 0.19 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.49 1h0h h GLU 305 CO 0.05 0.29 -0.04 0.09 -0.73 0.00 0.00 179.01 178.67 1h0h n ASN 306 N -4.45 0.20 0.00 1.04 3.02 -1.26 -4.90 115.26 108.91 1h0h n ASN 306 Ca 0.01 -0.46 0.00 0.00 -0.03 0.00 0.00 54.58 54.10 1h0h n ASN 306 Cb 0.10 -0.15 0.00 0.00 -0.61 0.00 0.00 39.78 39.12 1h0h n ASN 306 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1h0h n GLY 307 N 1.24 0.61 3.89 7.41 0.00 -0.14 -4.69 105.19 113.52 1h0h n GLY 307 Ca 0.16 -0.34 -0.35 0.00 0.00 0.00 0.00 46.02 45.49 1h0h n GLY 307 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1h0h s ASN 308 N -2.31 6.41 0.17 1.61 0.01 -1.26 -4.77 114.94 114.80 1h0h s ASN 308 Ca 0.00 0.44 -0.33 0.00 -0.71 0.00 0.00 52.86 52.26 1h0h s ASN 308 Cb 0.00 -2.05 -0.14 0.00 0.41 0.00 0.00 41.25 39.47 1h0h s ASN 308 CO 0.00 0.32 1.43 -2.65 -1.51 0.00 0.00 177.10 174.69 1h0h n PRO 309 N 1.39 1.82 -1.85 -0.60 -0.02 -1.26 -0.55 135.00 133.92 1h0h n PRO 309 Ca -0.14 0.65 -0.33 0.00 -2.02 0.00 0.00 63.50 61.66 1h0h n PRO 309 Cb 0.54 -2.33 0.04 0.00 -0.02 0.00 0.00 33.50 31.72 1h0h n PRO 309 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1h0h s LYS 310 N 0.26 2.97 -0.00 -0.52 1.02 0.19 -4.80 119.74 118.85 1h0h s LYS 310 Ca 0.76 1.35 0.01 0.00 0.02 0.00 0.00 55.97 58.10 1h0h s LYS 310 Cb -0.74 -1.98 -0.00 0.00 -0.52 0.00 0.00 37.83 34.59 1h0h s LYS 310 CO 0.45 -1.11 -0.02 1.03 -0.92 0.00 0.00 175.35 174.77 1h0h s ARG 311 N -4.06 0.18 -0.40 1.68 0.52 -1.26 -1.28 118.95 114.33 1h0h s ARG 311 Ca 0.66 -0.10 0.02 0.00 -0.52 0.00 0.00 55.73 55.80 1h0h s ARG 311 Cb -0.19 -0.16 0.11 0.00 0.52 0.00 0.00 34.95 35.23 1h0h s ARG 311 CO 0.40 0.04 0.13 0.34 0.02 0.00 0.00 175.30 176.23 1h0h s ASP 312 N -0.10 4.84 0.00 0.23 2.15 0.51 -4.96 116.67 119.33 1h0h s ASP 312 Ca 0.00 -2.29 0.17 0.00 0.43 0.00 0.00 52.55 50.86 1h0h s ASP 312 Cb -0.01 -1.69 0.75 0.00 -0.30 0.00 0.00 42.92 41.67 1h0h s ASP 312 CO -0.00 -0.40 1.54 -0.62 -0.17 0.00 0.00 175.17 175.52 1h0h n GLU 313 N 4.13 0.04 0.09 4.34 1.02 -1.26 -1.16 120.64 127.84 1h0h n GLU 313 Ca 0.03 0.19 0.13 0.00 -0.02 0.00 0.00 57.16 57.49 1h0h n GLU 313 Cb 0.40 -1.50 0.44 0.00 -0.02 0.00 0.00 31.44 30.76 1h0h n GLU 313 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1h0h n THR 314 N -1.47 0.54 -2.29 2.62 -2.24 -1.26 -4.93 114.28 105.26 1h0h n THR 314 Ca 0.05 -0.21 -0.18 0.00 -2.27 0.00 0.00 64.05 61.44 1h0h n THR 314 Cb 0.19 -0.62 -0.01 0.00 -2.10 0.00 0.00 70.33 67.79 1h0h n THR 314 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1h0h n LEU 315 N -2.16 -1.78 -0.04 3.22 4.77 -0.31 -4.90 117.00 115.82 1h0h n LEU 315 Ca 0.05 0.01 0.01 0.00 -0.03 0.00 0.00 56.01 56.05 1h0h n LEU 315 Cb 0.40 -2.57 -0.11 0.00 -2.33 0.00 0.00 43.42 38.81 1h0h n LEU 315 CO 0.29 -0.23 -0.80 0.29 -1.33 0.00 0.00 177.39 175.61 1h0h n LYS 316 N -2.69 1.11 -1.58 3.23 5.02 -1.26 -4.57 118.16 117.42 1h0h n LYS 316 Ca -0.21 -0.07 -0.47 0.00 -2.02 0.00 0.00 58.31 55.54 1h0h n LYS 316 Cb 0.66 -1.34 -0.03 0.00 -0.02 0.00 0.00 35.03 34.30 1h0h n LYS 316 CO 0.00 0.00 0.00 1.58 -0.52 0.00 0.00 177.40 178.46 1h0h n HIS 317 N -2.24 1.23 0.29 2.13 -0.00 -1.26 -4.83 115.22 110.55 1h0h n HIS 317 Ca -0.12 0.69 0.18 0.00 0.46 0.00 0.00 57.72 58.93 1h0h n HIS 317 Cb 0.64 -2.26 0.86 0.00 -0.12 0.00 0.00 29.99 29.11 1h0h n HIS 317 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 1h0h h PRO 318 N 2.75 0.00 -0.40 1.57 0.13 -1.99 -1.96 132.00 132.10 1h0h h PRO 318 Ca -0.41 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 1h0h h PRO 318 Cb 1.34 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.47 1h0h h PRO 318 CO 0.66 0.04 0.00 0.54 -0.23 0.00 0.00 178.00 179.00 1h0h n ARG 319 N -3.22 2.97 -2.53 0.86 1.74 -1.26 -4.46 116.66 110.76 1h0h n ARG 319 Ca -0.01 -2.35 -0.34 0.00 -0.77 0.00 0.00 57.85 54.38 1h0h n ARG 319 Cb 0.22 -1.47 -0.03 0.00 -1.02 0.00 0.00 32.46 30.15 1h0h n ARG 319 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1h0h h VAL 321 N 1.49 0.27 -0.66 0.00 2.07 -0.96 -0.67 116.25 117.79 1h0h h VAL 321 Ca -0.49 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.14 1h0h h VAL 321 Cb 1.22 0.27 -0.08 0.00 -1.52 0.00 0.00 31.29 31.17 1h0h h VAL 321 CO 0.59 0.00 0.24 0.15 0.02 0.00 0.00 177.57 178.57 1h0h h PHE 322 N -0.01 0.41 -0.05 1.57 3.57 -1.46 0.17 116.94 121.15 1h0h h PHE 322 Ca 0.34 0.03 -0.19 0.00 3.53 0.00 0.00 57.97 61.69 1h0h h PHE 322 Cb 0.53 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 39.18 1h0h h PHE 322 CO -0.58 0.08 -0.77 1.96 -2.23 0.00 0.00 178.31 176.77 1h0h h GLN 323 N 0.41 0.34 -0.81 1.11 1.08 -1.50 -1.13 115.11 114.60 1h0h h GLN 323 Ca 0.34 -0.30 -0.02 0.00 -1.45 0.00 0.00 58.65 57.22 1h0h h GLN 323 Cb 0.46 0.07 -0.04 0.00 -0.05 0.00 0.00 27.48 27.92 1h0h h GLN 323 CO -0.35 0.95 0.43 0.82 -0.95 0.00 0.00 178.83 179.73 1h0h h ILE 324 N 0.22 1.24 -0.38 2.54 2.04 -0.26 -1.63 117.51 121.29 1h0h h ILE 324 Ca -0.04 -0.63 -0.05 0.00 1.00 0.00 0.00 64.86 65.15 1h0h h ILE 324 Cb 1.35 0.18 -0.01 0.00 -0.74 0.00 0.00 36.82 37.60 1h0h h ILE 324 CO 0.13 0.28 0.06 0.24 0.00 0.00 0.00 178.15 178.85 1h0h h MET 325 N 1.13 0.63 -0.60 2.37 2.86 -0.51 -0.18 114.93 120.62 1h0h h MET 325 Ca 0.28 -0.17 0.09 0.00 -2.06 0.00 0.00 59.70 57.84 1h0h h MET 325 Cb 0.06 -0.07 -0.07 0.00 0.06 0.00 0.00 31.60 31.57 1h0h h MET 325 CO -0.04 0.69 0.22 0.87 1.06 0.00 0.00 176.91 179.71 1h0h h LYS 326 N 0.47 0.39 -0.08 1.72 1.57 -0.80 -1.74 116.57 118.11 1h0h h LYS 326 Ca 0.11 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.86 1h0h h LYS 326 Cb 0.37 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.59 1h0h h LYS 326 CO 0.01 0.26 0.00 -0.22 -0.57 0.00 0.00 179.45 178.93 1h0h h LYS 327 N 0.40 0.14 -0.85 3.15 1.63 -1.06 -3.17 116.57 116.81 1h0h h LYS 327 Ca 0.30 -0.04 0.05 0.00 -0.85 0.00 0.00 60.65 60.11 1h0h h LYS 327 Cb 0.37 -0.01 -0.06 0.00 -0.60 0.00 0.00 32.23 31.93 1h0h h LYS 327 CO -0.30 0.40 0.53 1.25 -3.45 0.00 0.00 179.45 177.88 1h0h h HIS 328 N -0.15 0.98 -0.00 1.91 2.76 -0.50 -2.81 115.15 117.34 1h0h h HIS 328 Ca 0.02 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.22 1h0h h HIS 328 Cb 0.34 -0.32 0.00 0.00 1.55 0.00 0.00 27.41 28.98 1h0h h HIS 328 CO 0.03 0.51 -0.18 0.66 -1.30 0.00 0.00 177.93 177.65 1h0h n TYR 329 N -4.61 0.00 0.19 5.26 4.01 -0.70 -4.13 117.16 117.18 1h0h n TYR 329 Ca 0.12 0.00 0.18 0.00 -0.16 0.00 0.00 57.90 58.04 1h0h n TYR 329 Cb 0.16 -0.25 0.82 0.00 -0.31 0.00 0.00 39.34 39.76 1h0h n TYR 329 CO 0.00 0.00 0.00 1.05 -0.46 0.00 0.00 176.86 177.45 1h0h h GLU 330 N 0.42 0.00 0.00 -0.72 4.11 -1.46 -2.27 114.58 114.65 1h0h h GLU 330 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1h0h h GLU 330 Cb 0.43 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.68 1h0h h GLU 330 CO 0.00 0.00 0.00 0.54 0.07 0.00 0.00 179.01 179.62 1h0h n ARG 331 N -3.73 0.18 -1.68 1.06 1.74 -1.26 -4.37 116.66 108.60 1h0h n ARG 331 Ca 0.02 0.22 -0.32 0.00 -0.77 0.00 0.00 57.85 57.00 1h0h n ARG 331 Cb 0.37 -1.74 -0.04 0.00 -1.02 0.00 0.00 32.46 30.03 1h0h n ARG 331 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1h0h n TYR 332 N -2.06 1.98 -1.99 -1.55 4.01 -0.85 -4.96 117.16 111.74 1h0h n TYR 332 Ca 0.05 -2.34 -0.33 0.00 -0.16 0.00 0.00 57.90 55.12 1h0h n TYR 332 Cb 0.36 -1.63 0.02 0.00 -0.31 0.00 0.00 39.34 37.78 1h0h n TYR 332 CO 0.00 0.00 0.00 0.16 -0.46 0.00 0.00 176.86 176.56 1h0h s ASP 333 N 0.50 5.62 0.23 7.72 1.47 -1.26 -4.43 116.67 126.52 1h0h s ASP 333 Ca 0.58 1.88 -0.06 0.00 1.18 0.00 0.00 52.55 56.12 1h0h s ASP 333 Cb 0.29 -2.54 0.37 0.00 -0.34 0.00 0.00 42.92 40.69 1h0h s ASP 333 CO -0.15 -1.28 1.77 -0.07 0.68 0.00 0.00 175.17 176.12 1h0h h LEU 334 N 0.38 0.43 -0.71 2.11 3.38 -1.94 -0.43 115.31 118.52 1h0h h LEU 334 Ca -0.47 0.07 0.04 0.00 0.09 0.00 0.00 57.88 57.61 1h0h h LEU 334 Cb 1.23 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.93 1h0h h LEU 334 CO 0.57 0.23 0.43 0.44 0.09 0.00 0.00 178.44 180.20 1h0h h ASP 335 N 0.57 0.69 -0.55 -0.43 3.32 -1.99 -0.25 116.42 117.78 1h0h h ASP 335 Ca 0.37 0.01 -0.05 0.00 0.02 0.00 0.00 57.03 57.38 1h0h h ASP 335 Cb 0.43 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 39.82 1h0h h ASP 335 CO -0.30 0.46 0.16 0.11 -1.72 0.00 0.00 179.24 177.96 1h0h h LYS 336 N 0.82 0.86 -0.45 3.56 1.57 -1.47 -1.43 116.57 120.03 1h0h h LYS 336 Ca 0.30 -0.19 -0.01 0.00 -1.87 0.00 0.00 60.65 58.87 1h0h h LYS 336 Cb 0.08 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.25 1h0h h LYS 336 CO -0.13 0.79 0.23 0.82 -0.57 0.00 0.00 179.45 180.59 1h0h h ILE 337 N 0.77 1.17 -0.56 1.86 1.08 -0.75 -1.32 117.51 119.76 1h0h h ILE 337 Ca 0.18 -0.46 0.02 0.00 -0.39 0.00 0.00 64.86 64.21 1h0h h ILE 337 Cb 0.30 0.65 -0.04 0.00 -3.07 0.00 0.00 36.82 34.67 1h0h h ILE 337 CO -0.00 0.18 0.34 -1.28 -0.69 0.00 0.00 178.15 176.70 1h0h h SER 338 N 0.58 0.56 -0.69 1.72 0.87 -0.87 0.60 113.55 116.32 1h0h h SER 338 Ca 0.16 0.00 -0.06 0.00 -1.23 0.00 0.00 61.79 60.66 1h0h h SER 338 Cb 0.08 -0.12 -0.03 0.00 -0.44 0.00 0.00 62.40 61.89 1h0h h SER 338 CO -0.02 0.39 0.22 0.00 -0.53 0.00 0.00 176.83 176.89 1h0h h ALA 339 N 1.24 1.06 0.12 6.23 0.00 -0.91 -0.42 119.26 126.58 1h0h h ALA 339 Ca 0.22 -0.22 -0.32 0.00 0.00 0.00 0.00 54.91 54.60 1h0h h ALA 339 Cb 0.01 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 1h0h h ALA 339 CO -0.09 0.64 -1.61 0.97 0.00 0.00 0.00 179.25 179.16 1h0h h ILE 340 N 1.04 1.06 0.00 0.00 6.09 -1.00 -3.36 117.51 121.35 1h0h h ILE 340 Ca 0.23 -2.72 -0.07 0.00 -1.37 0.00 0.00 64.86 60.93 1h0h h ILE 340 Cb 0.30 2.71 -0.01 0.00 0.47 0.00 0.00 36.82 40.29 1h0h h ILE 340 CO -0.01 0.81 -0.88 0.00 -3.07 0.00 0.00 178.15 175.00 1h0h n GLY 342 N 1.24 2.38 3.72 0.00 0.00 -0.17 -0.68 105.19 111.69 1h0h n GLY 342 Ca -0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 1h0h n GLY 342 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1h0h s THR 343 N -2.25 3.45 0.17 2.61 2.01 -1.24 -4.89 115.64 115.52 1h0h s THR 343 Ca 0.00 1.06 -0.33 0.00 0.31 0.00 0.00 61.69 62.72 1h0h s THR 343 Cb 0.00 -3.68 -0.14 0.00 0.01 0.00 0.00 72.50 68.69 1h0h s THR 343 CO 0.00 0.09 1.46 -2.65 -0.69 0.00 0.00 174.62 172.83 1h0h n PRO 344 N 3.79 1.90 -0.31 4.92 -0.02 -1.26 -4.40 135.00 139.62 1h0h n PRO 344 Ca 0.10 0.68 0.12 0.00 -2.02 0.00 0.00 63.50 62.39 1h0h n PRO 344 Cb 0.43 -2.38 0.30 0.00 -0.02 0.00 0.00 33.50 31.83 1h0h n PRO 344 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 1h0h h LYS 345 N 5.03 0.50 -0.64 -0.52 3.64 -1.92 -0.38 116.57 122.27 1h0h h LYS 345 Ca -0.45 -0.03 0.01 0.00 -1.27 0.00 0.00 60.65 58.90 1h0h h LYS 345 Cb 1.28 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 32.95 1h0h h LYS 345 CO 0.82 0.33 0.42 1.49 -2.27 0.00 0.00 179.45 180.24 1h0h h GLU 346 N 0.51 0.85 -0.08 1.90 4.22 -1.99 -0.30 114.58 119.69 1h0h h GLU 346 Ca 0.55 -0.05 -0.11 0.00 0.08 0.00 0.00 59.36 59.83 1h0h h GLU 346 Cb 0.98 -0.19 0.01 0.00 0.50 0.00 0.00 28.75 30.04 1h0h h GLU 346 CO -0.47 0.57 -0.39 1.25 -2.18 0.00 0.00 179.01 177.79 1h0h h LEU 347 N 0.87 0.47 -0.46 1.64 5.85 -1.47 -1.57 115.31 120.65 1h0h h LEU 347 Ca 0.24 -0.65 0.05 0.00 0.84 0.00 0.00 57.88 58.35 1h0h h LEU 347 Cb -0.09 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 40.75 1h0h h LEU 347 CO -0.05 1.05 0.21 0.40 -0.34 0.00 0.00 178.44 179.71 1h0h h ILE 348 N -0.07 0.92 -0.86 4.05 2.04 -0.86 -1.17 117.51 121.57 1h0h h ILE 348 Ca -0.03 -0.14 0.02 0.00 1.00 0.00 0.00 64.86 65.71 1h0h h ILE 348 Cb 1.04 0.47 -0.05 0.00 -0.74 0.00 0.00 36.82 37.54 1h0h h ILE 348 CO 0.08 0.08 0.56 0.25 0.00 0.00 0.00 178.15 179.12 1h0h h LEU 349 N 0.42 0.95 -0.66 1.44 5.85 -1.03 0.66 115.31 122.93 1h0h h LEU 349 Ca 0.21 -0.02 0.06 0.00 0.84 0.00 0.00 57.88 58.97 1h0h h LEU 349 Cb 0.15 -0.23 -0.06 0.00 0.37 0.00 0.00 40.66 40.90 1h0h h LEU 349 CO -0.17 0.67 0.37 0.11 -0.34 0.00 0.00 178.44 179.08 1h0h h LYS 350 N 1.12 0.66 -0.14 1.25 1.57 -0.21 0.43 116.57 121.25 1h0h h LYS 350 Ca 0.33 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 59.05 1h0h h LYS 350 Cb -0.07 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.09 1h0h h LYS 350 CO -0.09 0.44 0.03 0.28 -0.57 0.00 0.00 179.45 179.53 1h0h h VAL 351 N 0.68 1.21 -0.31 0.50 2.07 -0.25 -1.75 116.25 118.40 1h0h h VAL 351 Ca 0.30 -0.66 0.02 0.00 0.82 0.00 0.00 66.70 67.18 1h0h h VAL 351 Cb 0.19 1.38 -0.03 0.00 -1.52 0.00 0.00 31.29 31.32 1h0h h VAL 351 CO -0.18 0.20 0.15 1.88 0.02 0.00 0.00 177.57 179.63 1h0h h TYR 352 N 0.02 0.27 -0.45 1.57 -1.99 -0.49 0.63 116.97 116.52 1h0h h TYR 352 Ca 0.04 0.01 -0.03 0.00 2.00 0.00 0.00 58.73 60.75 1h0h h TYR 352 Cb 0.28 -0.08 -0.02 0.00 2.00 0.00 0.00 36.73 38.91 1h0h h TYR 352 CO 0.01 0.15 0.15 -0.44 -0.00 0.00 0.00 178.16 178.02 1h0h h ASP 353 N 0.31 0.65 0.08 3.88 3.32 -0.87 0.11 116.42 123.91 1h0h h ASP 353 Ca 0.13 -0.20 -0.00 0.00 0.02 0.00 0.00 57.03 56.98 1h0h h ASP 353 Cb 0.05 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.44 1h0h h ASP 353 CO -0.10 0.68 -0.04 0.00 -1.72 0.00 0.00 179.24 178.06 1h0h h ALA 354 N 1.00 -0.11 -0.37 3.45 0.00 -1.14 -2.84 119.26 119.25 1h0h h ALA 354 Ca 0.15 -0.09 -0.08 0.00 0.00 0.00 0.00 54.91 54.88 1h0h h ALA 354 Cb 0.26 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1h0h h ALA 354 CO -0.01 -0.49 -0.09 -0.92 0.00 0.00 0.00 179.25 177.74 1h0h h TYR 355 N -0.26 0.80 0.00 0.00 3.20 -0.72 -3.06 116.97 116.93 1h0h h TYR 355 Ca -0.01 -0.17 0.00 0.00 3.14 0.00 0.00 58.73 61.69 1h0h h TYR 355 Cb 0.22 -0.19 0.00 0.00 1.54 0.00 0.00 36.73 38.29 1h0h h TYR 355 CO -0.02 0.86 0.00 0.00 -1.64 0.00 0.00 178.16 177.36 1h0h n ALA 357 N -1.75 1.29 1.99 0.00 0.00 -1.07 -1.84 120.51 119.12 1h0h n ALA 357 Ca 0.03 0.09 0.15 0.00 0.00 0.00 0.00 53.44 53.71 1h0h n ALA 357 Cb 0.27 -1.26 0.86 0.00 0.00 0.00 0.00 19.45 19.33 1h0h n ALA 357 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1h0h n THR 358 N -1.98 0.00 0.25 0.00 -2.24 -0.70 -3.58 114.28 106.03 1h0h n THR 358 Ca 0.01 -0.01 0.06 0.00 -2.27 0.00 0.00 64.05 61.83 1h0h n THR 358 Cb 0.10 -0.43 0.26 0.00 -2.10 0.00 0.00 70.33 68.15 1h0h n THR 358 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1h0h n GLY 359 N 0.96 -0.83 3.77 3.38 0.00 -0.77 -4.28 105.19 107.42 1h0h n GLY 359 Ca 0.22 0.02 -0.40 0.00 0.00 0.00 0.00 46.02 45.86 1h0h n GLY 359 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1h0h s LYS 360 N -3.12 4.15 0.45 1.61 1.02 -1.23 -4.16 119.74 118.45 1h0h s LYS 360 Ca 0.03 2.19 0.20 0.00 0.02 0.00 0.00 55.97 58.40 1h0h s LYS 360 Cb 0.05 -2.90 1.16 0.00 -0.52 0.00 0.00 37.83 35.63 1h0h s LYS 360 CO 0.17 -0.35 1.89 -1.35 -0.92 0.00 0.00 175.35 174.79 1h0h h PRO 361 N 3.00 0.30 -0.54 -1.68 0.11 -1.88 -1.51 132.00 129.81 1h0h h PRO 361 Ca -0.49 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1h0h h PRO 361 Cb 1.24 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1h0h h PRO 361 CO 0.64 0.20 0.00 -0.40 -0.21 0.00 0.00 178.00 178.23 1h0h n ASP 362 N -4.45 4.51 -4.61 -2.05 5.75 -1.24 -4.11 116.55 110.33 1h0h n ASP 362 Ca 0.17 -2.54 -0.24 0.00 -0.01 0.00 0.00 54.79 52.17 1h0h n ASP 362 Cb 0.69 -0.54 -0.08 0.00 -1.03 0.00 0.00 41.12 40.16 1h0h n ASP 362 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 1h0h s LYS 363 N -2.01 2.19 -0.04 0.11 -0.14 -0.57 -4.91 119.74 114.38 1h0h s LYS 363 Ca 0.47 -1.37 -0.01 0.00 -1.36 0.00 0.00 55.97 53.69 1h0h s LYS 363 Cb 0.32 -2.15 0.03 0.00 -1.68 0.00 0.00 37.83 34.35 1h0h s LYS 363 CO 0.20 0.39 0.08 0.00 -0.76 0.00 0.00 175.35 175.26 1h0h s ALA 364 N -2.11 -0.09 0.03 5.17 0.00 -1.26 -4.73 121.76 118.78 1h0h s ALA 364 Ca 0.29 0.43 0.07 0.00 0.00 0.00 0.00 51.96 52.75 1h0h s ALA 364 Cb -0.07 -0.30 -0.03 0.00 0.00 0.00 0.00 23.12 22.71 1h0h s ALA 364 CO 0.18 -0.12 -0.18 0.20 0.00 0.00 0.00 175.76 175.85 1h0h s GLY 365 N 0.95 1.56 0.13 0.00 0.00 -1.26 -0.37 107.32 108.34 1h0h s GLY 365 Ca -0.08 -1.17 0.10 0.00 0.00 0.00 0.00 44.72 43.58 1h0h s GLY 365 CO -0.04 -1.04 -0.25 -1.08 0.00 0.00 0.00 173.10 170.69 1h0h s THR 366 N -0.89 2.11 -0.15 0.90 -1.32 -0.33 -3.97 115.64 111.99 1h0h s THR 366 Ca 0.14 -1.75 -0.01 0.00 -1.21 0.00 0.00 61.69 58.86 1h0h s THR 366 Cb -0.10 -1.90 -0.02 0.00 -1.51 0.00 0.00 72.50 68.97 1h0h s THR 366 CO 0.05 0.01 -0.10 -0.51 -2.21 0.00 0.00 174.62 171.85 1h0h s ILE 367 N -1.21 3.22 -0.24 5.08 1.10 -1.19 -0.71 121.20 127.26 1h0h s ILE 367 Ca 0.13 -0.59 -0.05 0.00 -0.51 0.00 0.00 60.65 59.63 1h0h s ILE 367 Cb -0.10 -2.38 -0.01 0.00 0.15 0.00 0.00 42.46 40.13 1h0h s ILE 367 CO 0.06 0.51 -0.00 -0.04 -2.11 0.00 0.00 174.94 173.35 1h0h s MET 368 N 0.50 3.40 -0.00 3.50 -1.94 0.95 -1.33 119.30 124.37 1h0h s MET 368 Ca -0.08 -0.62 -0.05 0.00 -1.71 0.00 0.00 55.69 53.23 1h0h s MET 368 Cb -0.15 -3.12 -0.00 0.00 2.01 0.00 0.00 34.83 33.57 1h0h s MET 368 CO 0.04 -0.23 0.10 -0.47 -0.01 0.00 0.00 175.02 174.45 1h0h s TYR 369 N 1.51 0.06 0.00 -0.03 5.04 -1.08 -1.68 117.35 121.17 1h0h s TYR 369 Ca 0.05 -0.15 0.00 0.00 -2.44 0.00 0.00 57.07 54.53 1h0h s TYR 369 Cb -0.15 -0.06 0.00 0.00 0.35 0.00 0.00 41.96 42.10 1h0h s TYR 369 CO -0.01 -0.23 0.00 0.00 -1.34 0.00 0.00 175.55 173.97 1h0h n ALA 370 N 1.72 1.59 -3.65 3.97 0.00 -0.75 -1.09 120.51 122.28 1h0h n ALA 370 Ca -0.21 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 52.89 1h0h n ALA 370 Cb 0.56 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.93 1h0h n ALA 370 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 1h0h n MET 371 N -0.59 2.53 0.00 0.00 0.00 -1.25 -4.77 117.12 113.04 1h0h n MET 371 Ca 0.00 -4.51 0.00 0.00 -0.00 0.00 0.00 57.70 53.19 1h0h n MET 371 Cb 0.00 -2.37 0.00 0.00 0.00 0.00 0.00 33.22 30.85 1h0h n MET 371 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1h0h n GLY 372 N 2.02 -2.79 3.77 -5.12 0.00 -1.26 -4.88 105.19 96.93 1h0h n GLY 372 Ca 0.22 -0.91 -0.39 0.00 0.00 0.00 0.00 46.02 44.95 1h0h n GLY 372 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1h0h s TRP 373 N 0.00 3.23 -0.51 1.61 0.52 -1.26 -4.93 118.94 117.60 1h0h s TRP 373 Ca 0.00 1.59 0.24 0.00 0.02 0.00 0.00 56.10 57.95 1h0h s TRP 373 Cb 0.00 -3.35 0.42 0.00 -1.15 0.00 0.00 33.47 29.39 1h0h s TRP 373 CO 0.00 -1.06 1.54 1.79 0.02 0.00 0.00 176.95 179.25 1h0h h THR 374 N 2.57 0.00 -2.76 2.01 1.35 -1.85 -3.38 112.91 110.84 1h0h h THR 374 Ca -0.48 -0.81 -0.56 0.00 -0.55 0.00 0.00 66.41 64.01 1h0h h THR 374 Cb 1.22 1.70 -0.02 0.00 -1.73 0.00 0.00 68.15 69.32 1h0h h THR 374 CO 0.64 0.00 1.07 -1.10 -0.25 0.00 0.00 175.52 175.88 1h0h s GLN 375 N -3.20 3.97 0.55 4.72 -0.21 -1.26 -4.89 119.66 119.34 1h0h s GLN 375 Ca 0.07 1.79 0.22 0.00 0.02 0.00 0.00 55.36 57.46 1h0h s GLN 375 Cb 0.08 -3.97 1.49 0.00 1.00 0.00 0.00 33.01 31.61 1h0h s GLN 375 CO 0.67 -1.07 2.17 0.45 -2.12 0.00 0.00 175.29 175.39 1h0h h HIS 376 N 9.94 0.00 0.00 0.91 3.86 -1.98 -0.08 115.15 127.80 1h0h h HIS 376 Ca -0.34 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.87 1h0h h HIS 376 Cb 1.15 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.62 1h0h h HIS 376 CO 0.88 0.00 0.00 0.25 0.86 0.00 0.00 177.93 179.92 1h0h n THR 377 N -4.25 0.38 -0.01 2.45 -2.24 -1.26 -2.22 114.28 107.14 1h0h n THR 377 Ca -0.02 0.10 -0.02 0.00 -2.27 0.00 0.00 64.05 61.84 1h0h n THR 377 Cb 0.15 -0.86 -0.01 0.00 -2.10 0.00 0.00 70.33 67.51 1h0h n THR 377 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1h0h n VAL 378 N -1.18 0.19 -0.08 2.28 0.31 -0.28 -4.86 118.33 114.70 1h0h n VAL 378 Ca 0.08 -0.00 -0.11 0.00 -0.01 0.00 0.00 64.34 64.30 1h0h n VAL 378 Cb 0.09 -1.54 -0.04 0.00 -0.91 0.00 0.00 33.84 31.45 1h0h n VAL 378 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 1h0h h GLY 379 N -0.08 0.44 0.52 2.92 0.00 -0.99 -3.11 103.07 102.77 1h0h h GLY 379 Ca -0.05 -0.30 0.04 0.00 0.00 0.00 0.00 47.33 47.02 1h0h h GLY 379 CO -0.03 0.28 -0.13 -2.08 0.00 0.00 0.00 176.54 174.58 1h0h h VAL 380 N 0.21 0.64 0.00 4.60 2.07 -1.67 -2.22 116.25 119.88 1h0h h VAL 380 Ca 0.07 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.53 1h0h h VAL 380 Cb 0.34 0.64 -0.01 0.00 -1.52 0.00 0.00 31.29 30.74 1h0h h VAL 380 CO 0.01 0.00 -0.28 1.56 0.02 0.00 0.00 177.57 178.87 1h0h h GLN 381 N -0.16 0.00 -0.15 1.57 1.08 -1.77 -0.92 115.11 114.76 1h0h h GLN 381 Ca 0.09 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.28 1h0h h GLN 381 Cb 0.29 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.71 1h0h h GLN 381 CO -0.22 0.28 0.06 -0.91 -0.95 0.00 0.00 178.83 177.09 1h0h h ASN 382 N 0.00 0.20 -0.14 1.46 2.35 -1.41 -0.20 115.58 117.84 1h0h h ASN 382 Ca -0.00 -0.16 -0.08 0.00 -0.55 0.00 0.00 56.30 55.51 1h0h h ASN 382 Cb 0.75 -0.05 -0.02 0.00 0.05 0.00 0.00 38.32 39.05 1h0h h ASN 382 CO 0.04 0.30 -0.16 0.40 -1.65 0.00 0.00 177.43 176.36 1h0h h ILE 383 N 0.09 1.24 -0.29 2.81 2.04 -1.06 -1.87 117.51 120.47 1h0h h ILE 383 Ca 0.05 -1.10 -0.01 0.00 1.00 0.00 0.00 64.86 64.80 1h0h h ILE 383 Cb 0.16 1.19 -0.01 0.00 -0.74 0.00 0.00 36.82 37.42 1h0h h ILE 383 CO -0.00 0.36 0.14 0.03 0.00 0.00 0.00 178.15 178.67 1h0h h ARG 384 N 0.48 0.42 -0.44 2.37 2.47 -1.00 -0.40 114.38 118.27 1h0h h ARG 384 Ca 0.08 -0.06 0.07 0.00 -1.26 0.00 0.00 59.98 58.81 1h0h h ARG 384 Cb 0.55 -0.08 -0.06 0.00 -1.65 0.00 0.00 29.97 28.73 1h0h h ARG 384 CO 0.04 0.40 0.07 0.00 0.56 0.00 0.00 179.97 181.03 1h0h h ALA 385 N 1.00 0.46 -0.50 0.04 0.00 -0.66 0.13 119.26 119.72 1h0h h ALA 385 Ca 0.10 0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 1h0h h ALA 385 Cb 0.12 0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 1h0h h ALA 385 CO -0.01 -0.33 0.24 0.52 0.00 0.00 0.00 179.25 179.67 1h0h h MET 386 N 0.19 0.73 -0.38 0.00 2.86 -1.16 -1.96 114.93 115.21 1h0h h MET 386 Ca 0.21 -0.11 -0.03 0.00 -2.06 0.00 0.00 59.70 57.71 1h0h h MET 386 Cb 0.28 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 31.79 1h0h h MET 386 CO -0.30 0.60 0.09 0.66 1.06 0.00 0.00 176.91 179.02 1h0h h SER 387 N 0.67 0.51 -0.09 1.22 4.64 -0.32 -1.56 113.55 118.62 1h0h h SER 387 Ca 0.17 -0.07 -0.02 0.00 -0.47 0.00 0.00 61.79 61.40 1h0h h SER 387 Cb 0.12 -0.13 -0.00 0.00 -0.31 0.00 0.00 62.40 62.07 1h0h h SER 387 CO -0.02 0.52 -0.03 0.40 -0.87 0.00 0.00 176.83 176.82 1h0h h ILE 388 N 0.54 1.31 -0.67 0.95 2.04 -0.49 -2.21 117.51 118.98 1h0h h ILE 388 Ca 0.13 -1.00 0.00 0.00 1.00 0.00 0.00 64.86 64.99 1h0h h ILE 388 Cb 0.22 1.80 -0.03 0.00 -0.74 0.00 0.00 36.82 38.06 1h0h h ILE 388 CO -0.00 0.28 0.43 0.78 0.00 0.00 0.00 178.15 179.64 1h0h h ASN 389 N -0.18 0.78 0.00 1.72 2.35 -1.09 -0.23 115.58 118.94 1h0h h ASN 389 Ca 0.02 -0.03 -0.10 0.00 -0.55 0.00 0.00 56.30 55.64 1h0h h ASN 389 Cb 0.46 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.62 1h0h h ASN 389 CO 0.01 0.58 -0.30 1.56 -1.65 0.00 0.00 177.43 177.63 1h0h h GLN 390 N 0.92 0.44 -0.19 0.81 1.08 -1.21 -1.97 115.11 114.98 1h0h h GLN 390 Ca 0.25 -0.18 -0.19 0.00 -1.45 0.00 0.00 58.65 57.08 1h0h h GLN 390 Cb -0.08 -0.02 0.01 0.00 -0.05 0.00 0.00 27.48 27.34 1h0h h GLN 390 CO -0.05 0.70 -0.61 -0.07 -0.95 0.00 0.00 178.83 177.85 1h0h h LEU 391 N 0.38 0.87 -1.38 1.46 3.38 -0.66 0.12 115.31 119.48 1h0h h LEU 391 Ca 0.05 -0.59 0.04 0.00 0.09 0.00 0.00 57.88 57.47 1h0h h LEU 391 Cb 0.72 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 41.18 1h0h h LEU 391 CO 0.06 1.31 0.45 -0.07 0.09 0.00 0.00 178.44 180.27 1h0h h LEU 392 N 0.48 0.69 -1.12 1.67 3.38 -0.85 -2.29 115.31 117.26 1h0h h LEU 392 Ca -0.02 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1h0h h LEU 392 Cb 1.23 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.82 1h0h h LEU 392 CO 0.13 0.47 0.00 0.18 0.09 0.00 0.00 178.44 179.31 1h0h n LEU 393 N -4.46 1.65 -3.42 1.67 4.77 -0.76 -0.45 117.00 116.00 1h0h n LEU 393 Ca 0.08 -0.79 -0.25 0.00 -0.03 0.00 0.00 56.01 55.03 1h0h n LEU 393 Cb 0.14 -0.18 0.05 0.00 -2.33 0.00 0.00 43.42 41.09 1h0h n LEU 393 CO 0.35 0.40 0.10 0.61 -1.33 0.00 0.00 177.39 177.52 1h0h n GLY 394 N 1.03 -0.53 0.78 -0.72 0.00 -0.86 -4.18 105.19 100.71 1h0h n GLY 394 Ca 0.12 0.19 0.12 0.00 0.00 0.00 0.00 46.02 46.45 1h0h n GLY 394 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1h0h n ASN 395 N -2.73 2.53 -4.74 1.61 3.02 0.02 -4.82 115.26 110.13 1h0h n ASN 395 Ca -0.03 -1.80 -0.36 0.00 -0.03 0.00 0.00 54.58 52.36 1h0h n ASN 395 Cb 0.57 0.07 -0.07 0.00 -0.61 0.00 0.00 39.78 39.75 1h0h n ASN 395 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1h0h s ILE 396 N -2.09 5.33 0.00 2.41 -1.09 -1.25 -0.23 121.20 124.29 1h0h s ILE 396 Ca 0.28 0.45 0.00 0.00 -2.23 0.00 0.00 60.65 59.16 1h0h s ILE 396 Cb 0.20 -3.58 0.00 0.00 -1.58 0.00 0.00 42.46 37.50 1h0h s ILE 396 CO 0.35 0.42 0.00 0.61 -1.23 0.00 0.00 174.94 175.10 1h0h n GLY 397 N 3.25 0.90 3.82 6.18 0.00 -1.26 -4.50 105.19 113.59 1h0h n GLY 397 Ca -0.13 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.64 1h0h n GLY 397 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1h0h s VAL 398 N -2.55 4.56 0.14 1.61 -7.23 -1.26 -4.27 120.40 111.40 1h0h s VAL 398 Ca 0.00 -1.14 -0.31 0.00 -1.81 0.00 0.00 61.98 58.72 1h0h s VAL 398 Cb 0.00 -3.37 -0.09 0.00 0.56 0.00 0.00 36.38 33.48 1h0h s VAL 398 CO 0.00 -0.18 1.57 0.00 -0.31 0.00 0.00 175.10 176.18 1h0h s ALA 399 N -1.86 3.74 0.00 1.32 0.00 -1.26 -1.57 121.76 122.13 1h0h s ALA 399 Ca 0.32 1.31 0.00 0.00 0.00 0.00 0.00 51.96 53.59 1h0h s ALA 399 Cb -0.09 -3.63 0.00 0.00 0.00 0.00 0.00 23.12 19.40 1h0h s ALA 399 CO 0.24 -0.83 0.00 0.41 0.00 0.00 0.00 175.76 175.59 1h0h n GLY 400 N 3.78 0.77 0.00 0.00 0.00 -1.24 -4.71 105.19 103.80 1h0h n GLY 400 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 1h0h n GLY 400 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h0h n GLY 401 N -2.44 2.79 0.00 -0.02 0.00 -0.61 -3.52 105.19 101.40 1h0h n GLY 401 Ca 0.00 -1.77 0.00 0.00 0.00 0.00 0.00 46.02 44.25 1h0h n GLY 401 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h0h n GLY 402 N 5.00 0.08 3.28 -0.02 0.00 0.68 -4.57 105.19 109.65 1h0h n GLY 402 Ca 0.00 -1.80 -0.42 0.00 0.00 0.00 0.00 46.02 43.80 1h0h n GLY 402 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1h0h s VAL 403 N -2.06 4.50 -1.23 1.61 1.01 -1.26 -3.19 120.40 119.77 1h0h s VAL 403 Ca 0.00 -1.43 -0.14 0.00 0.00 0.00 0.00 61.98 60.41 1h0h s VAL 403 Cb 0.00 -3.79 0.16 0.00 0.00 0.00 0.00 36.38 32.74 1h0h s VAL 403 CO 0.00 -0.61 1.50 0.59 0.00 0.00 0.00 175.10 176.58 1h0h n ASN 404 N 5.00 5.17 -4.55 3.32 3.02 -0.44 -2.11 115.26 124.67 1h0h n ASN 404 Ca -0.10 -2.97 -0.41 0.00 -0.03 0.00 0.00 54.58 51.06 1h0h n ASN 404 Cb 0.42 -1.59 -0.03 0.00 -0.61 0.00 0.00 39.78 37.97 1h0h n ASN 404 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1h0h s ALA 405 N 1.90 2.72 0.05 5.41 0.00 -1.26 -2.64 121.76 127.95 1h0h s ALA 405 Ca 0.44 -1.56 -0.31 0.00 0.00 0.00 0.00 51.96 50.54 1h0h s ALA 405 Cb -0.01 -4.33 -0.07 0.00 0.00 0.00 0.00 23.12 18.71 1h0h s ALA 405 CO 0.01 -3.39 1.54 -0.51 0.00 0.00 0.00 175.76 173.42 1h0h s LEU 406 N 5.67 4.35 0.67 0.00 1.43 -0.25 -4.33 118.68 126.21 1h0h s LEU 406 Ca 0.38 2.35 -0.14 0.00 -1.03 0.00 0.00 54.13 55.69 1h0h s LEU 406 Cb -0.06 -3.56 0.00 0.00 0.03 0.00 0.00 46.19 42.60 1h0h s LEU 406 CO 0.09 -0.81 1.10 -0.13 0.23 0.00 0.00 176.35 176.83 1h0h s ARG 407 N 2.41 2.78 0.00 1.70 3.00 -1.26 -4.61 118.95 122.97 1h0h s ARG 407 Ca 0.70 1.34 0.00 0.00 0.00 0.00 0.00 55.73 57.76 1h0h s ARG 407 Cb -0.37 -1.95 0.00 0.00 0.00 0.00 0.00 34.95 32.63 1h0h s ARG 407 CO 0.30 -1.26 0.00 0.41 0.00 0.00 0.00 175.30 174.75 1h0h n GLY 408 N -0.68 1.71 3.81 -3.53 0.00 -1.26 -4.30 105.19 100.94 1h0h n GLY 408 Ca 0.10 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.81 1h0h n GLY 408 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1h0h s GLU 409 N 0.00 2.94 0.50 1.61 2.02 -1.26 -1.93 118.70 122.57 1h0h s GLU 409 Ca 0.00 1.06 0.25 0.00 0.02 0.00 0.00 54.97 56.30 1h0h s GLU 409 Cb 0.00 -1.99 1.33 0.00 0.10 0.00 0.00 34.13 33.57 1h0h s GLU 409 CO 0.00 -1.10 1.90 0.00 0.02 0.00 0.00 175.26 176.09 1h0h h ALA 410 N -0.46 2.55 0.00 5.21 0.00 -0.93 -2.59 119.26 123.04 1h0h h ALA 410 Ca -0.45 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.41 1h0h h ALA 410 Cb 1.22 0.03 -0.10 0.00 0.00 0.00 0.00 17.79 18.94 1h0h h ALA 410 CO 0.56 -0.79 -0.51 -1.71 0.00 0.00 0.00 179.25 176.80 1h0h n ASN 411 N -4.37 1.26 0.27 0.00 5.15 -1.21 -4.02 115.26 112.32 1h0h n ASN 411 Ca 0.17 -2.74 0.12 0.00 -0.60 0.00 0.00 54.58 51.52 1h0h n ASN 411 Cb 0.79 -0.36 0.74 0.00 -0.53 0.00 0.00 39.78 40.41 1h0h n ASN 411 CO 0.00 0.00 0.00 1.62 1.40 0.00 0.00 177.26 180.28 1h0h h VAL 412 N 3.77 0.71 -0.20 3.44 3.04 -1.59 0.07 116.25 125.50 1h0h h VAL 412 Ca -0.06 -0.33 -0.01 0.00 -1.01 0.00 0.00 66.70 65.29 1h0h h VAL 412 Cb 1.33 1.20 -0.01 0.00 -2.01 0.00 0.00 31.29 31.80 1h0h h VAL 412 CO 0.03 0.08 0.08 -0.61 -1.01 0.00 0.00 177.57 176.14 1h0h h GLN 413 N 0.00 0.29 -0.41 4.17 5.75 -1.80 -1.77 115.11 121.34 1h0h h GLN 413 Ca -0.00 -0.05 -0.10 0.00 -0.15 0.00 0.00 58.65 58.35 1h0h h GLN 413 Cb 0.19 -0.05 -0.01 0.00 1.07 0.00 0.00 27.48 28.68 1h0h h GLN 413 CO 0.01 0.36 -0.13 0.78 -2.65 0.00 0.00 178.83 177.20 1h0h h GLY 414 N 0.16 0.89 1.67 2.39 0.00 -1.48 0.18 103.07 106.87 1h0h h GLY 414 Ca 0.07 -0.75 -0.03 0.00 0.00 0.00 0.00 47.33 46.61 1h0h h GLY 414 CO -0.01 0.69 0.05 1.48 0.00 0.00 0.00 176.54 178.75 1h0h h SER 415 N 0.64 0.39 -0.03 0.19 4.64 -0.98 0.48 113.55 118.88 1h0h h SER 415 Ca 0.10 -0.05 -0.09 0.00 -0.47 0.00 0.00 61.79 61.29 1h0h h SER 415 Cb 0.67 -0.10 0.01 0.00 -0.31 0.00 0.00 62.40 62.67 1h0h h SER 415 CO 0.05 0.41 -0.32 0.74 -0.87 0.00 0.00 176.83 176.84 1h0h h THR 416 N 0.42 1.48 -0.24 2.95 2.02 -1.12 -2.44 112.91 115.97 1h0h h THR 416 Ca 0.10 -1.85 0.07 0.00 0.77 0.00 0.00 66.41 65.50 1h0h h THR 416 Cb 0.20 2.55 -0.01 0.00 -1.74 0.00 0.00 68.15 69.15 1h0h h THR 416 CO -0.00 0.52 0.18 0.44 0.37 0.00 0.00 175.52 177.03 1h0h h ASP 417 N -0.31 0.00 -0.56 4.18 3.32 0.05 -1.13 116.42 121.98 1h0h h ASP 417 Ca -0.03 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.92 1h0h h ASP 417 Cb 1.02 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 40.51 1h0h h ASP 417 CO 0.06 0.00 0.13 1.41 -1.72 0.00 0.00 179.24 179.12 1h0h n HIS 418 N -4.34 1.93 -3.18 4.55 8.25 0.16 -1.26 115.22 121.33 1h0h n HIS 418 Ca 0.03 -0.84 -0.23 0.00 -0.26 0.00 0.00 57.72 56.42 1h0h n HIS 418 Cb 0.33 -0.54 0.05 0.00 1.12 0.00 0.00 29.99 30.96 1h0h n HIS 418 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1h0h n GLY 419 N 0.19 -0.51 1.69 -1.41 0.00 -0.43 -4.21 105.19 100.52 1h0h n GLY 419 Ca 0.29 0.16 -0.07 0.00 0.00 0.00 0.00 46.02 46.39 1h0h n GLY 419 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1h0h n LEU 420 N -4.28 5.80 -4.12 0.99 4.77 -0.93 -4.60 117.00 114.64 1h0h n LEU 420 Ca -0.07 -2.81 -0.14 0.00 -0.03 0.00 0.00 56.01 52.95 1h0h n LEU 420 Cb 0.60 -1.12 -0.11 0.00 -2.33 0.00 0.00 43.42 40.46 1h0h n LEU 420 CO 0.52 1.13 -0.41 -0.76 -1.33 0.00 0.00 177.39 176.54 1h0h s LEU 421 N -0.74 2.32 0.43 2.23 1.43 -1.19 -2.65 118.68 120.51 1h0h s LEU 421 Ca 0.16 -0.67 0.21 0.00 -1.03 0.00 0.00 54.13 52.79 1h0h s LEU 421 Cb 0.11 -0.25 0.98 0.00 0.03 0.00 0.00 46.19 47.06 1h0h s LEU 421 CO -0.01 -0.22 1.88 0.00 0.23 0.00 0.00 176.35 178.23 1h0h h MET 422 N 4.09 0.00 -0.00 1.70 -0.00 -1.33 -3.08 114.93 116.31 1h0h h MET 422 Ca -0.37 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.33 1h0h h MET 422 Cb 1.19 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.79 1h0h h MET 422 CO 0.46 0.27 -0.66 -2.39 -0.00 0.00 0.00 176.91 174.59 1h0h n HIS 423 N -3.68 0.00 -4.12 -0.10 1.44 -1.26 -4.73 115.22 102.77 1h0h n HIS 423 Ca -0.01 0.00 -0.15 0.00 -2.01 0.00 0.00 57.72 55.55 1h0h n HIS 423 Cb 0.38 -0.11 -0.13 0.00 0.12 0.00 0.00 29.99 30.26 1h0h n HIS 423 CO 0.00 0.00 0.00 0.96 -2.81 0.00 0.00 176.34 174.49 1h0h s ILE 424 N -2.88 0.54 0.61 0.61 -4.36 -1.16 -1.25 121.20 113.30 1h0h s ILE 424 Ca 0.12 -0.76 -0.03 0.00 -0.26 0.00 0.00 60.65 59.73 1h0h s ILE 424 Cb 0.17 -0.54 0.04 0.00 1.25 0.00 0.00 42.46 43.37 1h0h s ILE 424 CO 0.73 -0.17 0.88 -0.31 0.24 0.00 0.00 174.94 176.31 1h0h s TYR 425 N -0.87 2.99 0.19 1.37 2.02 0.71 -4.33 117.35 119.44 1h0h s TYR 425 Ca -0.05 0.31 -0.32 0.00 -0.37 0.00 0.00 57.07 56.65 1h0h s TYR 425 Cb -0.07 -2.87 -0.16 0.00 -0.40 0.00 0.00 41.96 38.46 1h0h s TYR 425 CO 0.00 -1.01 1.02 -2.30 -1.57 0.00 0.00 175.55 171.70 1h0h n PRO 426 N -2.58 0.95 -0.67 -1.71 -0.02 -1.26 -2.28 135.00 127.43 1h0h n PRO 426 Ca 0.07 0.34 0.00 0.00 -2.02 0.00 0.00 63.50 61.88 1h0h n PRO 426 Cb 0.59 -1.73 0.00 0.00 -0.02 0.00 0.00 33.50 32.34 1h0h n PRO 426 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1h0h n GLY 427 N 1.80 0.59 3.62 -1.23 0.00 -0.39 -4.21 105.19 105.37 1h0h n GLY 427 Ca 0.15 -0.72 -0.25 0.00 0.00 0.00 0.00 46.02 45.19 1h0h n GLY 427 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1h0h n TYR 428 N -2.66 -2.79 -3.69 1.61 4.01 -0.96 -4.91 117.16 107.75 1h0h n TYR 428 Ca 0.00 0.99 -0.37 0.00 -0.16 0.00 0.00 57.90 58.36 1h0h n TYR 428 Cb 0.00 -4.90 -0.11 0.00 -0.31 0.00 0.00 39.34 34.03 1h0h n TYR 428 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1h0h s LEU 429 N -7.29 3.92 0.35 7.72 1.43 -1.17 -4.91 118.68 118.72 1h0h s LEU 429 Ca 0.59 0.00 -0.28 0.00 -1.03 0.00 0.00 54.13 53.42 1h0h s LEU 429 Cb -0.26 -2.06 -0.12 0.00 0.03 0.00 0.00 46.19 43.78 1h0h s LEU 429 CO 0.73 0.02 1.26 0.61 0.23 0.00 0.00 176.35 179.20 1h0h n GLY 430 N 4.60 0.51 3.80 -3.19 0.00 -1.26 -0.21 105.19 109.43 1h0h n GLY 430 Ca -0.15 0.30 -0.33 0.00 0.00 0.00 0.00 46.02 45.83 1h0h n GLY 430 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1h0h s THR 431 N -1.11 3.71 0.42 2.61 -4.23 -0.38 -4.71 115.64 111.95 1h0h s THR 431 Ca 0.56 0.90 -0.26 0.00 -1.18 0.00 0.00 61.69 61.71 1h0h s THR 431 Cb -0.57 -3.37 -0.09 0.00 1.34 0.00 0.00 72.50 69.81 1h0h s THR 431 CO 0.62 -0.40 1.39 0.00 -0.54 0.00 0.00 174.62 175.69 1h0h s ALA 432 N -2.26 3.32 0.25 3.99 0.00 -1.26 -4.97 121.76 120.83 1h0h s ALA 432 Ca 0.66 1.40 0.09 0.00 0.00 0.00 0.00 51.96 54.10 1h0h s ALA 432 Cb -0.17 -3.55 -0.05 0.00 0.00 0.00 0.00 23.12 19.35 1h0h s ALA 432 CO 0.32 -1.01 -0.15 1.03 0.00 0.00 0.00 175.76 175.94 1h0h s ARG 433 N -2.28 1.51 0.41 0.00 1.81 -1.26 -2.29 118.95 116.85 1h0h s ARG 433 Ca 0.57 -1.70 0.11 0.00 -1.72 0.00 0.00 55.73 53.00 1h0h s ARG 433 Cb -0.42 -1.40 0.93 0.00 -0.45 0.00 0.00 34.95 33.61 1h0h s ARG 433 CO 0.55 0.22 1.97 0.00 -0.68 0.00 0.00 175.30 177.36 1h0h h ALA 434 N 2.39 1.91 -0.30 2.13 0.00 -1.18 -0.79 119.26 123.42 1h0h h ALA 434 Ca -0.39 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.51 1h0h h ALA 434 Cb 1.24 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1h0h h ALA 434 CO 0.62 -0.04 0.00 -1.13 0.00 0.00 0.00 179.25 178.70 1h0h n SER 435 N -4.48 3.29 -3.72 0.00 3.41 -1.26 -4.24 113.62 106.62 1h0h n SER 435 Ca 0.10 -2.43 -0.28 0.00 -0.26 0.00 0.00 58.87 56.01 1h0h n SER 435 Cb 0.33 -0.56 -0.11 0.00 -0.26 0.00 0.00 64.21 63.61 1h0h n SER 435 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 1h0h n ILE 436 N 0.35 1.58 0.22 -1.33 5.41 -0.30 -4.98 119.36 120.31 1h0h n ILE 436 Ca 0.14 -4.85 0.11 0.00 1.00 0.00 0.00 62.75 59.15 1h0h n ILE 436 Cb 0.70 -2.12 0.37 0.00 -0.71 0.00 0.00 39.64 37.88 1h0h n ILE 436 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 176.55 175.90 1h0h h PRO 437 N 5.03 0.00 -5.60 0.38 0.11 -1.80 -3.44 132.00 126.69 1h0h h PRO 437 Ca 0.17 0.00 -0.45 0.00 0.11 0.00 0.00 66.00 65.83 1h0h h PRO 437 Cb 0.74 0.00 -0.17 0.00 0.11 0.00 0.00 31.00 31.68 1h0h h PRO 437 CO 0.72 0.17 -0.76 0.95 -0.21 0.00 0.00 178.00 178.87 1h0h s THR 438 N -3.44 1.54 0.37 -1.15 -4.23 -1.26 -4.93 115.64 102.54 1h0h s THR 438 Ca 0.03 -1.86 0.04 0.00 -1.18 0.00 0.00 61.69 58.71 1h0h s THR 438 Cb 0.08 -1.72 0.27 0.00 1.34 0.00 0.00 72.50 72.47 1h0h s THR 438 CO 0.64 -0.42 2.02 0.22 -0.54 0.00 0.00 174.62 176.54 1h0h h TYR 439 N 3.27 0.71 -0.36 3.99 3.20 -1.88 -1.04 116.97 124.87 1h0h h TYR 439 Ca -0.40 0.02 -0.08 0.00 3.14 0.00 0.00 58.73 61.41 1h0h h TYR 439 Cb 1.20 -0.24 -0.02 0.00 1.54 0.00 0.00 36.73 39.21 1h0h h TYR 439 CO 0.67 0.44 -0.10 0.93 -1.64 0.00 0.00 178.16 178.46 1h0h h GLU 440 N 0.76 0.62 -0.06 1.82 3.07 -1.98 -0.18 114.58 118.63 1h0h h GLU 440 Ca 0.22 -0.18 -0.17 0.00 -0.50 0.00 0.00 59.36 58.73 1h0h h GLU 440 Cb -0.05 -0.06 -0.01 0.00 -0.84 0.00 0.00 28.75 27.78 1h0h h GLU 440 CO -0.05 0.71 -0.68 0.93 -1.40 0.00 0.00 179.01 178.52 1h0h h GLU 441 N 0.57 0.29 0.08 2.33 5.08 -1.66 -1.60 114.58 119.67 1h0h h GLU 441 Ca 0.10 -0.23 -0.00 0.00 -1.00 0.00 0.00 59.36 58.23 1h0h h GLU 441 Cb 0.51 0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.80 1h0h h GLU 441 CO 0.03 0.87 -0.04 -0.92 -1.00 0.00 0.00 179.01 177.94 1h0h h TYR 442 N 0.20 -0.11 -0.25 4.33 3.20 -0.53 -0.59 116.97 123.23 1h0h h TYR 442 Ca -0.02 -0.00 -0.11 0.00 3.14 0.00 0.00 58.73 61.74 1h0h h TYR 442 Cb 1.23 0.03 -0.01 0.00 1.54 0.00 0.00 36.73 39.52 1h0h h TYR 442 CO 0.03 0.03 -0.32 1.79 -1.64 0.00 0.00 178.16 178.06 1h0h h THR 443 N -0.22 1.28 -0.59 1.81 1.35 -1.06 -2.52 112.91 112.96 1h0h h THR 443 Ca -0.01 -1.41 -0.05 0.00 -0.55 0.00 0.00 66.41 64.39 1h0h h THR 443 Cb 0.19 1.44 -0.03 0.00 -1.73 0.00 0.00 68.15 68.02 1h0h h THR 443 CO 0.02 0.44 0.18 0.50 -0.25 0.00 0.00 175.52 176.42 1h0h h LYS 444 N 0.44 0.89 -0.30 4.72 3.64 -1.10 -2.60 116.57 122.25 1h0h h LYS 444 Ca 0.05 -0.17 -0.04 0.00 -1.27 0.00 0.00 60.65 59.23 1h0h h LYS 444 Cb 0.77 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.44 1h0h h LYS 444 CO 0.06 0.77 0.03 -0.22 -2.27 0.00 0.00 179.45 177.82 1h0h h LYS 445 N 0.87 0.52 -0.42 1.90 3.64 -0.72 -3.25 116.57 119.11 1h0h h LYS 445 Ca 0.20 -0.15 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 1h0h h LYS 445 Cb 0.25 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.02 1h0h h LYS 445 CO -0.01 0.63 0.00 1.19 -2.27 0.00 0.00 179.45 178.99 1h0h n PHE 446 N -4.60 0.55 -3.72 1.91 3.72 -0.98 -4.77 117.46 109.57 1h0h n PHE 446 Ca -0.02 -0.28 -0.38 0.00 -0.05 0.00 0.00 57.45 56.72 1h0h n PHE 446 Cb 0.23 0.00 -0.12 0.00 -0.94 0.00 0.00 39.48 38.66 1h0h n PHE 446 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 1h0h s THR 447 N -1.45 3.83 0.47 4.37 2.01 -0.99 -4.85 115.64 119.02 1h0h s THR 447 Ca 0.32 -1.33 -0.22 0.00 0.31 0.00 0.00 61.69 60.77 1h0h s THR 447 Cb 0.17 -3.27 -0.08 0.00 0.01 0.00 0.00 72.50 69.33 1h0h s THR 447 CO 0.23 -0.33 1.09 -2.84 -0.69 0.00 0.00 174.62 172.08 1h0h s PRO 448 N 1.37 3.81 -0.05 4.92 0.02 -1.26 -4.96 135.00 138.85 1h0h s PRO 448 Ca 0.01 1.56 0.06 0.00 0.02 0.00 0.00 61.00 62.65 1h0h s PRO 448 Cb -0.21 -2.29 -0.01 0.00 0.02 0.00 0.00 34.50 32.01 1h0h s PRO 448 CO 0.02 -0.46 -0.24 0.08 -0.33 0.00 0.00 177.00 176.06 1h0h s VAL 449 N -1.73 2.13 -0.04 3.83 1.01 -1.26 -4.31 120.40 120.02 1h0h s VAL 449 Ca 0.65 -1.05 -0.01 0.00 0.00 0.00 0.00 61.98 61.57 1h0h s VAL 449 Cb -0.23 -1.77 0.03 0.00 0.00 0.00 0.00 36.38 34.42 1h0h s VAL 449 CO 0.27 0.57 0.07 -0.55 0.00 0.00 0.00 175.10 175.47 1h0h s SER 450 N -0.24 -0.00 -0.23 3.32 0.15 -1.26 -5.02 113.70 110.42 1h0h s SER 450 Ca -0.01 0.14 0.10 0.00 0.70 0.00 0.00 55.95 56.88 1h0h s SER 450 Cb -0.13 0.03 0.67 0.00 -1.71 0.00 0.00 66.02 64.89 1h0h s SER 450 CO 0.03 -0.13 1.59 0.29 1.20 0.00 0.00 173.24 176.21 1h0h n LYS 451 N 4.15 3.95 -3.52 5.44 5.02 -1.26 -4.83 118.16 127.11 1h0h n LYS 451 Ca -0.27 -2.64 -0.41 0.00 -2.02 0.00 0.00 58.31 52.97 1h0h n LYS 451 Cb 0.51 -2.13 -0.10 0.00 -0.02 0.00 0.00 35.03 33.29 1h0h n LYS 451 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1h0h s ASP 452 N -0.70 6.03 0.27 4.39 -1.08 -1.26 -4.95 116.67 119.37 1h0h s ASP 452 Ca 0.46 -0.57 0.25 0.00 -0.52 0.00 0.00 52.55 52.16 1h0h s ASP 452 Cb 0.36 -2.13 0.97 0.00 -1.46 0.00 0.00 42.92 40.66 1h0h s ASP 452 CO 0.13 -0.29 1.74 -0.81 0.52 0.00 0.00 175.17 176.45 1h0h n PRO 453 N 5.11 0.22 0.00 4.34 -0.04 -1.26 -1.41 135.00 141.96 1h0h n PRO 453 Ca -0.12 0.40 0.14 0.00 -0.04 0.00 0.00 63.50 63.88 1h0h n PRO 453 Cb 0.49 -1.89 0.57 0.00 -0.04 0.00 0.00 33.50 32.63 1h0h n PRO 453 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1h0h n GLN 454 N -2.29 0.83 -3.60 0.54 6.02 -1.26 -4.78 117.38 112.83 1h0h n GLN 454 Ca 0.03 -0.34 -0.38 0.00 -0.01 0.00 0.00 57.00 56.29 1h0h n GLN 454 Cb 0.27 -1.49 -0.11 0.00 1.02 0.00 0.00 30.24 29.93 1h0h n GLN 454 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 1h0h s SER 455 N -2.41 6.05 0.25 1.08 0.15 -0.50 -1.91 113.70 116.41 1h0h s SER 455 Ca 0.30 0.03 -0.05 0.00 0.70 0.00 0.00 55.95 56.93 1h0h s SER 455 Cb 0.20 -2.12 0.31 0.00 -1.71 0.00 0.00 66.02 62.70 1h0h s SER 455 CO 0.47 -0.03 1.90 0.00 1.20 0.00 0.00 173.24 176.77 1h0h h ALA 456 N 8.17 1.28 -6.91 5.45 0.00 -1.85 -3.47 119.26 121.92 1h0h h ALA 456 Ca -0.36 -0.04 -0.59 0.00 0.00 0.00 0.00 54.91 53.92 1h0h h ALA 456 Cb 1.18 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 1h0h h ALA 456 CO 0.58 0.51 -1.01 -1.71 0.00 0.00 0.00 179.25 177.61 1h0h n ASN 457 N -4.47 -4.16 -0.07 0.00 5.15 -1.14 -4.81 115.26 105.77 1h0h n ASN 457 Ca 0.13 -1.29 0.17 0.00 -0.60 0.00 0.00 54.58 52.98 1h0h n ASN 457 Cb 0.10 -1.75 0.59 0.00 -0.53 0.00 0.00 39.78 38.19 1h0h n ASN 457 CO 0.00 0.00 0.00 -0.25 1.40 0.00 0.00 177.26 178.41 1h0h h TRP 458 N -2.62 0.25 0.00 1.20 2.91 -1.20 -0.70 115.95 115.79 1h0h h TRP 458 Ca -0.71 0.01 0.00 0.00 1.13 0.00 0.00 58.89 59.31 1h0h h TRP 458 Cb 1.41 -0.08 0.00 0.00 -0.51 0.00 0.00 29.16 29.98 1h0h h TRP 458 CO 0.37 0.10 0.00 0.91 -1.03 0.00 0.00 178.44 178.79 1h0h n TRP 459 N -4.43 0.00 0.33 2.65 7.02 -1.26 -1.57 117.44 120.17 1h0h n TRP 459 Ca 0.11 0.00 0.20 0.00 -1.02 0.00 0.00 57.50 56.79 1h0h n TRP 459 Cb 0.52 -0.43 1.06 0.00 -2.42 0.00 0.00 31.31 30.05 1h0h n TRP 459 CO 0.00 0.00 0.00 0.66 -2.02 0.00 0.00 177.69 176.33 1h0h h SER 460 N 0.00 0.00 0.18 -0.99 4.64 -1.31 0.71 113.55 116.79 1h0h h SER 460 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1h0h h SER 460 Cb 0.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.19 1h0h h SER 460 CO 0.00 0.00 0.00 0.59 -0.87 0.00 0.00 176.83 176.55 1h0h n ASN 461 N -3.11 0.00 -0.24 4.97 3.02 -0.61 -4.48 115.26 114.81 1h0h n ASN 461 Ca -0.02 -0.63 0.01 0.00 -0.03 0.00 0.00 54.58 53.90 1h0h n ASN 461 Cb 0.18 -0.10 0.04 0.00 -0.61 0.00 0.00 39.78 39.30 1h0h n ASN 461 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 1h0h n PHE 462 N -1.10 0.08 0.27 3.10 7.35 0.24 -1.18 117.46 126.22 1h0h n PHE 462 Ca 0.19 0.78 0.11 0.00 -0.76 0.00 0.00 57.45 57.77 1h0h n PHE 462 Cb 0.14 -0.77 0.73 0.00 0.35 0.00 0.00 39.48 39.93 1h0h n PHE 462 CO 0.00 0.00 0.00 -1.35 -0.76 0.00 0.00 176.76 174.65 1h0h h PRO 463 N 0.00 0.00 -0.38 -7.13 0.11 -1.86 0.35 132.00 123.09 1h0h h PRO 463 Ca 0.24 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 66.27 1h0h h PRO 463 Cb 0.40 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.50 1h0h h PRO 463 CO -0.64 0.06 -0.12 0.87 -0.21 0.00 0.00 178.00 177.96 1h0h h LYS 464 N 0.00 0.67 0.13 1.05 1.57 -1.40 -1.89 116.57 116.71 1h0h h LYS 464 Ca -0.00 -0.22 -0.24 0.00 -1.87 0.00 0.00 60.65 58.33 1h0h h LYS 464 Cb 0.13 -0.06 0.03 0.00 0.08 0.00 0.00 32.23 32.41 1h0h h LYS 464 CO 0.01 0.78 -1.00 1.88 -0.57 0.00 0.00 179.45 180.54 1h0h h TYR 465 N 0.61 0.75 -0.55 -1.35 0.05 -1.00 -2.46 116.97 113.02 1h0h h TYR 465 Ca 0.11 -0.51 -0.06 0.00 0.05 0.00 0.00 58.73 58.32 1h0h h TYR 465 Cb 0.57 -0.05 -0.02 0.00 1.01 0.00 0.00 36.73 38.24 1h0h h TYR 465 CO 0.03 1.37 0.12 0.66 -1.05 0.00 0.00 178.16 179.29 1h0h h SER 466 N -0.08 0.84 -0.47 3.88 4.64 -1.34 0.08 113.55 121.09 1h0h h SER 466 Ca -0.16 -0.24 -0.01 0.00 -0.47 0.00 0.00 61.79 60.90 1h0h h SER 466 Cb 1.75 -0.22 -0.02 0.00 -0.31 0.00 0.00 62.40 63.60 1h0h h SER 466 CO 0.19 0.86 0.25 0.00 -0.87 0.00 0.00 176.83 177.26 1h0h h ALA 467 N 1.01 0.61 -0.60 5.18 0.00 -1.42 -1.83 119.26 122.21 1h0h h ALA 467 Ca 0.17 -0.10 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 1h0h h ALA 467 Cb 0.36 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1h0h h ALA 467 CO 0.00 0.14 0.02 0.77 0.00 0.00 0.00 179.25 180.19 1h0h h SER 468 N 0.63 1.00 0.08 0.00 0.02 -1.23 -1.08 113.55 112.97 1h0h h SER 468 Ca 0.17 -0.27 -0.00 0.00 -0.84 0.00 0.00 61.79 60.84 1h0h h SER 468 Cb 0.07 -0.27 0.00 0.00 0.14 0.00 0.00 62.40 62.35 1h0h h SER 468 CO -0.02 1.04 -0.04 0.22 -1.14 0.00 0.00 176.83 176.89 1h0h h TYR 469 N 0.95 -0.11 -0.69 3.45 3.20 -0.85 -1.44 116.97 121.48 1h0h h TYR 469 Ca 0.17 -0.00 0.03 0.00 3.14 0.00 0.00 58.73 62.07 1h0h h TYR 469 Cb 0.52 0.03 -0.04 0.00 1.54 0.00 0.00 36.73 38.78 1h0h h TYR 469 CO 0.04 0.05 0.43 0.82 -1.64 0.00 0.00 178.16 177.86 1h0h h ILE 470 N -0.25 1.08 -0.04 1.81 2.04 -1.21 -2.02 117.51 118.93 1h0h h ILE 470 Ca -0.01 -0.29 -0.09 0.00 1.00 0.00 0.00 64.86 65.48 1h0h h ILE 470 Cb 0.21 0.17 -0.01 0.00 -0.74 0.00 0.00 36.82 36.45 1h0h h ILE 470 CO 0.02 0.15 -0.38 0.11 0.00 0.00 0.00 178.15 178.05 1h0h h LYS 471 N 0.84 0.08 0.00 2.37 1.79 -1.18 -0.20 116.57 120.26 1h0h h LYS 471 Ca 0.28 -0.03 -0.00 0.00 -2.18 0.00 0.00 60.65 58.72 1h0h h LYS 471 Cb 0.03 -0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 30.68 1h0h h LYS 471 CO -0.11 0.45 -0.00 0.66 -1.08 0.00 0.00 179.45 179.36 1h0h h SER 472 N 0.07 0.00 0.00 0.86 4.64 -0.50 -2.18 113.55 116.44 1h0h h SER 472 Ca 0.01 0.00 -0.36 0.00 -0.47 0.00 0.00 61.79 60.97 1h0h h SER 472 Cb 0.70 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.73 1h0h h SER 472 CO 0.05 0.00 -2.31 0.23 -0.87 0.00 0.00 176.83 173.93 1h0h n MET 473 N -3.61 0.56 -3.37 4.77 2.81 -0.80 -4.74 117.12 112.74 1h0h n MET 473 Ca -0.03 0.15 -0.26 0.00 -1.81 0.00 0.00 57.70 55.75 1h0h n MET 473 Cb 0.08 -1.44 -0.08 0.00 -0.71 0.00 0.00 33.22 31.07 1h0h n MET 473 CO 0.00 0.00 0.00 0.91 1.51 0.00 0.00 175.97 178.39 1h0h n TRP 474 N -3.37 1.65 0.27 2.03 8.01 -0.15 -1.03 117.44 124.84 1h0h n TRP 474 Ca -0.42 -3.87 0.14 0.00 -1.31 0.00 0.00 57.50 52.04 1h0h n TRP 474 Cb 0.91 -0.41 0.79 0.00 -2.01 0.00 0.00 31.31 30.58 1h0h n TRP 474 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.69 175.68 1h0h h PRO 475 N 4.34 0.00 -0.02 -0.99 0.13 -1.61 -2.60 132.00 131.26 1h0h h PRO 475 Ca 0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 1h0h h PRO 475 Cb 0.78 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.91 1h0h h PRO 475 CO 0.64 0.09 -0.35 -0.25 -0.23 0.00 0.00 178.00 177.90 1h0h n ASP 476 N -3.63 1.99 -4.90 1.44 8.00 -1.26 -4.91 116.55 113.29 1h0h n ASP 476 Ca -0.02 -1.49 -0.29 0.00 0.71 0.00 0.00 54.79 53.70 1h0h n ASP 476 Cb 0.20 0.33 -0.03 0.00 -0.02 0.00 0.00 41.12 41.60 1h0h n ASP 476 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1h0h s ALA 477 N -2.39 3.55 0.67 2.24 0.00 -0.98 -5.07 121.76 119.78 1h0h s ALA 477 Ca 0.22 -0.46 -0.11 0.00 0.00 0.00 0.00 51.96 51.61 1h0h s ALA 477 Cb 0.19 -2.40 -0.01 0.00 0.00 0.00 0.00 23.12 20.89 1h0h s ALA 477 CO 0.51 0.19 1.05 0.16 0.00 0.00 0.00 175.76 177.68 1h0h s ASP 478 N -3.12 5.74 0.30 0.00 1.47 -1.26 -4.80 116.67 114.99 1h0h s ASP 478 Ca 0.46 1.46 -0.01 0.00 1.18 0.00 0.00 52.55 55.64 1h0h s ASP 478 Cb -0.11 -2.40 0.47 0.00 -0.34 0.00 0.00 42.92 40.53 1h0h s ASP 478 CO 0.30 -1.19 1.95 -0.07 0.68 0.00 0.00 175.17 176.83 1h0h h LEU 479 N -0.55 0.95 -0.23 2.11 3.38 -1.95 0.19 115.31 119.20 1h0h h LEU 479 Ca -0.44 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.48 1h0h h LEU 479 Cb 1.21 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.73 1h0h h LEU 479 CO 0.60 0.66 0.00 0.78 0.09 0.00 0.00 178.44 180.57 1h0h h ASN 480 N 1.10 0.40 0.60 -0.43 2.35 -1.99 0.17 115.58 117.78 1h0h h ASN 480 Ca 0.34 -0.31 -0.02 0.00 -0.55 0.00 0.00 56.30 55.76 1h0h h ASN 480 Cb -0.01 -0.11 -0.01 0.00 0.05 0.00 0.00 38.32 38.24 1h0h h ASN 480 CO -0.10 0.61 -0.41 -0.33 -1.65 0.00 0.00 177.43 175.55 1h0h h GLU 481 N 0.19 -0.94 -0.44 0.81 5.08 -1.86 -2.78 114.58 114.64 1h0h h GLU 481 Ca 0.07 0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.47 1h0h h GLU 481 Cb 0.40 0.21 -0.02 0.00 0.50 0.00 0.00 28.75 29.84 1h0h h GLU 481 CO 0.01 -0.62 0.19 0.00 -1.00 0.00 0.00 179.01 177.59 1h0h h ALA 482 N -0.71 1.52 -0.88 3.43 0.00 -0.56 -1.32 119.26 120.74 1h0h h ALA 482 Ca -0.07 -0.11 0.07 0.00 0.00 0.00 0.00 54.91 54.80 1h0h h ALA 482 Cb 0.80 -0.18 -0.06 0.00 0.00 0.00 0.00 17.79 18.35 1h0h h ALA 482 CO 0.04 0.38 0.57 -0.92 0.00 0.00 0.00 179.25 179.33 1h0h h TYR 483 N 0.61 1.00 0.00 0.00 3.20 -0.54 -0.55 116.97 120.70 1h0h h TYR 483 Ca 0.15 0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.05 1h0h h TYR 483 Cb 0.10 -0.33 0.00 0.00 1.54 0.00 0.00 36.73 38.04 1h0h h TYR 483 CO 0.01 0.52 0.00 0.78 -1.64 0.00 0.00 178.16 177.82 1h0h h GLY 484 N 0.98 0.00 1.99 1.82 0.00 -0.96 -2.52 103.07 104.39 1h0h h GLY 484 Ca 0.38 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.71 1h0h h GLY 484 CO -0.14 0.00 -0.01 -0.97 0.00 0.00 0.00 176.54 175.42 1h0h h TYR 485 N 0.00 0.00 -3.33 5.60 0.05 -1.04 -3.45 116.97 114.80 1h0h h TYR 485 Ca 0.00 0.00 -0.54 0.00 0.05 0.00 0.00 58.73 58.24 1h0h h TYR 485 Cb 0.30 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.03 1h0h h TYR 485 CO 0.00 0.00 0.44 -0.51 -1.05 0.00 0.00 178.16 177.04 1h0h s LEU 486 N -5.30 4.37 0.40 3.88 1.43 -0.95 -4.84 118.68 117.67 1h0h s LEU 486 Ca 0.09 1.80 -0.26 0.00 -1.03 0.00 0.00 54.13 54.73 1h0h s LEU 486 Cb 0.09 -3.57 -0.09 0.00 0.03 0.00 0.00 46.19 42.65 1h0h s LEU 486 CO 0.63 -0.34 1.29 -2.16 0.23 0.00 0.00 176.35 176.00 1h0h s PRO 487 N 1.02 3.98 -0.17 1.29 0.04 -1.25 -4.83 135.00 135.09 1h0h s PRO 487 Ca 0.55 2.13 -0.04 0.00 0.04 0.00 0.00 61.00 63.68 1h0h s PRO 487 Cb -0.24 -2.76 -0.02 0.00 0.04 0.00 0.00 34.50 31.52 1h0h s PRO 487 CO 0.28 -0.47 -0.04 0.15 0.04 0.00 0.00 177.00 176.97 1h0h s LYS 488 N -2.23 3.60 0.43 4.56 1.02 0.35 -4.56 119.74 122.91 1h0h s LYS 488 Ca 0.57 -0.55 -0.23 0.00 0.02 0.00 0.00 55.97 55.78 1h0h s LYS 488 Cb -0.37 -2.94 -0.08 0.00 -0.52 0.00 0.00 37.83 33.92 1h0h s LYS 488 CO 0.48 0.15 1.07 0.20 -0.92 0.00 0.00 175.35 176.33 1h0h s GLY 489 N 0.61 2.70 0.42 -3.33 0.00 -0.97 -4.58 107.32 102.18 1h0h s GLY 489 Ca -0.03 0.73 -0.26 0.00 0.00 0.00 0.00 44.72 45.17 1h0h s GLY 489 CO 0.02 1.15 1.30 1.18 0.00 0.00 0.00 173.10 176.76 1h0h n GLU 490 N -0.35 2.00 -1.90 2.90 -0.58 -1.26 -0.74 120.64 120.72 1h0h n GLU 490 Ca 0.06 0.71 -0.42 0.00 -0.42 0.00 0.00 57.16 57.10 1h0h n GLU 490 Cb 0.50 -2.43 -0.03 0.00 -0.57 0.00 0.00 31.44 28.91 1h0h n GLU 490 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1h0h s ASP 491 N -0.51 6.55 0.00 1.62 1.01 -1.26 -2.19 116.67 121.89 1h0h s ASP 491 Ca 0.61 2.69 0.00 0.00 0.71 0.00 0.00 52.55 56.56 1h0h s ASP 491 Cb -0.50 -2.60 0.00 0.00 1.01 0.00 0.00 42.92 40.83 1h0h s ASP 491 CO 0.58 -0.83 0.00 0.61 0.21 0.00 0.00 175.17 175.74 1h0h n GLY 492 N 3.38 1.06 3.72 0.21 0.00 -1.26 -5.00 105.19 107.29 1h0h n GLY 492 Ca 0.12 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.76 1h0h n GLY 492 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1h0h s LYS 493 N -0.08 4.37 -0.16 1.61 2.47 -0.93 -5.05 119.74 121.97 1h0h s LYS 493 Ca 0.00 0.62 -0.21 0.00 -1.56 0.00 0.00 55.97 54.82 1h0h s LYS 493 Cb 0.00 -3.45 -0.03 0.00 -1.46 0.00 0.00 37.83 32.89 1h0h s LYS 493 CO 0.00 0.09 0.64 0.34 0.16 0.00 0.00 175.35 176.59 1h0h s ASP 494 N 0.73 6.77 -0.21 1.43 2.15 -1.26 -4.84 116.67 121.44 1h0h s ASP 494 Ca 0.31 0.93 0.14 0.00 0.43 0.00 0.00 52.55 54.35 1h0h s ASP 494 Cb -0.16 -2.36 0.48 0.00 -0.30 0.00 0.00 42.92 40.57 1h0h s ASP 494 CO 0.13 -0.22 1.38 -1.22 -0.17 0.00 0.00 175.17 175.07 1h0h n TYR 495 N 4.65 0.79 -2.48 -5.34 4.02 -1.26 -4.78 117.16 112.76 1h0h n TYR 495 Ca -0.02 -1.18 -0.25 0.00 -0.01 0.00 0.00 57.90 56.45 1h0h n TYR 495 Cb 0.50 -0.34 0.13 0.00 -0.02 0.00 0.00 39.34 39.61 1h0h n TYR 495 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 176.86 174.31 1h0h s SER 496 N -2.37 3.99 0.61 7.72 1.04 -1.26 -4.41 113.70 119.02 1h0h s SER 496 Ca 0.41 -0.34 0.30 0.00 0.48 0.00 0.00 55.95 56.80 1h0h s SER 496 Cb 0.35 0.09 1.60 0.00 0.10 0.00 0.00 66.02 68.17 1h0h s SER 496 CO 0.04 -2.12 1.97 -0.25 0.98 0.00 0.00 173.24 173.86 1h0h h TRP 497 N -0.79 0.00 -0.99 5.02 2.91 -1.95 0.12 115.95 120.27 1h0h h TRP 497 Ca -0.37 0.00 0.12 0.00 1.13 0.00 0.00 58.89 59.78 1h0h h TRP 497 Cb 1.25 0.00 -0.08 0.00 -0.51 0.00 0.00 29.16 29.82 1h0h h TRP 497 CO -0.47 0.00 0.62 1.25 -1.03 0.00 0.00 178.44 178.82 1h0h h LEU 498 N 0.00 0.89 0.00 0.65 5.85 -1.93 -3.33 115.31 117.44 1h0h h LEU 498 Ca 0.11 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.88 1h0h h LEU 498 Cb 0.81 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.71 1h0h h LEU 498 CO -0.00 0.47 -0.71 0.35 -0.34 0.00 0.00 178.44 178.20 1h0h n THR 499 N -4.61 0.00 -0.13 1.05 -2.24 -0.11 -4.61 114.28 103.63 1h0h n THR 499 Ca 0.19 -0.08 -0.06 0.00 -2.27 0.00 0.00 64.05 61.83 1h0h n THR 499 Cb 0.37 0.54 0.00 0.00 -2.10 0.00 0.00 70.33 69.15 1h0h n THR 499 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1h0h h LEU 500 N 0.00 -0.90 -0.82 3.22 6.46 -0.96 0.13 115.31 122.44 1h0h h LEU 500 Ca 0.00 0.18 -0.12 0.00 -0.12 0.00 0.00 57.88 57.82 1h0h h LEU 500 Cb 0.00 0.45 -0.01 0.00 -0.73 0.00 0.00 40.66 40.37 1h0h h LEU 500 CO 0.00 -0.28 -0.42 -0.26 -0.62 0.00 0.00 178.44 176.86 1h0h h PHE 501 N -0.19 0.43 -0.45 1.25 0.04 -1.84 -0.40 116.94 115.79 1h0h h PHE 501 Ca 0.20 -0.12 -0.09 0.00 2.80 0.00 0.00 57.97 60.76 1h0h h PHE 501 Cb 0.50 -0.09 -0.02 0.00 2.20 0.00 0.00 35.95 38.54 1h0h h PHE 501 CO -0.50 0.73 -0.05 0.22 -0.60 0.00 0.00 178.31 178.10 1h0h h ASP 502 N 0.30 0.83 -0.87 2.17 3.58 -1.71 0.42 116.42 121.13 1h0h h ASP 502 Ca 0.03 -0.33 -0.00 0.00 0.42 0.00 0.00 57.03 57.14 1h0h h ASP 502 Cb 0.87 -0.23 -0.04 0.00 1.72 0.00 0.00 39.33 41.65 1h0h h ASP 502 CO 0.07 0.97 0.53 0.44 -2.88 0.00 0.00 179.24 178.37 1h0h h ASP 503 N 0.68 1.05 -0.56 2.28 3.32 -0.44 0.14 116.42 122.88 1h0h h ASP 503 Ca 0.12 -0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.10 1h0h h ASP 503 Cb 0.57 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.83 1h0h h ASP 503 CO 0.03 0.80 0.31 -0.03 -1.72 0.00 0.00 179.24 178.64 1h0h h MET 504 N 1.21 0.78 -0.51 3.56 4.05 -0.81 0.06 114.93 123.27 1h0h h MET 504 Ca 0.31 -0.09 -0.03 0.00 -0.28 0.00 0.00 59.70 59.62 1h0h h MET 504 Cb -0.05 -0.15 -0.03 0.00 -0.80 0.00 0.00 31.60 30.57 1h0h h MET 504 CO -0.06 0.60 0.21 0.35 0.23 0.00 0.00 176.91 178.24 1h0h h PHE 505 N 0.76 0.73 -0.04 1.39 3.57 0.06 -1.63 116.94 121.77 1h0h h PHE 505 Ca 0.20 -0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.67 1h0h h PHE 505 Cb 0.05 -0.23 0.00 0.00 2.79 0.00 0.00 35.95 38.56 1h0h h PHE 505 CO -0.01 0.57 0.00 1.04 -2.23 0.00 0.00 178.31 177.67 1h0h n GLN 506 N -4.35 1.19 -0.54 1.11 6.02 -0.06 -4.89 117.38 115.86 1h0h n GLN 506 Ca 0.04 -0.28 0.00 0.00 -0.01 0.00 0.00 57.00 56.75 1h0h n GLN 506 Cb 0.15 -1.30 0.00 0.00 1.02 0.00 0.00 30.24 30.11 1h0h n GLN 506 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1h0h n GLY 507 N 0.86 0.73 0.18 1.08 0.00 -0.61 -4.96 105.19 102.48 1h0h n GLY 507 Ca 0.14 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.29 1h0h n GLY 507 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1h0h h LYS 508 N 2.41 0.00 -5.00 1.61 1.57 -1.18 -3.43 116.57 112.55 1h0h h LYS 508 Ca 0.00 0.00 -0.66 0.00 -1.87 0.00 0.00 60.65 58.12 1h0h h LYS 508 Cb 0.00 0.00 -0.28 0.00 0.08 0.00 0.00 32.23 32.03 1h0h h LYS 508 CO 0.00 0.00 -0.73 0.42 -0.57 0.00 0.00 179.45 178.57 1h0h s ILE 509 N -3.24 3.34 -0.13 1.86 -1.09 -1.26 -4.46 121.20 116.23 1h0h s ILE 509 Ca 0.07 -0.50 -0.05 0.00 -2.23 0.00 0.00 60.65 57.94 1h0h s ILE 509 Cb 0.08 -2.52 -0.25 0.00 -1.58 0.00 0.00 42.46 38.19 1h0h s ILE 509 CO 0.61 0.43 0.34 0.29 -1.23 0.00 0.00 174.94 175.37 1h0h n LYS 510 N 4.79 0.75 -4.44 2.79 4.76 0.12 -4.46 118.16 122.47 1h0h n LYS 510 Ca -0.18 0.25 -0.23 0.00 -2.87 0.00 0.00 58.31 55.28 1h0h n LYS 510 Cb 0.51 -1.70 -0.13 0.00 -1.84 0.00 0.00 35.03 31.87 1h0h n LYS 510 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 1h0h s GLY 511 N -5.63 1.08 -0.06 0.72 0.00 -0.44 -0.30 107.32 102.70 1h0h s GLY 511 Ca -0.22 -1.07 -0.03 0.00 0.00 0.00 0.00 44.72 43.40 1h0h s GLY 511 CO 0.76 -1.04 0.13 -0.12 0.00 0.00 0.00 173.10 172.83 1h0h s PHE 512 N -0.96 -0.14 -0.33 1.90 5.36 -0.85 -1.61 117.98 121.35 1h0h s PHE 512 Ca 0.05 0.44 -0.15 0.00 -0.96 0.00 0.00 56.93 56.31 1h0h s PHE 512 Cb -0.09 -0.10 -0.02 0.00 -0.34 0.00 0.00 43.02 42.47 1h0h s PHE 512 CO 0.03 -0.15 0.34 -0.06 -1.46 0.00 0.00 175.22 173.91 1h0h s PHE 513 N 1.13 3.22 -0.94 10.12 0.08 -0.23 -0.85 117.98 130.49 1h0h s PHE 513 Ca -0.09 0.05 -0.10 0.00 0.12 0.00 0.00 56.93 56.91 1h0h s PHE 513 Cb -0.11 -2.62 0.24 0.00 -0.57 0.00 0.00 43.02 39.95 1h0h s PHE 513 CO -0.05 -0.38 0.89 0.00 -0.10 0.00 0.00 175.22 175.58 1h0h s ALA 514 N 1.99 4.35 -0.65 5.36 0.00 0.05 -1.51 121.76 131.35 1h0h s ALA 514 Ca 0.12 -3.61 -0.16 0.00 0.00 0.00 0.00 51.96 48.31 1h0h s ALA 514 Cb -0.16 -3.40 0.15 0.00 0.00 0.00 0.00 23.12 19.70 1h0h s ALA 514 CO 0.11 -2.22 0.65 -0.46 0.00 0.00 0.00 175.76 173.85 1h0h s TRP 515 N -0.65 3.32 -0.83 0.00 -0.11 -0.10 -2.18 118.94 118.40 1h0h s TRP 515 Ca 0.24 -1.41 0.00 0.00 1.22 0.00 0.00 56.10 56.16 1h0h s TRP 515 Cb -0.10 -3.88 0.00 0.00 -1.50 0.00 0.00 33.47 27.98 1h0h s TRP 515 CO -0.09 -1.10 0.00 0.41 -4.62 0.00 0.00 176.95 171.55 1h0h n GLY 516 N 4.93 0.05 3.18 5.86 0.00 -0.15 -3.88 105.19 115.17 1h0h n GLY 516 Ca -0.03 -0.49 -0.09 0.00 0.00 0.00 0.00 46.02 45.40 1h0h n GLY 516 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1h0h s GLN 517 N -4.37 0.88 -0.49 1.61 -0.21 -1.26 -4.73 119.66 111.09 1h0h s GLN 517 Ca 0.00 -1.27 0.08 0.00 0.02 0.00 0.00 55.36 54.19 1h0h s GLN 517 Cb 0.00 0.27 0.30 0.00 1.00 0.00 0.00 33.01 34.58 1h0h s GLN 517 CO 0.00 -0.25 0.75 -1.71 -2.12 0.00 0.00 175.29 171.95 1h0h n ASN 518 N -0.06 2.34 0.20 5.90 5.15 -1.26 -4.93 115.26 122.60 1h0h n ASN 518 Ca -0.09 -3.22 0.14 0.00 -0.60 0.00 0.00 54.58 50.80 1h0h n ASN 518 Cb 0.63 -0.62 0.72 0.00 -0.53 0.00 0.00 39.78 39.98 1h0h n ASN 518 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 1h0h h PRO 519 N 3.48 0.00 0.00 1.20 0.13 -1.98 0.31 132.00 135.14 1h0h h PRO 519 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 1h0h h PRO 519 Cb 0.75 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.88 1h0h h PRO 519 CO 0.65 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.42 1h0h n ALA 520 N -1.85 1.50 0.00 -0.56 0.00 -1.26 -1.88 120.51 116.47 1h0h n ALA 520 Ca -0.01 0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1h0h n ALA 520 Cb 0.06 -1.25 0.00 0.00 0.00 0.00 0.00 19.45 18.26 1h0h n ALA 520 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1h0h h SER 522 N 0.00 0.00 -4.03 0.00 4.64 -1.20 -3.40 113.55 109.57 1h0h h SER 522 Ca 0.00 -0.02 -0.48 0.00 -0.47 0.00 0.00 61.79 60.82 1h0h h SER 522 Cb 0.97 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.07 1h0h h SER 522 CO 0.00 0.01 0.29 -0.83 -0.87 0.00 0.00 176.83 175.43 1h0h s GLY 523 N -4.25 2.07 0.70 -0.77 0.00 -0.79 -4.74 107.32 99.55 1h0h s GLY 523 Ca 0.02 0.09 -0.16 0.00 0.00 0.00 0.00 44.72 44.67 1h0h s GLY 523 CO 0.75 0.34 1.24 0.00 0.00 0.00 0.00 173.10 175.44 1h0h s ALA 524 N -2.49 2.21 -0.91 3.20 0.00 0.11 -4.02 121.76 119.86 1h0h s ALA 524 Ca 0.57 1.02 -0.06 0.00 0.00 0.00 0.00 51.96 53.48 1h0h s ALA 524 Cb -0.10 -3.51 -0.01 0.00 0.00 0.00 0.00 23.12 19.50 1h0h s ALA 524 CO 0.29 -1.78 0.75 -1.71 0.00 0.00 0.00 175.76 173.31 1h0h n ASN 525 N -2.40 -6.47 -0.33 0.00 2.85 -0.65 -3.85 115.26 104.41 1h0h n ASN 525 Ca 0.14 -0.58 0.14 0.00 -0.11 0.00 0.00 54.58 54.17 1h0h n ASN 525 Cb 0.49 -4.17 0.32 0.00 1.24 0.00 0.00 39.78 37.67 1h0h n ASN 525 CO 0.00 0.00 0.00 0.28 -2.11 0.00 0.00 177.26 175.43 1h0h h SER 526 N -0.53 0.61 -0.53 1.20 0.02 -0.51 -0.35 113.55 113.46 1h0h h SER 526 Ca -0.39 0.12 0.04 0.00 -0.84 0.00 0.00 61.79 60.73 1h0h h SER 526 Cb 1.22 0.03 -0.04 0.00 0.14 0.00 0.00 62.40 63.74 1h0h h SER 526 CO 0.38 0.15 0.28 0.78 -1.14 0.00 0.00 176.83 177.28 1h0h h ASN 527 N 0.60 0.41 -0.07 3.07 2.35 -1.82 0.94 115.58 121.06 1h0h h ASN 527 Ca 0.58 0.03 -0.23 0.00 -0.55 0.00 0.00 56.30 56.13 1h0h h ASN 527 Cb 1.00 -0.05 0.01 0.00 0.05 0.00 0.00 38.32 39.34 1h0h h ASN 527 CO -0.44 0.28 -0.85 0.50 -1.65 0.00 0.00 177.43 175.27 1h0h h LYS 528 N 0.54 0.70 -0.53 0.81 3.64 -1.62 -1.91 116.57 118.20 1h0h h LYS 528 Ca 0.23 -0.66 0.04 0.00 -1.27 0.00 0.00 60.65 59.00 1h0h h LYS 528 Cb 0.13 0.16 -0.04 0.00 -0.41 0.00 0.00 32.23 32.07 1h0h h LYS 528 CO -0.15 1.26 0.28 1.15 -2.27 0.00 0.00 179.45 179.71 1h0h h THR 529 N 0.39 0.97 -0.90 1.00 2.02 -0.92 0.30 112.91 115.77 1h0h h THR 529 Ca -0.08 -0.19 -0.01 0.00 0.77 0.00 0.00 66.41 66.90 1h0h h THR 529 Cb 1.49 0.38 -0.04 0.00 -1.74 0.00 0.00 68.15 68.24 1h0h h THR 529 CO 0.17 0.10 0.53 0.03 0.37 0.00 0.00 175.52 176.72 1h0h h ARG 530 N 0.55 1.24 -0.75 6.66 3.08 -0.78 -1.99 114.38 122.38 1h0h h ARG 530 Ca 0.23 -0.12 -0.02 0.00 0.07 0.00 0.00 59.98 60.14 1h0h h ARG 530 Cb 0.12 -0.25 -0.04 0.00 0.08 0.00 0.00 29.97 29.88 1h0h h ARG 530 CO -0.15 0.88 0.40 1.49 -1.07 0.00 0.00 179.97 181.52 1h0h h GLU 531 N 1.25 1.06 -0.51 0.04 4.81 -0.50 -2.81 114.58 117.91 1h0h h GLU 531 Ca 0.32 -0.13 0.04 0.00 -0.13 0.00 0.00 59.36 59.46 1h0h h GLU 531 Cb -0.02 -0.20 -0.03 0.00 0.63 0.00 0.00 28.75 29.12 1h0h h GLU 531 CO -0.06 0.80 0.34 0.00 -0.73 0.00 0.00 179.01 179.36 1h0h h ALA 532 N 1.21 1.79 0.00 2.92 0.00 0.30 -1.21 119.26 124.26 1h0h h ALA 532 Ca 0.26 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.11 1h0h h ALA 532 Cb 0.06 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1h0h h ALA 532 CO -0.04 0.14 -0.22 -0.07 0.00 0.00 0.00 179.25 179.06 1h0h h LEU 533 N 0.55 0.00 -0.82 0.00 3.38 -1.17 -1.89 115.31 115.35 1h0h h LEU 533 Ca 0.21 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.18 1h0h h LEU 533 Cb 0.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.91 1h0h h LEU 533 CO -0.06 0.22 0.00 0.71 0.09 0.00 0.00 178.44 179.40 1h0h h THR 534 N 0.00 0.00 0.00 0.22 1.35 -1.25 -2.34 112.91 110.89 1h0h h THR 534 Ca -0.00 -0.25 0.00 0.00 -0.55 0.00 0.00 66.41 65.61 1h0h h THR 534 Cb 0.49 1.00 0.00 0.00 -1.73 0.00 0.00 68.15 67.91 1h0h h THR 534 CO 0.03 0.00 0.00 0.29 -0.25 0.00 0.00 175.52 175.59 1h0h n LYS 535 N -2.33 0.24 -2.47 4.72 4.76 -0.71 -4.51 118.16 117.85 1h0h n LYS 535 Ca 0.02 0.22 -0.37 0.00 -2.87 0.00 0.00 58.31 55.31 1h0h n LYS 535 Cb 0.23 -1.80 -0.03 0.00 -1.84 0.00 0.00 35.03 31.59 1h0h n LYS 535 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1h0h s LEU 536 N -4.46 4.18 0.04 -0.35 1.43 -0.88 -4.87 118.68 113.76 1h0h s LEU 536 Ca 0.10 2.13 -0.16 0.00 -1.03 0.00 0.00 54.13 55.17 1h0h s LEU 536 Cb 0.12 -4.11 -0.25 0.00 0.03 0.00 0.00 46.19 41.99 1h0h s LEU 536 CO 0.57 -0.52 1.13 0.44 0.23 0.00 0.00 176.35 178.21 1h0h h ASP 537 N 2.61 0.78 -5.03 2.29 3.32 -0.90 -3.33 116.42 116.16 1h0h h ASP 537 Ca -0.48 -0.77 -0.12 0.00 0.02 0.00 0.00 57.03 55.68 1h0h h ASP 537 Cb 1.22 -0.24 -0.19 0.00 0.22 0.00 0.00 39.33 40.34 1h0h h ASP 537 CO 0.63 1.45 -0.35 -1.66 -1.72 0.00 0.00 179.24 177.58 1h0h s TRP 538 N -3.19 -0.05 -0.01 4.55 1.48 -0.95 -0.77 118.94 120.00 1h0h s TRP 538 Ca -0.11 -0.04 0.02 0.00 -1.06 0.00 0.00 56.10 54.91 1h0h s TRP 538 Cb 0.05 0.03 0.00 0.00 -1.16 0.00 0.00 33.47 32.39 1h0h s TRP 538 CO 0.89 -0.40 -0.07 1.41 -4.06 0.00 0.00 176.95 174.72 1h0h s MET 539 N -1.95 0.68 -0.23 3.25 1.75 0.23 -2.00 119.30 121.02 1h0h s MET 539 Ca -0.10 -0.24 -0.06 0.00 -1.25 0.00 0.00 55.69 54.05 1h0h s MET 539 Cb -0.04 -0.66 -0.02 0.00 2.84 0.00 0.00 34.83 36.95 1h0h s MET 539 CO -0.00 0.11 0.02 0.08 -0.65 0.00 0.00 175.02 174.58 1h0h s VAL 540 N 0.07 3.97 -0.19 10.11 1.01 -0.03 -1.02 120.40 134.32 1h0h s VAL 540 Ca -0.01 -0.29 -0.01 0.00 0.00 0.00 0.00 61.98 61.67 1h0h s VAL 540 Cb -0.06 -2.83 0.01 0.00 0.00 0.00 0.00 36.38 33.50 1h0h s VAL 540 CO -0.00 0.38 -0.14 0.21 0.00 0.00 0.00 175.10 175.55 1h0h s ASN 541 N 1.43 3.62 -0.25 3.32 3.04 0.16 -0.77 114.94 125.50 1h0h s ASN 541 Ca 0.05 -0.53 -0.03 0.00 0.04 0.00 0.00 52.86 52.39 1h0h s ASN 541 Cb -0.15 -1.58 0.01 0.00 -1.54 0.00 0.00 41.25 37.99 1h0h s ASN 541 CO 0.01 0.01 -0.02 -0.69 -3.04 0.00 0.00 177.10 173.36 1h0h s VAL 542 N 1.28 3.25 0.29 -5.21 1.01 -0.93 -1.08 120.40 119.02 1h0h s VAL 542 Ca 0.04 -0.82 -0.20 0.00 0.00 0.00 0.00 61.98 60.99 1h0h s VAL 542 Cb -0.14 -2.62 0.02 0.00 0.00 0.00 0.00 36.38 33.65 1h0h s VAL 542 CO -0.08 0.22 0.73 0.21 0.00 0.00 0.00 175.10 176.19 1h0h s ASN 543 N 1.40 -0.23 0.12 3.32 3.84 -1.04 -0.98 114.94 121.37 1h0h s ASN 543 Ca 0.02 -0.67 -0.07 0.00 0.21 0.00 0.00 52.86 52.35 1h0h s ASN 543 Cb -0.16 0.74 -0.12 0.00 -0.55 0.00 0.00 41.25 41.16 1h0h s ASN 543 CO -0.03 -1.39 1.28 0.40 -2.79 0.00 0.00 177.10 174.58 1h0h h ILE 544 N 2.00 1.36 -3.62 -5.21 2.04 -1.87 -1.91 117.51 110.30 1h0h h ILE 544 Ca -0.21 -2.34 -0.44 0.00 1.00 0.00 0.00 64.86 62.87 1h0h h ILE 544 Cb 1.25 2.36 -0.19 0.00 -0.74 0.00 0.00 36.82 39.50 1h0h h ILE 544 CO 0.25 0.71 -0.77 -0.36 0.00 0.00 0.00 178.15 177.98 1h0h s PHE 545 N -3.34 1.47 0.75 1.37 0.08 -1.26 -4.22 117.98 112.83 1h0h s PHE 545 Ca -0.07 -0.52 -0.15 0.00 0.12 0.00 0.00 56.93 56.31 1h0h s PHE 545 Cb 0.08 -0.77 0.04 0.00 -0.57 0.00 0.00 43.02 41.80 1h0h s PHE 545 CO 0.88 0.17 1.19 -3.47 -0.10 0.00 0.00 175.22 173.89 1h0h n ASP 546 N 0.64 1.27 -3.41 1.36 2.03 -1.26 -4.98 116.55 112.19 1h0h n ASP 546 Ca -0.16 0.67 -0.07 0.00 0.52 0.00 0.00 54.79 55.76 1h0h n ASP 546 Cb 0.56 -1.51 0.00 0.00 -0.72 0.00 0.00 41.12 39.46 1h0h n ASP 546 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1h0h s ASN 547 N -1.81 -0.11 0.54 1.67 2.20 -1.26 -5.03 114.94 111.14 1h0h s ASN 547 Ca 0.76 -0.80 0.21 0.00 -0.94 0.00 0.00 52.86 52.10 1h0h s ASN 547 Cb -0.33 0.71 1.46 0.00 -2.00 0.00 0.00 41.25 41.09 1h0h s ASN 547 CO 0.47 -1.37 2.18 -0.33 -2.94 0.00 0.00 177.10 175.11 1h0h h GLU 548 N 2.00 0.00 0.00 3.55 3.07 -1.93 -0.38 114.58 120.89 1h0h h GLU 548 Ca -0.26 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 58.60 1h0h h GLU 548 Cb 1.24 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 29.15 1h0h h GLU 548 CO 0.32 0.02 -0.03 1.15 -1.40 0.00 0.00 179.01 179.07 1h0h h THR 549 N 0.00 0.07 -0.57 1.13 2.02 -1.92 -2.39 112.91 111.25 1h0h h THR 549 Ca -0.00 -1.05 0.06 0.00 0.77 0.00 0.00 66.41 66.19 1h0h h THR 549 Cb 0.03 0.14 -0.03 0.00 -1.74 0.00 0.00 68.15 66.55 1h0h h THR 549 CO 0.00 0.02 0.38 1.23 0.37 0.00 0.00 175.52 177.52 1h0h h GLY 550 N -1.00 0.65 -2.93 2.16 0.00 -1.92 -2.36 103.07 97.67 1h0h h GLY 550 Ca -0.00 -0.21 -0.26 0.00 0.00 0.00 0.00 47.33 46.86 1h0h h GLY 550 CO -0.00 0.15 0.22 1.44 0.00 0.00 0.00 176.54 178.36 1h0h n SER 551 N -4.47 3.58 -0.13 0.19 7.64 -0.16 -4.66 113.62 115.60 1h0h n SER 551 Ca 0.08 -3.50 0.16 0.00 1.01 0.00 0.00 58.87 56.61 1h0h n SER 551 Cb 0.25 -0.71 0.53 0.00 -1.01 0.00 0.00 64.21 63.28 1h0h n SER 551 CO 0.00 0.00 0.00 2.19 -3.01 0.00 0.00 175.04 174.22 1h0h h PHE 552 N 1.50 0.40 0.00 1.43 -0.00 -0.87 -1.43 116.94 117.97 1h0h h PHE 552 Ca 0.32 0.01 0.00 0.00 -0.00 0.00 0.00 57.97 58.30 1h0h h PHE 552 Cb 2.14 -0.13 0.00 0.00 -0.00 0.00 0.00 35.95 37.96 1h0h h PHE 552 CO 1.19 0.16 0.00 -2.67 -0.00 0.00 0.00 178.31 176.99 1h0h n TRP 553 N -4.46 0.45 -1.33 6.09 4.27 -1.26 -1.78 117.44 119.42 1h0h n TRP 553 Ca 0.13 0.21 0.08 0.00 -3.89 0.00 0.00 57.50 54.03 1h0h n TRP 553 Cb 0.53 -0.83 0.13 0.00 -1.36 0.00 0.00 31.31 29.78 1h0h n TRP 553 CO 0.00 0.00 0.00 2.89 -2.29 0.00 0.00 177.69 178.29 1h0h n ARG 554 N -1.94 1.15 -0.96 -2.67 1.85 -0.54 -3.86 116.66 109.69 1h0h n ARG 554 Ca 0.01 -2.53 -0.11 0.00 -1.00 0.00 0.00 57.85 54.22 1h0h n ARG 554 Cb 0.10 -1.36 0.08 0.00 -1.05 0.00 0.00 32.46 30.23 1h0h n ARG 554 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1h0h n GLY 555 N -1.15 -0.75 3.67 2.89 0.00 -0.73 -4.90 105.19 104.22 1h0h n GLY 555 Ca 0.14 -1.77 -0.45 0.00 0.00 0.00 0.00 46.02 43.94 1h0h n GLY 555 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1h0h n PRO 556 N -2.06 2.14 -1.18 1.61 -0.02 -1.26 -1.95 135.00 132.27 1h0h n PRO 556 Ca 0.07 0.77 -0.06 0.00 -2.02 0.00 0.00 63.50 62.25 1h0h n PRO 556 Cb 0.24 -2.50 -0.03 0.00 -0.02 0.00 0.00 33.50 31.19 1h0h n PRO 556 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1h0h n ASP 557 N 2.95 -5.11 -4.80 2.55 8.00 -1.26 -4.97 116.55 113.91 1h0h n ASP 557 Ca 0.15 0.16 -0.37 0.00 0.71 0.00 0.00 54.79 55.44 1h0h n ASP 557 Cb 0.30 -3.17 -0.06 0.00 -0.02 0.00 0.00 41.12 38.16 1h0h n ASP 557 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 1h0h s MET 558 N -2.24 3.96 -0.43 -1.24 -1.94 -0.82 -5.04 119.30 111.54 1h0h s MET 558 Ca 0.00 0.14 -0.12 0.00 -1.71 0.00 0.00 55.69 54.00 1h0h s MET 558 Cb 0.00 -3.31 0.07 0.00 2.01 0.00 0.00 34.83 33.60 1h0h s MET 558 CO 0.00 0.50 0.30 0.34 -0.01 0.00 0.00 175.02 176.16 1h0h s ASP 559 N -0.36 5.85 0.50 3.03 -1.08 -1.26 -4.80 116.67 118.56 1h0h s ASP 559 Ca 0.18 -1.34 0.15 0.00 -0.52 0.00 0.00 52.55 51.02 1h0h s ASP 559 Cb -0.14 -2.07 1.20 0.00 -1.46 0.00 0.00 42.92 40.45 1h0h s ASP 559 CO 0.07 -0.55 2.13 -0.65 0.52 0.00 0.00 175.17 176.69 1h0h h PRO 560 N 8.54 0.09 0.00 4.34 0.11 -1.89 -0.87 132.00 142.32 1h0h h PRO 560 Ca -0.25 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.84 1h0h h PRO 560 Cb 1.10 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.19 1h0h h PRO 560 CO 0.79 0.06 -0.05 0.87 -0.21 0.00 0.00 178.00 179.45 1h0h h LYS 561 N 0.09 0.00 -0.20 1.05 1.57 -1.86 -1.88 116.57 115.33 1h0h h LYS 561 Ca 0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 1h0h h LYS 561 Cb -0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1h0h h LYS 561 CO -0.00 0.05 0.00 1.63 -0.57 0.00 0.00 179.45 180.56 1h0h n LYS 562 N -4.27 1.98 -3.72 3.15 5.02 -0.34 -4.68 118.16 115.31 1h0h n LYS 562 Ca -0.03 -1.47 -0.38 0.00 -2.02 0.00 0.00 58.31 54.42 1h0h n LYS 562 Cb 0.14 -1.44 -0.12 0.00 -0.02 0.00 0.00 35.03 33.59 1h0h n LYS 562 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1h0h s ILE 563 N -1.75 4.10 -0.23 -0.18 1.01 -0.71 -4.98 121.20 118.46 1h0h s ILE 563 Ca 0.34 -0.79 0.27 0.00 0.00 0.00 0.00 60.65 60.48 1h0h s ILE 563 Cb 0.19 -3.19 0.36 0.00 0.01 0.00 0.00 42.46 39.83 1h0h s ILE 563 CO 0.29 -0.03 1.77 0.07 0.00 0.00 0.00 174.94 177.04 1h0h h LYS 564 N 8.28 0.00 -6.46 2.79 2.10 -1.85 -2.08 116.57 119.35 1h0h h LYS 564 Ca -0.29 0.00 -0.56 0.00 -2.00 0.00 0.00 60.65 57.81 1h0h h LYS 564 Cb 1.12 0.00 0.04 0.00 -0.90 0.00 0.00 32.23 32.48 1h0h h LYS 564 CO 0.62 0.00 1.06 2.41 -2.00 0.00 0.00 179.45 181.53 1h0h n THR 565 N -3.04 0.36 -2.81 0.07 -1.04 -1.25 -4.19 114.28 102.37 1h0h n THR 565 Ca 0.03 -0.06 -0.41 0.00 -2.04 0.00 0.00 64.05 61.56 1h0h n THR 565 Cb 0.43 -1.98 -0.03 0.00 -1.82 0.00 0.00 70.33 66.92 1h0h n THR 565 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 1h0h s GLU 566 N 2.73 4.48 -0.09 -2.82 2.12 0.05 -4.35 118.70 120.82 1h0h s GLU 566 Ca 0.84 1.24 0.04 0.00 0.36 0.00 0.00 54.97 57.45 1h0h s GLU 566 Cb -0.56 -3.48 -0.00 0.00 0.26 0.00 0.00 34.13 30.35 1h0h s GLU 566 CO 0.40 -0.10 -0.23 0.08 -0.54 0.00 0.00 175.26 174.88 1h0h s VAL 567 N 1.25 1.96 -0.30 3.70 1.01 -0.40 -0.60 120.40 127.02 1h0h s VAL 567 Ca 0.46 -0.97 -0.04 0.00 0.00 0.00 0.00 61.98 61.44 1h0h s VAL 567 Cb -0.19 -1.69 0.03 0.00 0.00 0.00 0.00 36.38 34.53 1h0h s VAL 567 CO 0.22 0.54 0.03 -0.36 0.00 0.00 0.00 175.10 175.53 1h0h s PHE 568 N 0.30 3.20 -0.24 5.22 0.08 -0.19 -0.56 117.98 125.80 1h0h s PHE 568 Ca -0.16 -1.51 -0.09 0.00 0.12 0.00 0.00 56.93 55.28 1h0h s PHE 568 Cb -0.17 -2.17 -0.04 0.00 -0.57 0.00 0.00 43.02 40.06 1h0h s PHE 568 CO 0.08 -0.73 0.12 0.12 -0.10 0.00 0.00 175.22 174.71 1h0h s PHE 569 N 1.36 3.22 -0.31 0.36 5.36 0.75 -0.66 117.98 128.05 1h0h s PHE 569 Ca -0.02 -0.00 0.01 0.00 -0.96 0.00 0.00 56.93 55.96 1h0h s PHE 569 Cb -0.19 -2.23 0.07 0.00 -0.34 0.00 0.00 43.02 40.33 1h0h s PHE 569 CO 0.00 -0.07 -0.00 -0.51 -1.46 0.00 0.00 175.22 173.18 1h0h s LEU 570 N 1.17 4.07 0.13 6.12 1.43 -0.24 -1.22 118.68 130.15 1h0h s LEU 570 Ca 0.06 -1.58 -0.31 0.00 -1.03 0.00 0.00 54.13 51.27 1h0h s LEU 570 Cb -0.14 -1.65 -0.08 0.00 0.03 0.00 0.00 46.19 44.34 1h0h s LEU 570 CO 0.05 -0.29 1.40 -2.16 0.23 0.00 0.00 176.35 175.57 1h0h s PRO 571 N 1.12 4.32 0.40 1.29 0.04 -1.26 -2.50 135.00 138.41 1h0h s PRO 571 Ca -0.02 2.11 0.08 0.00 0.04 0.00 0.00 61.00 63.21 1h0h s PRO 571 Cb -0.20 -3.23 -0.04 0.00 0.04 0.00 0.00 34.50 31.07 1h0h s PRO 571 CO -0.04 -0.43 0.22 0.00 0.04 0.00 0.00 177.00 176.78 1h0h s ALA 573 N -2.54 2.64 0.34 0.00 0.00 -1.11 -4.64 121.76 116.45 1h0h s ALA 573 Ca 0.42 0.11 0.07 0.00 0.00 0.00 0.00 51.96 52.56 1h0h s ALA 573 Cb 0.01 -3.19 -0.01 0.00 0.00 0.00 0.00 23.12 19.94 1h0h s ALA 573 CO 0.24 -1.26 0.47 0.14 0.00 0.00 0.00 175.76 175.34 1h0h s VAL 574 N -3.02 4.04 0.27 0.00 -7.23 -1.26 -4.88 120.40 108.33 1h0h s VAL 574 Ca 0.58 -1.00 0.01 0.00 -1.81 0.00 0.00 61.98 59.76 1h0h s VAL 574 Cb -0.14 -3.40 0.26 0.00 0.56 0.00 0.00 36.38 33.66 1h0h s VAL 574 CO 0.55 -0.15 1.76 0.00 -0.31 0.00 0.00 175.10 176.94 1h0h h ALA 575 N 0.89 1.38 0.00 1.32 0.00 -1.94 0.15 119.26 121.06 1h0h h ALA 575 Ca -0.46 0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.54 1h0h h ALA 575 Cb 1.26 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1h0h h ALA 575 CO 0.53 -0.09 0.00 0.44 0.00 0.00 0.00 179.25 180.13 1h0h n ILE 576 N -4.85 0.17 -0.36 0.00 -5.35 -1.26 -1.92 119.36 105.79 1h0h n ILE 576 Ca 0.19 0.04 0.09 0.00 -0.27 0.00 0.00 62.75 62.80 1h0h n ILE 576 Cb 0.48 -0.73 0.26 0.00 -1.74 0.00 0.00 39.64 37.91 1h0h n ILE 576 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1h0h n GLU 577 N -1.12 2.93 -4.16 6.28 1.02 0.04 -0.16 120.64 125.47 1h0h n GLU 577 Ca 0.13 -2.46 -0.18 0.00 -0.02 0.00 0.00 57.16 54.63 1h0h n GLU 577 Cb 0.10 -1.50 -0.12 0.00 -0.02 0.00 0.00 31.44 29.90 1h0h n GLU 577 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1h0h s LYS 578 N -1.20 0.80 -0.15 3.49 1.02 -0.81 -4.25 119.74 118.64 1h0h s LYS 578 Ca 0.38 -0.94 0.01 0.00 0.02 0.00 0.00 55.97 55.44 1h0h s LYS 578 Cb 0.21 -0.78 0.00 0.00 -0.52 0.00 0.00 37.83 36.75 1h0h s LYS 578 CO 0.24 0.17 -0.18 -2.00 -0.92 0.00 0.00 175.35 172.66 1h0h s GLU 579 N -1.75 3.13 0.00 1.68 2.12 -1.26 -3.28 118.70 119.34 1h0h s GLU 579 Ca -0.02 -0.79 0.00 0.00 0.36 0.00 0.00 54.97 54.51 1h0h s GLU 579 Cb -0.10 -2.55 0.00 0.00 0.26 0.00 0.00 34.13 31.74 1h0h s GLU 579 CO 0.02 -0.00 0.00 0.41 -0.54 0.00 0.00 175.26 175.15 1h0h n GLY 580 N 4.08 -1.08 3.41 -1.50 0.00 -0.87 -4.74 105.19 104.48 1h0h n GLY 580 Ca -0.19 -0.88 -0.26 0.00 0.00 0.00 0.00 46.02 44.68 1h0h n GLY 580 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1h0h s SER 581 N -4.00 3.32 0.01 1.61 1.04 -1.26 -0.15 113.70 114.28 1h0h s SER 581 Ca 0.00 -0.87 0.02 0.00 0.48 0.00 0.00 55.95 55.58 1h0h s SER 581 Cb 0.00 -0.24 -0.01 0.00 0.10 0.00 0.00 66.02 65.87 1h0h s SER 581 CO 0.00 0.09 -0.07 0.27 0.98 0.00 0.00 173.24 174.51 1h0h s ILE 582 N -1.77 0.52 -0.25 -1.02 -4.36 -0.85 -0.41 121.20 113.06 1h0h s ILE 582 Ca 0.20 -0.57 -0.08 0.00 -0.26 0.00 0.00 60.65 59.94 1h0h s ILE 582 Cb -0.07 -0.49 -0.03 0.00 1.25 0.00 0.00 42.46 43.11 1h0h s ILE 582 CO 0.10 -0.05 0.09 -0.44 0.24 0.00 0.00 174.94 174.88 1h0h s SER 583 N -0.68 5.36 1.04 4.36 0.01 -1.26 -0.72 113.70 121.81 1h0h s SER 583 Ca -0.02 -0.14 -0.15 0.00 1.31 0.00 0.00 55.95 56.95 1h0h s SER 583 Cb -0.05 -1.97 0.20 0.00 0.21 0.00 0.00 66.02 64.41 1h0h s SER 583 CO 0.00 -0.02 1.09 -0.46 0.41 0.00 0.00 173.24 174.27 1h0h n ASN 584 N 4.82 -0.27 0.19 2.44 6.94 -0.36 -4.12 115.26 124.89 1h0h n ASN 584 Ca -0.16 -1.35 0.07 0.00 -0.02 0.00 0.00 54.58 53.13 1h0h n ASN 584 Cb 0.52 -0.86 0.58 0.00 -2.36 0.00 0.00 39.78 37.66 1h0h n ASN 584 CO 0.00 0.00 0.00 -1.28 -1.03 0.00 0.00 177.26 174.95 1h0h h SER 585 N -1.66 0.12 -0.15 0.53 0.87 -1.48 -0.62 113.55 111.16 1h0h h SER 585 Ca -0.36 -0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.19 1h0h h SER 585 Cb 1.02 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 62.95 1h0h h SER 585 CO 0.25 0.09 0.00 0.61 -0.53 0.00 0.00 176.83 177.25 1h0h n GLY 586 N -1.52 -0.04 2.40 5.77 0.00 -1.26 -4.37 105.19 106.16 1h0h n GLY 586 Ca -0.01 -0.17 -0.11 0.00 0.00 0.00 0.00 46.02 45.73 1h0h n GLY 586 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1h0h n ARG 587 N -0.03 -0.92 -2.56 1.61 1.74 -0.24 -4.85 116.66 111.41 1h0h n ARG 587 Ca 0.05 0.86 -0.43 0.00 -0.77 0.00 0.00 57.85 57.56 1h0h n ARG 587 Cb 0.17 -4.87 -0.02 0.00 -1.02 0.00 0.00 32.46 26.71 1h0h n ARG 587 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 1h0h s TRP 588 N -2.32 2.96 -0.35 -1.55 0.52 -1.26 -2.11 118.94 114.82 1h0h s TRP 588 Ca 0.00 1.03 -0.25 0.00 0.02 0.00 0.00 56.10 56.91 1h0h s TRP 588 Cb 0.00 -3.85 0.01 0.00 -1.15 0.00 0.00 33.47 28.49 1h0h s TRP 588 CO 0.00 -1.15 0.86 1.41 0.02 0.00 0.00 176.95 178.10 1h0h s MET 589 N 3.91 3.84 -0.11 4.98 -2.45 0.14 -1.22 119.30 128.38 1h0h s MET 589 Ca 0.49 0.51 0.03 0.00 -1.25 0.00 0.00 55.69 55.47 1h0h s MET 589 Cb -0.13 -3.79 -0.00 0.00 1.25 0.00 0.00 34.83 32.16 1h0h s MET 589 CO 0.20 -0.87 -0.21 -0.65 1.05 0.00 0.00 175.02 174.54 1h0h s GLN 590 N 3.27 3.14 0.12 4.11 -0.21 0.10 -3.35 119.66 126.84 1h0h s GLN 590 Ca 0.35 -0.82 -0.29 0.00 0.02 0.00 0.00 55.36 54.63 1h0h s GLN 590 Cb -0.13 -2.42 -0.06 0.00 1.00 0.00 0.00 33.01 31.40 1h0h s GLN 590 CO 0.17 0.16 0.90 -0.46 -2.12 0.00 0.00 175.29 173.94 1h0h s TRP 591 N 0.42 3.83 0.18 0.91 -0.11 -0.32 -2.00 118.94 121.83 1h0h s TRP 591 Ca -0.15 1.73 0.10 0.00 1.22 0.00 0.00 56.10 59.00 1h0h s TRP 591 Cb -0.17 -2.97 -0.04 0.00 -1.50 0.00 0.00 33.47 28.78 1h0h s TRP 591 CO 0.07 0.28 -0.21 1.03 -4.62 0.00 0.00 176.95 173.49 1h0h s ARG 592 N -0.25 1.38 0.19 5.86 0.52 0.79 -4.86 118.95 122.58 1h0h s ARG 592 Ca 0.43 -1.45 0.08 0.00 -0.52 0.00 0.00 55.73 54.27 1h0h s ARG 592 Cb -0.23 -1.57 -0.04 0.00 0.52 0.00 0.00 34.95 33.63 1h0h s ARG 592 CO 0.28 0.33 -0.16 0.71 0.02 0.00 0.00 175.30 176.48 1h0h s TYR 593 N -1.84 1.78 0.05 -0.53 2.02 -1.11 -2.05 117.35 115.66 1h0h s TYR 593 Ca 0.18 -0.51 -0.31 0.00 -0.37 0.00 0.00 57.07 56.06 1h0h s TYR 593 Cb -0.07 -0.85 -0.06 0.00 -0.40 0.00 0.00 41.96 40.58 1h0h s TYR 593 CO 0.08 0.36 1.35 0.08 -1.57 0.00 0.00 175.55 175.85 1h0h s VAL 594 N -2.49 3.67 0.00 0.71 1.01 -1.20 -4.55 120.40 117.54 1h0h s VAL 594 Ca 0.19 1.14 0.00 0.00 0.00 0.00 0.00 61.98 63.31 1h0h s VAL 594 Cb -0.03 -3.73 0.00 0.00 0.00 0.00 0.00 36.38 32.62 1h0h s VAL 594 CO 0.07 0.04 0.00 0.61 0.00 0.00 0.00 175.10 175.82 1h0h n GLY 595 N 3.50 0.13 3.77 4.51 0.00 0.78 -4.93 105.19 112.96 1h0h n GLY 595 Ca 0.12 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.81 1h0h n GLY 595 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1h0h s PRO 596 N 0.56 2.76 0.75 1.61 0.04 -1.24 -4.92 135.00 134.55 1h0h s PRO 596 Ca 0.00 1.35 -0.11 0.00 0.04 0.00 0.00 61.00 62.27 1h0h s PRO 596 Cb 0.00 -1.95 0.04 0.00 0.04 0.00 0.00 34.50 32.63 1h0h s PRO 596 CO 0.00 -1.27 1.09 -1.83 0.04 0.00 0.00 177.00 175.03 1h0h s GLU 597 N -4.21 2.41 0.04 4.56 -1.05 -0.97 -4.22 118.70 115.25 1h0h s GLU 597 Ca 0.66 1.17 -0.35 0.00 -0.15 0.00 0.00 54.97 56.30 1h0h s GLU 597 Cb -0.20 -1.91 -0.14 0.00 -0.44 0.00 0.00 34.13 31.44 1h0h s GLU 597 CO 0.43 -1.53 1.62 -2.30 0.95 0.00 0.00 175.26 174.44 1h0h n PRO 598 N -3.33 1.85 -1.70 -4.83 -0.02 -1.26 -4.83 135.00 120.88 1h0h n PRO 598 Ca 0.09 0.67 -0.43 0.00 -2.02 0.00 0.00 63.50 61.81 1h0h n PRO 598 Cb 0.53 -2.43 -0.03 0.00 -0.02 0.00 0.00 33.50 31.55 1h0h n PRO 598 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 1h0h n ARG 599 N 4.26 2.68 -1.67 -0.52 0.63 -1.26 -4.66 116.66 116.12 1h0h n ARG 599 Ca 0.20 0.97 -0.46 0.00 -0.92 0.00 0.00 57.85 57.63 1h0h n ARG 599 Cb 0.25 -2.82 -0.04 0.00 0.45 0.00 0.00 32.46 30.30 1h0h n ARG 599 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 1h0h n LYS 600 N 4.37 2.10 -2.02 -0.14 4.76 -1.26 0.17 118.16 126.14 1h0h n LYS 600 Ca 0.17 0.76 -0.28 0.00 -2.87 0.00 0.00 58.31 56.09 1h0h n LYS 600 Cb 0.34 -2.52 0.03 0.00 -1.84 0.00 0.00 35.03 31.04 1h0h n LYS 600 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 1h0h n ASN 601 N 3.50 5.51 -4.76 4.39 3.02 0.64 -4.61 115.26 122.95 1h0h n ASN 601 Ca 0.17 -3.76 -0.34 0.00 -0.03 0.00 0.00 54.58 50.63 1h0h n ASN 601 Cb 0.28 -0.52 0.05 0.00 -0.61 0.00 0.00 39.78 38.98 1h0h n ASN 601 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1h0h s ALA 602 N -3.66 2.45 -0.03 5.41 0.00 0.13 -4.88 121.76 121.18 1h0h s ALA 602 Ca 0.53 0.72 0.05 0.00 0.00 0.00 0.00 51.96 53.25 1h0h s ALA 602 Cb 0.43 -3.37 -0.01 0.00 0.00 0.00 0.00 23.12 20.17 1h0h s ALA 602 CO -0.06 -1.29 -0.17 0.42 0.00 0.00 0.00 175.76 174.66 1h0h s ILE 603 N -2.07 1.38 0.64 0.00 1.01 -1.01 -4.68 121.20 116.47 1h0h s ILE 603 Ca 0.71 -0.71 -0.18 0.00 0.00 0.00 0.00 60.65 60.47 1h0h s ILE 603 Cb -0.24 -1.18 -0.01 0.00 0.01 0.00 0.00 42.46 41.04 1h0h s ILE 603 CO 0.38 0.40 1.24 -2.84 0.00 0.00 0.00 174.94 174.12 1h0h s PRO 604 N -0.09 2.66 0.24 2.79 0.02 -1.26 -2.75 135.00 136.61 1h0h s PRO 604 Ca -0.01 1.90 -0.05 0.00 0.02 0.00 0.00 61.00 62.87 1h0h s PRO 604 Cb -0.10 -1.88 0.42 0.00 0.02 0.00 0.00 34.50 32.96 1h0h s PRO 604 CO 0.01 -1.47 1.76 -0.44 -0.33 0.00 0.00 177.00 176.53 1h0h h ASP 605 N 0.53 0.44 -0.85 2.53 3.32 -1.97 -2.10 116.42 118.32 1h0h h ASP 605 Ca -0.50 0.08 0.08 0.00 0.02 0.00 0.00 57.03 56.71 1h0h h ASP 605 Cb 1.31 0.01 -0.07 0.00 0.22 0.00 0.00 39.33 40.81 1h0h h ASP 605 CO 0.53 0.22 0.51 1.23 -1.72 0.00 0.00 179.24 180.02 1h0h h GLY 606 N 0.57 1.30 1.62 2.75 0.00 -1.93 0.68 103.07 108.07 1h0h h GLY 606 Ca 0.40 -0.36 -0.17 0.00 0.00 0.00 0.00 47.33 47.19 1h0h h GLY 606 CO -0.33 0.21 -0.68 -0.55 0.00 0.00 0.00 176.54 175.19 1h0h h ASP 607 N 0.90 0.44 -0.56 0.19 3.32 -1.81 -0.99 116.42 117.91 1h0h h ASP 607 Ca 0.39 -0.28 0.01 0.00 0.02 0.00 0.00 57.03 57.17 1h0h h ASP 607 Cb 0.26 -0.13 -0.03 0.00 0.22 0.00 0.00 39.33 39.64 1h0h h ASP 607 CO -0.20 1.00 0.36 -0.07 -1.72 0.00 0.00 179.24 178.60 1h0h h LEU 608 N 0.27 0.61 -0.32 1.55 3.38 -0.63 0.17 115.31 120.33 1h0h h LEU 608 Ca -0.02 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 1h0h h LEU 608 Cb 1.24 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.84 1h0h h LEU 608 CO 0.12 0.43 0.09 0.40 0.09 0.00 0.00 178.44 179.57 1h0h h ILE 609 N 0.73 1.21 -0.33 1.22 2.04 -0.80 -0.96 117.51 120.61 1h0h h ILE 609 Ca 0.21 -0.69 0.04 0.00 1.00 0.00 0.00 64.86 65.43 1h0h h ILE 609 Cb -0.04 1.06 -0.04 0.00 -0.74 0.00 0.00 36.82 37.06 1h0h h ILE 609 CO -0.07 0.23 0.09 0.58 0.00 0.00 0.00 178.15 178.99 1h0h h VAL 610 N 0.36 0.88 -0.46 1.67 2.07 -0.96 0.91 116.25 120.70 1h0h h VAL 610 Ca 0.10 -0.08 -0.02 0.00 0.82 0.00 0.00 66.70 67.52 1h0h h VAL 610 Cb 0.27 0.63 -0.02 0.00 -1.52 0.00 0.00 31.29 30.65 1h0h h VAL 610 CO -0.00 0.04 0.20 -0.33 0.02 0.00 0.00 177.57 177.49 1h0h h GLU 611 N 0.22 0.69 -0.62 1.57 4.39 -0.33 -1.67 114.58 118.84 1h0h h GLU 611 Ca 0.15 -0.12 -0.09 0.00 0.34 0.00 0.00 59.36 59.64 1h0h h GLU 611 Cb 0.15 -0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 28.66 1h0h h GLU 611 CO -0.18 0.61 0.02 -0.07 -1.16 0.00 0.00 179.01 178.24 1h0h h LEU 612 N 0.61 1.05 -0.25 1.33 3.38 -0.96 -1.99 115.31 118.48 1h0h h LEU 612 Ca 0.16 -0.30 -0.03 0.00 0.09 0.00 0.00 57.88 57.80 1h0h h LEU 612 Cb 0.18 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 1h0h h LEU 612 CO -0.01 1.09 0.06 0.00 0.09 0.00 0.00 178.44 179.66 1h0h h ALA 613 N 1.00 0.33 -0.50 1.53 0.00 -0.56 -0.58 119.26 120.46 1h0h h ALA 613 Ca 0.18 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 1h0h h ALA 613 Cb 0.54 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 1h0h h ALA 613 CO 0.03 -0.01 0.17 0.87 0.00 0.00 0.00 179.25 180.31 1h0h h LYS 614 N 0.22 0.77 -0.59 0.00 1.57 -1.33 -0.22 116.57 117.00 1h0h h LYS 614 Ca 0.08 -0.16 -0.05 0.00 -1.87 0.00 0.00 60.65 58.65 1h0h h LYS 614 Cb 0.29 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.46 1h0h h LYS 614 CO 0.00 0.71 0.17 0.00 -0.57 0.00 0.00 179.45 179.76 1h0h h ARG 615 N 0.68 0.93 -0.41 3.15 3.08 -1.19 -1.65 114.38 118.97 1h0h h ARG 615 Ca 0.16 -0.21 -0.09 0.00 0.07 0.00 0.00 59.98 59.92 1h0h h ARG 615 Cb 0.25 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.15 1h0h h ARG 615 CO -0.01 0.84 -0.11 0.28 -1.07 0.00 0.00 179.97 179.90 1h0h h VAL 616 N 0.84 1.25 -0.69 2.04 2.07 -0.90 -1.54 116.25 119.32 1h0h h VAL 616 Ca 0.19 -1.15 -0.03 0.00 0.82 0.00 0.00 66.70 66.53 1h0h h VAL 616 Cb 0.31 1.06 -0.03 0.00 -1.52 0.00 0.00 31.29 31.11 1h0h h VAL 616 CO -0.00 0.39 0.32 1.56 0.02 0.00 0.00 177.57 179.86 1h0h h GLN 617 N 0.66 0.99 -0.34 1.57 4.20 -0.69 -1.45 115.11 120.05 1h0h h GLN 617 Ca 0.11 -0.14 -0.17 0.00 0.06 0.00 0.00 58.65 58.52 1h0h h GLN 617 Cb 0.58 -0.18 -0.00 0.00 0.30 0.00 0.00 27.48 28.17 1h0h h GLN 617 CO 0.04 0.77 -0.45 0.87 -0.67 0.00 0.00 178.83 179.39 1h0h h LYS 618 N 0.98 0.88 -0.31 1.46 1.57 -0.94 -0.51 116.57 119.71 1h0h h LYS 618 Ca 0.24 -0.50 0.02 0.00 -1.87 0.00 0.00 60.65 58.54 1h0h h LYS 618 Cb 0.11 0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.43 1h0h h LYS 618 CO -0.03 1.14 0.16 -0.07 -0.57 0.00 0.00 179.45 180.08 1h0h h LEU 619 N 0.71 0.24 -1.49 2.94 3.38 -0.86 -2.32 115.31 117.91 1h0h h LEU 619 Ca 0.04 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.00 1h0h h LEU 619 Cb 1.04 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.75 1h0h h LEU 619 CO 0.10 0.18 -0.14 -0.07 0.09 0.00 0.00 178.44 178.60 1h0h h LEU 620 N 0.33 0.00 -0.56 1.67 -0.00 -1.16 0.25 115.31 115.84 1h0h h LEU 620 Ca 0.13 0.00 -0.16 0.00 -0.00 0.00 0.00 57.88 57.85 1h0h h LEU 620 Cb 0.04 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 40.68 1h0h h LEU 620 CO -0.08 0.14 -0.66 0.00 -0.00 0.00 0.00 178.44 177.83 1h0h h ALA 621 N 1.86 0.76 0.08 1.53 0.00 -0.63 -2.77 119.26 120.09 1h0h h ALA 621 Ca -0.00 -0.58 -0.30 0.00 0.00 0.00 0.00 54.91 54.02 1h0h h ALA 621 Cb 0.55 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 1h0h h ALA 621 CO 0.02 0.76 -1.61 0.87 0.00 0.00 0.00 179.25 179.29 1h0h h LYS 622 N 0.19 0.17 -2.80 0.00 1.57 -0.94 -3.42 116.57 111.33 1h0h h LYS 622 Ca -0.01 -0.29 -0.60 0.00 -1.87 0.00 0.00 60.65 57.88 1h0h h LYS 622 Cb 1.20 0.11 -0.40 0.00 0.08 0.00 0.00 32.23 33.22 1h0h h LYS 622 CO 0.10 0.96 -0.79 0.99 -0.57 0.00 0.00 179.45 180.14 1h0h s THR 623 N -2.61 1.06 0.29 -0.16 2.01 0.03 -5.03 115.64 111.23 1h0h s THR 623 Ca -0.09 -2.52 0.20 0.00 0.31 0.00 0.00 61.69 59.59 1h0h s THR 623 Cb 0.07 -1.74 0.18 0.00 0.01 0.00 0.00 72.50 71.02 1h0h s THR 623 CO 0.83 -0.98 1.86 1.55 -0.69 0.00 0.00 174.62 177.19 1h0h h PRO 624 N 6.50 0.00 0.00 4.92 0.13 -1.74 -3.38 132.00 138.42 1h0h h PRO 624 Ca 0.07 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.20 1h0h h PRO 624 Cb 0.92 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.05 1h0h h PRO 624 CO 0.43 0.29 0.00 0.41 -0.23 0.00 0.00 178.00 178.90 1h0h n GLY 625 N -0.22 0.99 0.25 1.56 0.00 -1.26 -3.21 105.19 103.30 1h0h n GLY 625 Ca -0.01 -0.63 -0.08 0.00 0.00 0.00 0.00 46.02 45.30 1h0h n GLY 625 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1h0h h LYS 626 N 0.00 0.69 -1.32 1.61 1.57 -1.94 -3.41 116.57 113.77 1h0h h LYS 626 Ca 0.00 -0.33 -0.23 0.00 -1.87 0.00 0.00 60.65 58.22 1h0h h LYS 626 Cb 0.00 -0.01 -0.21 0.00 0.08 0.00 0.00 32.23 32.09 1h0h h LYS 626 CO 0.00 0.93 -0.59 -1.17 -0.57 0.00 0.00 179.45 178.06 1h0h s LEU 627 N -8.70 -0.85 0.28 2.94 2.96 -1.25 -5.01 118.68 109.06 1h0h s LEU 627 Ca -0.09 -1.84 0.15 0.00 -0.22 0.00 0.00 54.13 52.14 1h0h s LEU 627 Cb 0.12 1.39 0.14 0.00 0.50 0.00 0.00 46.19 48.34 1h0h s LEU 627 CO 0.84 -0.10 1.48 0.00 -1.32 0.00 0.00 176.35 177.24 1h0h h ALA 628 N 5.54 0.69 -0.48 5.97 0.00 -1.79 -3.40 119.26 125.79 1h0h h ALA 628 Ca 0.10 -0.48 0.09 0.00 0.00 0.00 0.00 54.91 54.62 1h0h h ALA 628 Cb 1.08 -0.08 -0.10 0.00 0.00 0.00 0.00 17.79 18.69 1h0h h ALA 628 CO 0.10 0.66 -0.27 0.00 0.00 0.00 0.00 179.25 179.74 1h0h h ALA 629 N 1.47 0.02 -0.79 0.00 0.00 -1.95 -0.53 119.26 117.48 1h0h h ALA 629 Ca -0.01 0.15 0.08 0.00 0.00 0.00 0.00 54.91 55.13 1h0h h ALA 629 Cb 1.34 0.63 -0.05 0.00 0.00 0.00 0.00 17.79 19.71 1h0h h ALA 629 CO 0.07 -0.62 0.52 -1.35 0.00 0.00 0.00 179.25 177.86 1h0h h PRO 630 N -0.16 0.78 0.22 0.00 0.11 -1.83 -0.80 132.00 130.32 1h0h h PRO 630 Ca 0.21 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 66.27 1h0h h PRO 630 Cb 0.51 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 31.44 1h0h h PRO 630 CO -0.57 0.52 -0.11 0.28 -0.21 0.00 0.00 178.00 177.91 1h0h h VAL 631 N 0.81 0.70 0.00 3.15 2.07 -1.16 -3.16 116.25 118.66 1h0h h VAL 631 Ca 0.35 -0.96 -0.10 0.00 0.82 0.00 0.00 66.70 66.81 1h0h h VAL 631 Cb 0.31 1.15 -0.01 0.00 -1.52 0.00 0.00 31.29 31.22 1h0h h VAL 631 CO -0.13 0.17 -0.45 0.71 0.02 0.00 0.00 177.57 177.89 1h0h h THR 632 N -0.88 1.11 -0.00 2.57 1.35 -1.11 -3.09 112.91 112.87 1h0h h THR 632 Ca -0.03 -1.68 0.00 0.00 -0.55 0.00 0.00 66.41 64.15 1h0h h THR 632 Cb 0.51 1.96 0.00 0.00 -1.73 0.00 0.00 68.15 68.89 1h0h h THR 632 CO 0.05 0.45 -0.39 0.29 -0.25 0.00 0.00 175.52 175.66 1h0h n LYS 633 N -3.69 0.12 -1.67 4.72 5.02 -0.32 -4.86 118.16 117.48 1h0h n LYS 633 Ca -0.01 -0.06 -0.46 0.00 -2.02 0.00 0.00 58.31 55.76 1h0h n LYS 633 Cb 0.53 -1.50 -0.04 0.00 -0.02 0.00 0.00 35.03 34.00 1h0h n LYS 633 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 1h0h n LEU 634 N -1.38 3.14 -4.11 -0.35 7.94 -1.17 -4.72 117.00 116.34 1h0h n LEU 634 Ca 0.07 1.07 -0.42 0.00 -1.11 0.00 0.00 56.01 55.62 1h0h n LEU 634 Cb 0.33 -1.42 0.00 0.00 0.53 0.00 0.00 43.42 42.86 1h0h n LEU 634 CO 0.33 -0.26 2.32 1.17 -1.11 0.00 0.00 177.39 179.83 1h0h n LYS 635 N 3.71 3.05 0.24 1.96 3.00 -0.20 -4.71 118.16 125.21 1h0h n LYS 635 Ca 0.17 -2.96 0.16 0.00 -0.00 0.00 0.00 58.31 55.68 1h0h n LYS 635 Cb 0.29 -3.35 0.56 0.00 0.00 0.00 0.00 35.03 32.52 1h0h n LYS 635 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.40 179.19 1h0h h THR 636 N 4.66 0.00 -0.04 3.15 1.35 -1.88 -2.75 112.91 117.39 1h0h h THR 636 Ca 0.50 -0.57 0.01 0.00 -0.55 0.00 0.00 66.41 65.80 1h0h h THR 636 Cb 0.74 1.54 -0.00 0.00 -1.73 0.00 0.00 68.15 68.70 1h0h h THR 636 CO 1.68 0.00 0.04 0.44 -0.25 0.00 0.00 175.52 177.43 1h0h h ASP 637 N 0.00 0.00 0.34 5.36 3.32 -1.93 0.11 116.42 123.61 1h0h h ASP 637 Ca 0.00 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 1h0h h ASP 637 Cb 0.60 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.15 1h0h h ASP 637 CO 0.00 0.00 -0.05 1.88 -1.72 0.00 0.00 179.24 179.35 1h0h h TYR 638 N 0.00 0.00 0.00 4.55 0.05 -1.89 -3.11 116.97 116.56 1h0h h TYR 638 Ca 0.02 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.80 1h0h h TYR 638 Cb 0.10 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.84 1h0h h TYR 638 CO 0.00 0.05 -0.79 0.91 -1.05 0.00 0.00 178.16 177.28 1h0h n TRP 639 N -3.39 0.44 -4.35 4.88 8.01 0.38 -4.22 117.44 119.18 1h0h n TRP 639 Ca -0.02 0.13 -0.21 0.00 -1.31 0.00 0.00 57.50 56.09 1h0h n TRP 639 Cb 0.18 -0.57 -0.11 0.00 -2.01 0.00 0.00 31.31 28.80 1h0h n TRP 639 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.69 176.82 1h0h s VAL 640 N -3.18 1.89 0.79 -0.99 -7.23 -1.18 -1.04 120.40 109.46 1h0h s VAL 640 Ca 0.05 -2.05 -0.12 0.00 -1.81 0.00 0.00 61.98 58.05 1h0h s VAL 640 Cb 0.14 -1.95 0.18 0.00 0.56 0.00 0.00 36.38 35.30 1h0h s VAL 640 CO 0.75 -0.39 1.07 -0.46 -0.31 0.00 0.00 175.10 175.76 1h0h n ASN 641 N 0.02 0.22 0.00 4.85 0.23 -0.17 -4.86 115.26 115.56 1h0h n ASN 641 Ca -0.11 -1.47 0.04 0.00 -0.53 0.00 0.00 54.58 52.51 1h0h n ASN 641 Cb 0.58 -0.81 0.18 0.00 -2.08 0.00 0.00 39.78 37.65 1h0h n ASN 641 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 1h0h n ASP 642 N -3.61 0.00 -1.04 0.53 8.00 -1.26 -0.83 116.55 118.34 1h0h n ASP 642 Ca 0.14 0.40 0.11 0.00 0.71 0.00 0.00 54.79 56.15 1h0h n ASP 642 Cb 0.48 -0.44 0.19 0.00 -0.02 0.00 0.00 41.12 41.33 1h0h n ASP 642 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 1h0h n HIS 643 N -1.44 0.41 -1.01 1.24 8.25 -1.26 -4.96 115.22 116.46 1h0h n HIS 643 Ca 0.02 -0.23 -0.00 0.00 -0.26 0.00 0.00 57.72 57.25 1h0h n HIS 643 Cb 0.08 -0.00 -0.00 0.00 1.12 0.00 0.00 29.99 31.19 1h0h n HIS 643 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1h0h n GLY 644 N 1.33 0.46 3.90 -1.41 0.00 -0.01 -5.04 105.19 104.42 1h0h n GLY 644 Ca 0.17 -0.45 -0.32 0.00 0.00 0.00 0.00 46.02 45.42 1h0h n GLY 644 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1h0h s HIS 645 N -1.99 3.50 -0.10 1.61 3.76 -1.26 -4.81 115.29 115.99 1h0h s HIS 645 Ca 0.00 0.27 -0.40 0.00 -0.15 0.00 0.00 55.06 54.79 1h0h s HIS 645 Cb 0.00 -1.77 -0.18 0.00 1.11 0.00 0.00 32.58 31.74 1h0h s HIS 645 CO 0.00 0.60 1.42 0.34 -0.85 0.00 0.00 174.74 176.26 1h0h n PHE 646 N 0.58 1.51 -3.97 1.40 7.35 -1.26 -1.00 117.46 122.07 1h0h n PHE 646 Ca -0.08 0.76 -0.31 0.00 -0.76 0.00 0.00 57.45 57.06 1h0h n PHE 646 Cb 0.52 -2.30 -0.15 0.00 0.35 0.00 0.00 39.48 37.89 1h0h n PHE 646 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 1h0h s ASP 647 N 1.49 4.47 0.44 -2.13 -1.08 -0.21 -4.78 116.67 114.87 1h0h s ASP 647 Ca 0.92 -1.82 0.18 0.00 -0.52 0.00 0.00 52.55 51.31 1h0h s ASP 647 Cb -1.12 -1.43 1.01 0.00 -1.46 0.00 0.00 42.92 39.92 1h0h s ASP 647 CO 0.58 -0.34 1.94 1.55 0.52 0.00 0.00 175.17 179.42 1h0h h PRO 648 N 7.76 0.00 -0.20 4.34 0.13 -1.85 -1.48 132.00 140.70 1h0h h PRO 648 Ca -0.10 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.93 1h0h h PRO 648 Cb 1.03 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.16 1h0h h PRO 648 CO 0.49 0.25 -0.26 0.45 -0.23 0.00 0.00 178.00 178.69 1h0h h HIS 649 N 0.00 0.66 -0.50 1.56 3.86 -1.95 0.38 115.15 119.16 1h0h h HIS 649 Ca -0.00 -0.21 -0.01 0.00 -1.16 0.00 0.00 60.37 58.98 1h0h h HIS 649 Cb 0.49 -0.13 -0.02 0.00 1.06 0.00 0.00 27.41 28.80 1h0h h HIS 649 CO 0.00 0.92 0.26 0.87 0.86 0.00 0.00 177.93 180.84 1h0h h LYS 650 N 0.21 0.71 -0.51 2.45 1.57 -1.82 -0.52 116.57 118.65 1h0h h LYS 650 Ca 0.02 -0.09 -0.04 0.00 -1.87 0.00 0.00 60.65 58.67 1h0h h LYS 650 Cb 0.83 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.99 1h0h h LYS 650 CO 0.06 0.57 0.17 0.82 -0.57 0.00 0.00 179.45 180.50 1h0h h ILE 651 N 0.66 1.23 -0.42 1.86 2.04 -1.22 -1.87 117.51 119.78 1h0h h ILE 651 Ca 0.17 -0.76 -0.00 0.00 1.00 0.00 0.00 64.86 65.27 1h0h h ILE 651 Cb 0.08 0.75 -0.02 0.00 -0.74 0.00 0.00 36.82 36.89 1h0h h ILE 651 CO -0.03 0.28 0.25 0.00 0.00 0.00 0.00 178.15 178.65 1h0h h ALA 652 N 1.03 1.64 -0.11 1.87 0.00 -0.68 0.24 119.26 123.26 1h0h h ALA 652 Ca 0.17 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.91 1h0h h ALA 652 Cb 0.26 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1h0h h ALA 652 CO -0.01 0.31 -0.45 0.87 0.00 0.00 0.00 179.25 179.97 1h0h h LYS 653 N 0.58 0.25 -0.27 0.00 1.57 -0.62 -1.75 116.57 116.34 1h0h h LYS 653 Ca 0.15 -0.13 -0.14 0.00 -1.87 0.00 0.00 60.65 58.67 1h0h h LYS 653 Cb -0.01 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.30 1h0h h LYS 653 CO -0.03 0.66 -0.36 1.25 -0.57 0.00 0.00 179.45 180.40 1h0h h LEU 654 N 0.21 0.79 -0.37 2.94 5.85 -0.53 0.38 115.31 124.57 1h0h h LEU 654 Ca 0.01 -0.50 0.01 0.00 0.84 0.00 0.00 57.88 58.24 1h0h h LEU 654 Cb 0.89 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.67 1h0h h LEU 654 CO 0.07 1.13 0.23 0.40 -0.34 0.00 0.00 178.44 179.94 1h0h h ILE 655 N 0.46 1.07 -0.15 4.05 2.04 -0.89 0.74 117.51 124.83 1h0h h ILE 655 Ca 0.03 -0.16 0.00 0.00 1.00 0.00 0.00 64.86 65.73 1h0h h ILE 655 Cb 0.95 0.56 -0.01 0.00 -0.74 0.00 0.00 36.82 37.57 1h0h h ILE 655 CO 0.08 0.09 0.10 -1.13 0.00 0.00 0.00 178.15 177.29 1h0h h ASN 656 N 0.47 0.17 -3.78 1.72 -1.24 -1.23 -2.34 115.58 109.36 1h0h h ASN 656 Ca 0.14 -0.01 0.00 0.00 0.71 0.00 0.00 56.30 57.14 1h0h h ASN 656 Cb -0.03 -0.04 0.00 0.00 0.73 0.00 0.00 38.32 38.98 1h0h h ASN 656 CO -0.05 0.13 0.00 0.61 -1.29 0.00 0.00 177.43 176.83 1h0h n GLY 657 N -1.12 2.50 3.21 1.57 0.00 0.13 -4.23 105.19 107.24 1h0h n GLY 657 Ca -0.04 -1.70 -0.12 0.00 0.00 0.00 0.00 46.02 44.16 1h0h n GLY 657 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1h0h s PHE 658 N -1.76 1.13 0.14 1.61 -0.12 -1.19 -0.94 117.98 116.85 1h0h s PHE 658 Ca 0.00 -1.28 -0.30 0.00 -0.05 0.00 0.00 56.93 55.30 1h0h s PHE 658 Cb 0.00 -0.60 -0.07 0.00 -0.63 0.00 0.00 43.02 41.72 1h0h s PHE 658 CO 0.00 -0.52 1.19 0.00 -0.05 0.00 0.00 175.22 175.84 1h0h s ALA 659 N -4.02 3.42 -0.32 1.99 0.00 -0.18 -0.78 121.76 121.87 1h0h s ALA 659 Ca 0.33 0.91 0.23 0.00 0.00 0.00 0.00 51.96 53.43 1h0h s ALA 659 Cb 0.07 -3.42 -0.01 0.00 0.00 0.00 0.00 23.12 19.76 1h0h s ALA 659 CO 0.08 -0.38 0.98 1.28 0.00 0.00 0.00 175.76 177.72 1h0h n LEU 660 N 3.00 0.65 -3.86 0.00 4.77 0.13 -0.83 117.00 120.86 1h0h n LEU 660 Ca 0.06 0.20 -0.10 0.00 -0.03 0.00 0.00 56.01 56.14 1h0h n LEU 660 Cb 0.45 -0.07 -0.06 0.00 -2.33 0.00 0.00 43.42 41.42 1h0h n LEU 660 CO 0.56 -0.10 0.11 -1.59 -1.33 0.00 0.00 177.39 175.03 1h0h s LYS 661 N -3.33 1.25 0.44 3.23 -2.85 -1.21 -4.82 119.74 112.45 1h0h s LYS 661 Ca -0.00 -1.04 -0.25 0.00 -1.00 0.00 0.00 55.97 53.68 1h0h s LYS 661 Cb 0.12 0.44 -0.08 0.00 -2.06 0.00 0.00 37.83 36.25 1h0h s LYS 661 CO 0.80 -0.49 1.28 -0.51 0.10 0.00 0.00 175.35 176.54 1h0h s ASP 662 N -2.92 6.12 0.21 0.03 1.01 -1.26 -3.99 116.67 115.87 1h0h s ASP 662 Ca 0.13 2.60 -0.22 0.00 0.71 0.00 0.00 52.55 55.77 1h0h s ASP 662 Cb 0.01 -2.63 0.05 0.00 1.01 0.00 0.00 42.92 41.36 1h0h s ASP 662 CO -0.01 -0.97 0.67 0.72 0.21 0.00 0.00 175.17 175.78 1h0h s PHE 663 N -1.32 -0.37 0.03 4.23 -0.71 -0.53 -4.95 117.98 114.36 1h0h s PHE 663 Ca 0.60 0.05 0.07 0.00 -1.04 0.00 0.00 56.93 56.62 1h0h s PHE 663 Cb -0.37 0.63 -0.02 0.00 -1.21 0.00 0.00 43.02 42.05 1h0h s PHE 663 CO 0.46 -1.02 -0.21 0.21 -1.34 0.00 0.00 175.22 173.32 1h0h s LYS 664 N -3.81 1.50 -0.16 1.99 2.20 -1.26 -0.32 119.74 119.88 1h0h s LYS 664 Ca 0.06 -0.91 -0.05 0.00 -0.36 0.00 0.00 55.97 54.71 1h0h s LYS 664 Cb -0.03 -1.58 0.06 0.00 -1.51 0.00 0.00 37.83 34.76 1h0h s LYS 664 CO -0.04 0.41 0.10 0.54 -0.36 0.00 0.00 175.35 176.00 1h0h s VAL 665 N -0.73 -0.10 0.00 4.02 0.11 0.12 -5.00 120.40 118.82 1h0h s VAL 665 Ca 0.08 -0.12 0.00 0.00 -2.93 0.00 0.00 61.98 59.01 1h0h s VAL 665 Cb -0.09 -0.55 0.00 0.00 -1.53 0.00 0.00 36.38 34.22 1h0h s VAL 665 CO 0.01 -0.24 0.00 0.61 -3.33 0.00 0.00 175.10 172.15 1h0h n GLY 666 N 5.28 2.78 0.00 6.54 0.00 -1.26 -1.21 105.19 117.33 1h0h n GLY 666 Ca -0.07 -0.24 0.12 0.00 0.00 0.00 0.00 46.02 45.83 1h0h n GLY 666 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1h0h n ASP 667 N 6.79 0.56 -4.73 1.61 8.00 -1.26 -4.92 116.55 122.60 1h0h n ASP 667 Ca 0.00 -0.34 -0.39 0.00 0.71 0.00 0.00 54.79 54.77 1h0h n ASP 667 Cb 0.00 0.35 -0.05 0.00 -0.02 0.00 0.00 41.12 41.39 1h0h n ASP 667 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1h0h s VAL 668 N -3.00 5.05 -0.08 2.53 1.01 -0.35 -5.06 120.40 120.50 1h0h s VAL 668 Ca 0.10 1.24 0.01 0.00 0.00 0.00 0.00 61.98 63.33 1h0h s VAL 668 Cb 0.17 -3.94 -0.03 0.00 0.00 0.00 0.00 36.38 32.58 1h0h s VAL 668 CO 0.72 0.32 -0.08 -1.61 0.00 0.00 0.00 175.10 174.45 1h0h s GLU 669 N 0.47 2.90 0.06 2.72 2.02 -1.26 0.14 118.70 125.75 1h0h s GLU 669 Ca 0.32 -0.58 0.09 0.00 0.02 0.00 0.00 54.97 54.82 1h0h s GLU 669 Cb -0.17 -2.60 -0.03 0.00 0.10 0.00 0.00 34.13 31.42 1h0h s GLU 669 CO 0.15 0.55 -0.25 0.71 0.02 0.00 0.00 175.26 176.44 1h0h s TYR 670 N -0.51 2.21 0.04 1.61 2.02 0.56 -5.00 117.35 118.27 1h0h s TYR 670 Ca 0.07 -0.40 0.04 0.00 -0.37 0.00 0.00 57.07 56.42 1h0h s TYR 670 Cb -0.12 -1.29 -0.04 0.00 -0.40 0.00 0.00 41.96 40.11 1h0h s TYR 670 CO 0.02 0.16 -0.05 0.15 -1.57 0.00 0.00 175.55 174.26 1h0h s LYS 671 N -1.41 2.50 0.05 -0.62 -0.14 -1.26 -1.45 119.74 117.41 1h0h s LYS 671 Ca 0.11 -0.79 -0.37 0.00 -1.36 0.00 0.00 55.97 53.56 1h0h s LYS 671 Cb -0.10 -2.49 -0.17 0.00 -1.68 0.00 0.00 37.83 33.39 1h0h s LYS 671 CO 0.03 0.57 1.36 0.00 -0.76 0.00 0.00 175.35 176.55 1h0h n ALA 672 N 1.13 -1.04 0.00 5.17 0.00 -1.26 -1.44 120.51 123.08 1h0h n ALA 672 Ca -0.14 0.51 0.00 0.00 0.00 0.00 0.00 53.44 53.81 1h0h n ALA 672 Cb 0.52 -2.07 0.00 0.00 0.00 0.00 0.00 19.45 17.90 1h0h n ALA 672 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1h0h n GLY 673 N 2.61 1.86 3.78 0.00 0.00 -0.01 -4.97 105.19 108.46 1h0h n GLY 673 Ca 0.19 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.84 1h0h n GLY 673 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1h0h s GLN 674 N -0.98 4.55 0.34 1.61 -0.21 -0.52 -4.72 119.66 119.73 1h0h s GLN 674 Ca 0.00 1.30 -0.28 0.00 0.02 0.00 0.00 55.36 56.40 1h0h s GLN 674 Cb 0.00 -2.77 -0.10 0.00 1.00 0.00 0.00 33.01 31.14 1h0h s GLN 674 CO 0.00 0.27 1.22 -0.65 -2.12 0.00 0.00 175.29 174.01 1h0h s GLN 675 N -2.11 4.33 0.19 2.91 -1.52 -1.26 -1.01 119.66 121.19 1h0h s GLN 675 Ca 0.50 2.02 -0.30 0.00 -1.95 0.00 0.00 55.36 55.64 1h0h s GLN 675 Cb -0.18 -2.98 -0.08 0.00 -0.22 0.00 0.00 33.01 29.55 1h0h s GLN 675 CO 0.23 -0.14 0.97 0.42 -0.25 0.00 0.00 175.29 176.52 1h0h s ILE 676 N -1.22 4.17 0.11 1.08 -1.09 -0.12 -4.46 121.20 119.67 1h0h s ILE 676 Ca 0.50 2.00 0.05 0.00 -2.23 0.00 0.00 60.65 60.97 1h0h s ILE 676 Cb -0.36 -4.27 -0.22 0.00 -1.58 0.00 0.00 42.46 36.03 1h0h s ILE 676 CO 0.46 0.40 1.26 0.00 -1.23 0.00 0.00 174.94 175.84 1h0h h ALA 677 N 4.74 0.31 -2.74 9.38 0.00 -1.94 -3.37 119.26 125.65 1h0h h ALA 677 Ca -0.44 -0.91 -0.05 0.00 0.00 0.00 0.00 54.91 53.51 1h0h h ALA 677 Cb 1.21 -0.14 -0.13 0.00 0.00 0.00 0.00 17.79 18.73 1h0h h ALA 677 CO 0.70 1.21 -0.03 -0.08 0.00 0.00 0.00 179.25 181.05 1h0h s THR 678 N -2.70 0.06 -0.46 0.00 -1.32 -1.26 -3.57 115.64 106.38 1h0h s THR 678 Ca 0.00 -0.46 0.22 0.00 -1.21 0.00 0.00 61.69 60.24 1h0h s THR 678 Cb 0.10 -1.11 0.23 0.00 -1.51 0.00 0.00 72.50 70.21 1h0h s THR 678 CO 0.83 -0.25 1.67 2.22 -2.21 0.00 0.00 174.62 176.88 1h0h n PHE 679 N -0.11 0.73 0.32 9.09 1.16 -1.22 -1.60 117.46 125.82 1h0h n PHE 679 Ca -0.17 0.31 0.21 0.00 -1.87 0.00 0.00 57.45 55.93 1h0h n PHE 679 Cb 0.63 -1.00 1.08 0.00 -1.61 0.00 0.00 39.48 38.59 1h0h n PHE 679 CO 0.00 0.00 0.00 0.78 -1.87 0.00 0.00 176.76 175.67 1h0h h GLY 680 N 1.77 0.00 -1.67 4.97 0.00 -1.95 -2.69 103.07 103.50 1h0h h GLY 680 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1h0h h GLY 680 CO 0.00 0.00 -0.07 1.42 0.00 0.00 0.00 176.54 177.89 1h0h n HIS 681 N -3.16 0.00 -1.58 5.60 8.25 -0.63 -4.99 115.22 118.71 1h0h n HIS 681 Ca -0.02 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.11 1h0h n HIS 681 Cb 0.12 -0.00 0.07 0.00 1.12 0.00 0.00 29.99 31.30 1h0h n HIS 681 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1h0h s LEU 682 N -2.07 3.31 -0.06 2.41 1.43 -1.02 -5.00 118.68 117.68 1h0h s LEU 682 Ca 0.27 2.08 0.04 0.00 -1.03 0.00 0.00 54.13 55.50 1h0h s LEU 682 Cb 0.20 -4.56 -0.02 0.00 0.03 0.00 0.00 46.19 41.84 1h0h s LEU 682 CO 0.34 -1.90 -0.20 -1.10 0.23 0.00 0.00 176.35 173.72 1h0h s GLN 683 N -4.15 2.61 0.31 1.70 -1.52 -1.26 -4.90 119.66 112.46 1h0h s GLN 683 Ca 0.68 -0.80 0.26 0.00 -1.95 0.00 0.00 55.36 53.55 1h0h s GLN 683 Cb -0.22 -2.30 0.93 0.00 -0.22 0.00 0.00 33.01 31.19 1h0h s GLN 683 CO 0.44 0.46 1.77 0.00 -0.25 0.00 0.00 175.29 177.71 1h0h h ALA 684 N 5.85 1.00 -0.16 6.09 0.00 -1.80 -3.34 119.26 126.91 1h0h h ALA 684 Ca -0.37 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.54 1h0h h ALA 684 Cb 1.17 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1h0h h ALA 684 CO 0.50 0.00 0.00 -0.40 0.00 0.00 0.00 179.25 179.35 1h0h n ASP 685 N -2.48 2.02 0.00 0.00 5.68 -1.26 -4.78 116.55 115.74 1h0h n ASP 685 Ca 0.03 -1.73 0.00 0.00 -0.50 0.00 0.00 54.79 52.59 1h0h n ASP 685 Cb 0.34 -0.10 0.00 0.00 -1.14 0.00 0.00 41.12 40.22 1h0h n ASP 685 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1h0h n GLY 686 N 1.22 0.61 0.23 6.12 0.00 -1.25 -4.97 105.19 107.14 1h0h n GLY 686 Ca 0.17 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.34 1h0h n GLY 686 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1h0h h SER 687 N 0.00 0.00 -4.28 1.61 0.02 -1.91 -3.45 113.55 105.54 1h0h h SER 687 Ca 0.00 0.00 -0.47 0.00 -0.84 0.00 0.00 61.79 60.48 1h0h h SER 687 Cb 0.00 0.00 -0.21 0.00 0.14 0.00 0.00 62.40 62.33 1h0h h SER 687 CO 0.00 0.00 -0.79 0.42 -1.14 0.00 0.00 176.83 175.32 1h0h s THR 688 N -3.53 1.37 0.44 -2.27 -4.23 -1.26 0.22 115.64 106.38 1h0h s THR 688 Ca 0.03 -1.47 0.05 0.00 -1.18 0.00 0.00 61.69 59.12 1h0h s THR 688 Cb 0.09 -1.33 0.01 0.00 1.34 0.00 0.00 72.50 72.61 1h0h s THR 688 CO 0.51 -0.20 0.61 0.42 -0.54 0.00 0.00 174.62 175.42 1h0h s THR 689 N -1.39 3.32 0.00 3.99 -4.23 0.04 -4.13 115.64 113.25 1h0h s THR 689 Ca 0.03 -0.84 0.00 0.00 -1.18 0.00 0.00 61.69 59.70 1h0h s THR 689 Cb -0.09 -3.17 0.00 0.00 1.34 0.00 0.00 72.50 70.58 1h0h s THR 689 CO 0.03 -0.09 0.00 -0.24 -0.54 0.00 0.00 174.62 173.79 1h0h n SER 690 N -1.95 0.00 0.21 3.99 2.88 -0.99 -3.20 113.62 114.56 1h0h n SER 690 Ca 0.05 0.00 0.05 0.00 -1.33 0.00 0.00 58.87 57.64 1h0h n SER 690 Cb 0.59 0.00 0.47 0.00 -0.75 0.00 0.00 64.21 64.52 1h0h n SER 690 CO 0.00 0.00 0.00 1.23 -1.23 0.00 0.00 175.04 175.04 1h0h h GLY 691 N 0.00 0.00 -6.26 0.46 0.00 -0.36 -3.04 103.07 93.88 1h0h h GLY 691 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.21 1h0h h GLY 691 CO 0.00 0.00 -0.48 0.00 0.00 0.00 0.00 176.54 176.06 1h0h h TRP 693 N 8.12 0.26 0.00 0.00 5.08 -1.80 0.26 115.95 127.87 1h0h h TRP 693 Ca -0.10 0.01 0.00 0.00 1.08 0.00 0.00 58.89 59.87 1h0h h TRP 693 Cb 1.14 -0.08 0.00 0.00 -3.00 0.00 0.00 29.16 27.22 1h0h h TRP 693 CO 0.23 0.10 0.00 0.44 -1.28 0.00 0.00 178.44 177.93 1h0h n ILE 694 N -4.43 1.05 1.20 0.12 -5.35 -1.26 -1.76 119.36 108.93 1h0h n ILE 694 Ca 0.12 0.37 0.13 0.00 -0.27 0.00 0.00 62.75 63.10 1h0h n ILE 694 Cb 0.55 -1.29 0.26 0.00 -1.74 0.00 0.00 39.64 37.42 1h0h n ILE 694 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 1h0h n TYR 695 N -1.99 0.00 -2.06 4.28 4.01 0.08 -4.52 117.16 116.95 1h0h n TYR 695 Ca 0.01 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.33 1h0h n TYR 695 Cb 0.15 -0.01 -0.03 0.00 -0.31 0.00 0.00 39.34 39.14 1h0h n TYR 695 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 1h0h s THR 696 N -2.07 3.66 0.00 -0.72 2.01 -0.72 -0.39 115.64 117.40 1h0h s THR 696 Ca 0.31 0.78 0.00 0.00 0.31 0.00 0.00 61.69 63.09 1h0h s THR 696 Cb 0.20 -3.56 0.00 0.00 0.01 0.00 0.00 72.50 69.16 1h0h s THR 696 CO 0.35 -0.13 0.00 0.61 -0.69 0.00 0.00 174.62 174.77 1h0h n GLY 697 N 4.26 2.05 0.11 4.40 0.00 -1.23 -3.46 105.19 111.32 1h0h n GLY 697 Ca 0.18 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.17 1h0h n GLY 697 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1h0h h SER 698 N 0.00 0.00 -1.99 1.61 4.64 -1.03 -3.42 113.55 113.36 1h0h h SER 698 Ca 0.00 0.00 -0.37 0.00 -0.47 0.00 0.00 61.79 60.95 1h0h h SER 698 Cb 0.00 0.00 -0.31 0.00 -0.31 0.00 0.00 62.40 61.78 1h0h h SER 698 CO 0.00 0.74 -0.68 -0.47 -0.87 0.00 0.00 176.83 175.55 1h0h s TYR 699 N -3.26 -0.29 0.00 4.77 6.14 -1.26 -0.91 117.35 122.54 1h0h s TYR 699 Ca -0.00 -0.76 0.00 0.00 0.64 0.00 0.00 57.07 56.95 1h0h s TYR 699 Cb 0.11 -0.43 0.00 0.00 0.42 0.00 0.00 41.96 42.07 1h0h s TYR 699 CO 0.78 -0.96 0.00 0.25 0.64 0.00 0.00 175.55 176.26 1h0h n THR 700 N 4.37 0.00 0.29 4.34 -2.24 -0.81 -4.78 114.28 115.45 1h0h n THR 700 Ca 0.09 0.00 0.15 0.00 -2.27 0.00 0.00 64.05 62.03 1h0h n THR 700 Cb 0.45 -0.36 0.86 0.00 -2.10 0.00 0.00 70.33 69.18 1h0h n THR 700 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1h0h h GLU 701 N 0.00 0.00 -0.01 -0.78 4.39 -1.88 -1.37 114.58 114.93 1h0h h GLU 701 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1h0h h GLU 701 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 1h0h h GLU 701 CO 0.00 0.06 -0.02 1.63 -1.16 0.00 0.00 179.01 179.52 1h0h n LYS 702 N -3.61 1.53 0.00 2.33 4.76 -1.26 -5.04 118.16 116.87 1h0h n LYS 702 Ca -0.02 -0.83 0.00 0.00 -2.87 0.00 0.00 58.31 54.59 1h0h n LYS 702 Cb 0.16 -1.48 0.00 0.00 -1.84 0.00 0.00 35.03 31.87 1h0h n LYS 702 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1h0h n GLY 703 N 1.17 0.02 3.50 0.72 0.00 -0.52 -4.95 105.19 105.13 1h0h n GLY 703 Ca 0.19 -2.28 -0.42 0.00 0.00 0.00 0.00 46.02 43.51 1h0h n GLY 703 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1h0h s ASN 704 N -3.33 6.17 0.46 1.61 3.84 -1.26 -1.92 114.94 120.51 1h0h s ASN 704 Ca 0.00 -0.75 0.24 0.00 0.21 0.00 0.00 52.86 52.56 1h0h s ASN 704 Cb 0.00 -2.48 1.07 0.00 -0.55 0.00 0.00 41.25 39.28 1h0h s ASN 704 CO 0.00 -1.62 1.90 0.24 -2.79 0.00 0.00 177.10 174.83 1h0h h MET 705 N 9.78 0.00 0.00 0.43 2.86 -1.35 -2.47 114.93 124.18 1h0h h MET 705 Ca -0.28 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.36 1h0h h MET 705 Cb 1.06 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.72 1h0h h MET 705 CO 1.23 0.22 0.00 0.00 1.06 0.00 0.00 176.91 179.42 1h0h n ALA 706 N -2.27 1.84 1.18 6.32 0.00 -1.25 -2.50 120.51 123.83 1h0h n ALA 706 Ca -0.01 0.04 0.12 0.00 0.00 0.00 0.00 53.44 53.60 1h0h n ALA 706 Cb 0.37 -1.40 0.25 0.00 0.00 0.00 0.00 19.45 18.67 1h0h n ALA 706 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1h0h n ALA 707 N -1.75 3.16 -1.77 0.00 0.00 -0.93 -1.18 120.51 118.05 1h0h n ALA 707 Ca 0.03 -0.50 -0.39 0.00 0.00 0.00 0.00 53.44 52.58 1h0h n ALA 707 Cb 0.28 -1.01 -0.00 0.00 0.00 0.00 0.00 19.45 18.72 1h0h n ALA 707 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1h0h s ARG 708 N -2.43 3.87 -0.28 0.00 0.52 -1.04 -4.88 118.95 114.72 1h0h s ARG 708 Ca 0.24 2.12 0.19 0.00 -0.52 0.00 0.00 55.73 57.75 1h0h s ARG 708 Cb 0.19 -2.67 0.49 0.00 0.52 0.00 0.00 34.95 33.48 1h0h s ARG 708 CO 0.51 -0.56 1.11 0.54 0.02 0.00 0.00 175.30 176.92 1h0h n ARG 709 N -0.05 2.10 -3.26 3.54 1.74 -1.24 -0.58 116.66 118.91 1h0h n ARG 709 Ca 0.05 -3.64 -0.41 0.00 -0.77 0.00 0.00 57.85 53.07 1h0h n ARG 709 Cb 0.44 -1.72 -0.08 0.00 -1.02 0.00 0.00 32.46 30.08 1h0h n ARG 709 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1h0h s ASP 710 N -3.69 6.32 -0.01 0.55 -1.08 -0.51 -4.92 116.67 113.33 1h0h s ASP 710 Ca 0.32 0.03 0.15 0.00 -0.52 0.00 0.00 52.55 52.53 1h0h s ASP 710 Cb 0.35 -2.26 0.45 0.00 -1.46 0.00 0.00 42.92 40.01 1h0h s ASP 710 CO -0.02 -0.44 1.37 0.29 0.52 0.00 0.00 175.17 176.89 1h0h n LYS 711 N 5.69 2.27 -1.77 4.34 5.02 -1.26 -2.60 118.16 129.85 1h0h n LYS 711 Ca -0.05 -1.84 -0.42 0.00 -2.02 0.00 0.00 58.31 53.98 1h0h n LYS 711 Cb 0.49 -1.44 -0.03 0.00 -0.02 0.00 0.00 35.03 34.04 1h0h n LYS 711 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1h0h s THR 712 N -1.38 2.12 0.02 -0.18 2.01 -1.26 -4.99 115.64 111.97 1h0h s THR 712 Ca 0.34 0.09 -0.02 0.00 0.31 0.00 0.00 61.69 62.40 1h0h s THR 712 Cb 0.18 -3.06 -0.01 0.00 0.01 0.00 0.00 72.50 69.62 1h0h s THR 712 CO 0.22 0.01 0.02 -1.10 -0.69 0.00 0.00 174.62 173.08 1h0h s GLN 713 N 0.91 0.38 0.90 4.92 -0.21 -1.26 -4.48 119.66 120.82 1h0h s GLN 713 Ca 0.72 -0.57 -0.13 0.00 0.02 0.00 0.00 55.36 55.40 1h0h s GLN 713 Cb -0.49 0.14 0.14 0.00 1.00 0.00 0.00 33.01 33.80 1h0h s GLN 713 CO 0.34 -0.07 1.17 0.95 -2.12 0.00 0.00 175.29 175.56 1h0h s THR 714 N -1.55 1.98 0.20 -0.19 -4.23 -1.26 -4.77 115.64 105.81 1h0h s THR 714 Ca -0.15 0.00 -0.12 0.00 -1.18 0.00 0.00 61.69 60.25 1h0h s THR 714 Cb -0.08 -2.84 0.12 0.00 1.34 0.00 0.00 72.50 71.04 1h0h s THR 714 CO -0.01 0.00 1.86 0.44 -0.54 0.00 0.00 174.62 176.38 1h0h h ASP 715 N -1.44 0.76 0.15 3.99 3.32 -2.01 0.63 116.42 121.81 1h0h h ASP 715 Ca -0.48 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 56.55 1h0h h ASP 715 Cb 1.32 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 40.67 1h0h h ASP 715 CO 0.59 0.55 -0.14 -0.03 -1.72 0.00 0.00 179.24 178.49 1h0h h MET 716 N 0.90 -0.30 -0.78 3.56 4.05 -1.97 -0.68 114.93 119.71 1h0h h MET 716 Ca 0.25 0.02 0.01 0.00 -0.28 0.00 0.00 59.70 59.70 1h0h h MET 716 Cb -0.10 0.07 -0.04 0.00 -0.80 0.00 0.00 31.60 30.73 1h0h h MET 716 CO -0.06 -0.20 0.51 1.96 0.23 0.00 0.00 176.91 179.36 1h0h h GLN 717 N -0.31 1.01 -0.14 0.39 4.20 -1.84 -2.88 115.11 115.54 1h0h h GLN 717 Ca 0.00 -0.06 -0.09 0.00 0.06 0.00 0.00 58.65 58.56 1h0h h GLN 717 Cb 0.29 -0.23 -0.01 0.00 0.30 0.00 0.00 27.48 27.83 1h0h h GLN 717 CO -0.03 0.67 -0.33 0.00 -0.67 0.00 0.00 178.83 178.47 1h0h h ALA 718 N 1.29 1.19 -0.61 3.87 0.00 -0.61 -0.30 119.26 124.08 1h0h h ALA 718 Ca 0.29 -0.36 0.12 0.00 0.00 0.00 0.00 54.91 54.96 1h0h h ALA 718 Cb -0.10 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.56 1h0h h ALA 718 CO -0.07 0.53 0.42 -0.22 0.00 0.00 0.00 179.25 179.91 1h0h h LYS 719 N 0.24 0.33 -0.00 0.00 1.63 -0.89 -3.06 116.57 114.82 1h0h h LYS 719 Ca 0.03 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.81 1h0h h LYS 719 Cb 0.70 -0.08 0.00 0.00 -0.60 0.00 0.00 32.23 32.25 1h0h h LYS 719 CO 0.05 0.22 -0.21 0.44 -3.45 0.00 0.00 179.45 176.50 1h0h n ILE 720 N -4.46 0.00 -2.24 2.00 -5.35 -0.97 -5.02 119.36 103.32 1h0h n ILE 720 Ca 0.11 -0.39 0.00 0.00 -0.27 0.00 0.00 62.75 62.19 1h0h n ILE 720 Cb 0.44 1.04 0.00 0.00 -1.74 0.00 0.00 39.64 39.37 1h0h n ILE 720 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1h0h n GLY 721 N 0.95 0.76 0.18 3.28 0.00 -0.16 -4.51 105.19 105.68 1h0h n GLY 721 Ca 0.02 -0.58 -0.08 0.00 0.00 0.00 0.00 46.02 45.38 1h0h n GLY 721 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1h0h h LEU 722 N 0.00 0.44 -3.01 0.99 3.38 -1.84 -3.44 115.31 111.84 1h0h h LEU 722 Ca 0.00 -0.26 -0.53 0.00 0.09 0.00 0.00 57.88 57.18 1h0h h LEU 722 Cb 0.97 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.58 1h0h h LEU 722 CO 0.00 0.97 -0.96 -1.22 0.09 0.00 0.00 178.44 177.32 1h0h n TYR 723 N -3.88 -1.60 0.31 1.13 4.01 -1.26 -4.84 117.16 111.03 1h0h n TYR 723 Ca -0.03 0.41 0.17 0.00 -0.16 0.00 0.00 57.90 58.29 1h0h n TYR 723 Cb 0.65 -3.21 0.99 0.00 -0.31 0.00 0.00 39.34 37.46 1h0h n TYR 723 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 1h0h h PRO 724 N -2.11 0.00 -0.01 -0.72 0.13 -1.88 -0.52 132.00 126.89 1h0h h PRO 724 Ca -0.67 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.46 1h0h h PRO 724 Cb 1.38 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.51 1h0h h PRO 724 CO 0.55 0.01 -0.05 0.41 -0.23 0.00 0.00 178.00 178.69 1h0h n GLY 725 N -1.16 -0.17 3.49 1.56 0.00 -1.25 -4.76 105.19 102.89 1h0h n GLY 725 Ca -0.03 -0.43 -0.43 0.00 0.00 0.00 0.00 46.02 45.14 1h0h n GLY 725 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1h0h s TRP 726 N -2.11 3.16 0.00 1.61 -0.11 -0.21 -1.42 118.94 119.86 1h0h s TRP 726 Ca 0.35 -0.32 0.00 0.00 1.22 0.00 0.00 56.10 57.36 1h0h s TRP 726 Cb 0.21 -2.93 0.00 0.00 -1.50 0.00 0.00 33.47 29.25 1h0h s TRP 726 CO 0.38 -0.70 0.00 0.25 -4.62 0.00 0.00 176.95 172.25 1h0h n THR 727 N 5.47 0.00 -3.66 5.86 -2.24 0.26 -4.84 114.28 115.13 1h0h n THR 727 Ca -0.07 0.00 -0.14 0.00 -2.27 0.00 0.00 64.05 61.57 1h0h n THR 727 Cb 0.48 0.00 -0.08 0.00 -2.10 0.00 0.00 70.33 68.63 1h0h n THR 727 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 1h0h s TRP 728 N 0.00 -0.68 0.00 4.78 -0.00 -1.21 -4.68 118.94 117.14 1h0h s TRP 728 Ca 0.00 1.66 0.04 0.00 -0.00 0.00 0.00 56.10 57.80 1h0h s TRP 728 Cb 0.00 0.24 -0.03 0.00 -0.00 0.00 0.00 33.47 33.68 1h0h s TRP 728 CO 0.00 -0.34 -0.11 0.00 -0.00 0.00 0.00 176.95 176.50 1h0h s ALA 729 N 0.28 2.83 0.16 5.86 0.00 -1.26 0.25 121.76 129.88 1h0h s ALA 729 Ca -0.00 -1.06 -0.10 0.00 0.00 0.00 0.00 51.96 50.80 1h0h s ALA 729 Cb -0.04 -0.99 -0.06 0.00 0.00 0.00 0.00 23.12 22.02 1h0h s ALA 729 CO 0.01 0.59 0.48 1.67 0.00 0.00 0.00 175.76 178.51 1h0h s TRP 730 N -0.92 3.51 0.07 0.00 1.48 -0.90 0.72 118.94 122.90 1h0h s TRP 730 Ca 0.15 0.83 -0.18 0.00 -1.06 0.00 0.00 56.10 55.84 1h0h s TRP 730 Cb -0.11 -2.21 -0.07 0.00 -1.16 0.00 0.00 33.47 29.93 1h0h s TRP 730 CO 0.05 0.39 0.54 -1.25 -4.06 0.00 0.00 176.95 172.62 1h0h s PRO 731 N -2.39 4.12 -1.57 3.25 0.04 -1.26 -4.70 135.00 132.48 1h0h s PRO 731 Ca 0.41 0.65 -0.14 0.00 0.04 0.00 0.00 61.00 61.96 1h0h s PRO 731 Cb -0.13 -3.20 0.14 0.00 0.04 0.00 0.00 34.50 31.35 1h0h s PRO 731 CO 0.21 0.63 0.35 1.33 0.04 0.00 0.00 177.00 179.56 1h0h n VAL 732 N 1.64 -0.30 -1.88 -0.36 0.24 -1.25 -0.64 118.33 115.78 1h0h n VAL 732 Ca -0.11 -0.15 -0.15 0.00 -2.04 0.00 0.00 64.34 61.90 1h0h n VAL 732 Cb 0.51 -0.59 -0.03 0.00 -1.47 0.00 0.00 33.84 32.25 1h0h n VAL 732 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 1h0h n ASN 733 N -2.24 -4.58 -4.55 -1.34 5.15 0.22 -4.90 115.26 103.03 1h0h n ASN 733 Ca -0.03 0.16 -0.41 0.00 -0.60 0.00 0.00 54.58 53.70 1h0h n ASN 733 Cb 0.47 -3.56 -0.03 0.00 -0.53 0.00 0.00 39.78 36.13 1h0h n ASN 733 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 1h0h s ARG 734 N -4.03 3.26 0.16 1.20 0.52 0.19 -4.28 118.95 115.96 1h0h s ARG 734 Ca 0.00 -0.18 -0.02 0.00 -0.52 0.00 0.00 55.73 55.01 1h0h s ARG 734 Cb 0.00 -4.14 -0.01 0.00 0.52 0.00 0.00 34.95 31.31 1h0h s ARG 734 CO 0.00 -2.01 1.38 0.00 0.02 0.00 0.00 175.30 174.69 1h0h h ARG 735 N 9.87 0.38 -4.72 3.54 2.47 -1.88 -3.39 114.38 120.66 1h0h h ARG 735 Ca -0.27 -0.36 -0.68 0.00 -1.26 0.00 0.00 59.98 57.40 1h0h h ARG 735 Cb 1.05 0.09 -0.34 0.00 -1.65 0.00 0.00 29.97 29.12 1h0h h ARG 735 CO 1.25 1.02 -0.68 0.42 0.56 0.00 0.00 179.97 182.53 1h0h s ILE 736 N -3.43 2.87 0.71 2.04 1.01 -1.26 -4.46 121.20 118.68 1h0h s ILE 736 Ca -0.05 -1.66 -0.12 0.00 0.00 0.00 0.00 60.65 58.82 1h0h s ILE 736 Cb 0.10 -2.77 0.02 0.00 0.01 0.00 0.00 42.46 39.82 1h0h s ILE 736 CO 0.85 -0.27 1.08 0.27 0.00 0.00 0.00 174.94 176.87 1h0h s ILE 737 N 1.17 3.54 -1.58 2.92 -4.36 -0.64 -3.37 121.20 118.88 1h0h s ILE 737 Ca -0.01 0.56 0.00 0.00 -0.26 0.00 0.00 60.65 60.94 1h0h s ILE 737 Cb -0.20 -3.12 0.00 0.00 1.25 0.00 0.00 42.46 40.39 1h0h s ILE 737 CO -0.03 -0.59 0.00 -1.22 0.24 0.00 0.00 174.94 173.34 1h0h n TYR 738 N -3.07 -0.20 0.30 1.37 4.01 -1.26 -4.13 117.16 114.18 1h0h n TYR 738 Ca 0.09 0.00 0.05 0.00 -0.16 0.00 0.00 57.90 57.88 1h0h n TYR 738 Cb 0.53 -2.88 0.24 0.00 -0.31 0.00 0.00 39.34 36.92 1h0h n TYR 738 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 1h0h n ASN 739 N -0.66 0.10 0.26 7.72 0.23 -1.22 -2.01 115.26 119.69 1h0h n ASN 739 Ca -0.17 0.53 0.12 0.00 -0.53 0.00 0.00 54.58 54.54 1h0h n ASN 739 Cb 0.55 -0.55 0.73 0.00 -2.08 0.00 0.00 39.78 38.43 1h0h n ASN 739 CO 0.00 0.00 0.00 0.03 -0.93 0.00 0.00 177.26 176.36 1h0h h ARG 740 N 0.00 0.00 0.00 -3.83 3.08 -1.83 -1.83 114.38 109.98 1h0h h ARG 740 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1h0h h ARG 740 Cb 0.16 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.21 1h0h h ARG 740 CO 0.00 0.11 0.00 0.00 -1.07 0.00 0.00 179.97 179.01 1h0h n ALA 741 N -2.29 2.25 1.44 0.04 0.00 -0.85 -3.12 120.51 117.98 1h0h n ALA 741 Ca -0.02 -0.12 0.14 0.00 0.00 0.00 0.00 53.44 53.44 1h0h n ALA 741 Cb 0.23 -1.40 0.53 0.00 0.00 0.00 0.00 19.45 18.81 1h0h n ALA 741 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1h0h n SER 742 N -1.26 1.01 -4.50 0.00 3.41 -0.69 -4.86 113.62 106.73 1h0h n SER 742 Ca 0.12 -1.06 -0.25 0.00 -0.26 0.00 0.00 58.87 57.42 1h0h n SER 742 Cb 0.19 0.03 -0.10 0.00 -0.26 0.00 0.00 64.21 64.06 1h0h n SER 742 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 1h0h s VAL 743 N -2.26 2.43 0.61 -3.33 -7.23 -1.18 -0.88 120.40 108.55 1h0h s VAL 743 Ca 0.32 -2.33 -0.10 0.00 -1.81 0.00 0.00 61.98 58.06 1h0h s VAL 743 Cb 0.20 -2.42 0.14 0.00 0.56 0.00 0.00 36.38 34.86 1h0h s VAL 743 CO 0.43 -0.34 0.83 -0.90 -0.31 0.00 0.00 175.10 174.81 1h0h n ASP 744 N -0.68 0.05 0.23 4.85 5.68 0.03 -4.84 116.55 121.88 1h0h n ASP 744 Ca -0.05 -1.30 0.12 0.00 -0.50 0.00 0.00 54.79 53.06 1h0h n ASP 744 Cb 0.61 -0.64 0.72 0.00 -1.14 0.00 0.00 41.12 40.68 1h0h n ASP 744 CO 0.00 0.00 0.00 -0.07 -1.33 0.00 0.00 177.20 175.80 1h0h h LEU 745 N 0.00 0.00 -0.72 -2.12 3.38 -1.96 -1.01 115.31 112.88 1h0h h LEU 745 Ca -0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.70 1h0h h LEU 745 Cb 0.74 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.49 1h0h h LEU 745 CO 0.19 0.00 -0.05 0.59 0.09 0.00 0.00 178.44 179.26 1h0h n ASN 746 N -4.30 1.17 0.00 -0.43 3.02 -1.26 -0.93 115.26 112.52 1h0h n ASN 746 Ca -0.01 -1.27 0.00 0.00 -0.03 0.00 0.00 54.58 53.27 1h0h n ASN 746 Cb 0.17 0.02 0.00 0.00 -0.61 0.00 0.00 39.78 39.35 1h0h n ASN 746 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1h0h n GLY 747 N 1.19 0.77 3.72 7.41 0.00 -0.38 -4.79 105.19 113.09 1h0h n GLY 747 Ca 0.18 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.81 1h0h n GLY 747 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1h0h s LYS 748 N -0.55 4.41 0.36 1.61 2.20 -1.26 -1.56 119.74 124.94 1h0h s LYS 748 Ca 0.00 0.78 -0.28 0.00 -0.36 0.00 0.00 55.97 56.10 1h0h s LYS 748 Cb 0.00 -3.45 -0.12 0.00 -1.51 0.00 0.00 37.83 32.75 1h0h s LYS 748 CO 0.00 0.07 1.42 -2.30 -0.36 0.00 0.00 175.35 174.18 1h0h n PRO 749 N 3.82 2.46 0.17 4.03 -0.02 -1.26 -0.79 135.00 143.41 1h0h n PRO 749 Ca -0.02 0.86 0.04 0.00 -2.02 0.00 0.00 63.50 62.36 1h0h n PRO 749 Cb 0.51 -2.54 0.25 0.00 -0.02 0.00 0.00 33.50 31.70 1h0h n PRO 749 CO 0.00 0.00 0.00 1.88 1.98 0.00 0.00 175.50 179.36 1h0h h TYR 750 N 2.96 0.00 -2.75 6.00 0.05 -1.31 -3.38 116.97 118.54 1h0h h TYR 750 Ca -0.49 0.00 -0.60 0.00 0.05 0.00 0.00 58.73 57.69 1h0h h TYR 750 Cb 1.26 0.00 -0.40 0.00 1.01 0.00 0.00 36.73 38.60 1h0h h TYR 750 CO 0.53 0.46 -0.78 0.00 -1.05 0.00 0.00 178.16 177.31 1h0h s ALA 751 N -3.47 2.43 0.44 3.88 0.00 -1.26 -3.73 121.76 120.05 1h0h s ALA 751 Ca 0.00 -2.99 0.15 0.00 0.00 0.00 0.00 51.96 49.13 1h0h s ALA 751 Cb 0.11 -1.86 1.06 0.00 0.00 0.00 0.00 23.12 22.42 1h0h s ALA 751 CO 0.71 -2.04 1.96 -1.00 0.00 0.00 0.00 175.76 175.39 1h0h h PRO 752 N 5.77 0.37 0.00 0.00 0.13 -1.95 0.11 132.00 136.43 1h0h h PRO 752 Ca 0.17 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 1h0h h PRO 752 Cb 0.86 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 31.90 1h0h h PRO 752 CO 0.52 0.25 0.00 0.93 -0.23 0.00 0.00 178.00 179.47 1h0h h GLU 753 N 0.39 0.00 -0.47 0.86 5.08 -1.96 -3.29 114.58 115.19 1h0h h GLU 753 Ca 0.30 0.00 -0.28 0.00 -1.00 0.00 0.00 59.36 58.38 1h0h h GLU 753 Cb 0.67 0.00 -0.27 0.00 0.50 0.00 0.00 28.75 29.65 1h0h h GLU 753 CO -0.08 0.00 -0.76 0.36 -1.00 0.00 0.00 179.01 177.53 1h0h n LYS 754 N -2.47 1.19 -2.04 2.33 2.85 0.22 -4.97 118.16 115.26 1h0h n LYS 754 Ca 0.01 -2.51 -0.38 0.00 -1.05 0.00 0.00 58.31 54.38 1h0h n LYS 754 Cb 0.19 -0.62 0.01 0.00 -0.65 0.00 0.00 35.03 33.96 1h0h n LYS 754 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1h0h s ALA 755 N -1.44 3.04 -0.21 0.58 0.00 -0.34 -4.30 121.76 119.09 1h0h s ALA 755 Ca 0.24 1.17 -0.16 0.00 0.00 0.00 0.00 51.96 53.21 1h0h s ALA 755 Cb 0.43 -3.48 -0.10 0.00 0.00 0.00 0.00 23.12 19.97 1h0h s ALA 755 CO -0.03 -0.93 -0.19 0.28 0.00 0.00 0.00 175.76 174.89 1h0h n VAL 756 N -0.40 1.50 -4.22 0.00 0.31 -1.26 -4.87 118.33 109.40 1h0h n VAL 756 Ca 0.07 -0.03 -0.14 0.00 -0.01 0.00 0.00 64.34 64.23 1h0h n VAL 756 Cb 0.45 -2.16 -0.10 0.00 -0.91 0.00 0.00 33.84 31.12 1h0h n VAL 756 CO 0.00 0.00 0.00 0.68 -1.32 0.00 0.00 176.83 176.19 1h0h s VAL 757 N -2.53 1.02 -0.13 2.52 -7.23 -1.26 -1.13 120.40 111.65 1h0h s VAL 757 Ca -0.29 -1.93 -0.12 0.00 -1.81 0.00 0.00 61.98 57.84 1h0h s VAL 757 Cb 0.07 -1.69 0.04 0.00 0.56 0.00 0.00 36.38 35.35 1h0h s VAL 757 CO 0.43 -0.72 0.35 -0.70 -0.31 0.00 0.00 175.10 174.15 1h0h s GLU 758 N -3.52 0.40 -0.11 4.82 2.12 -0.67 -4.50 118.70 117.24 1h0h s GLU 758 Ca 0.13 0.52 -0.26 0.00 0.36 0.00 0.00 54.97 55.72 1h0h s GLU 758 Cb 0.02 0.17 -0.02 0.00 0.26 0.00 0.00 34.13 34.55 1h0h s GLU 758 CO -0.01 -0.06 0.83 -0.46 -0.54 0.00 0.00 175.26 175.02 1h0h s TRP 759 N 0.33 3.51 -0.67 5.30 -0.11 -0.60 -0.77 118.94 125.93 1h0h s TRP 759 Ca -0.01 1.35 -0.16 0.00 1.22 0.00 0.00 56.10 58.50 1h0h s TRP 759 Cb -0.03 -2.98 0.16 0.00 -1.50 0.00 0.00 33.47 29.11 1h0h s TRP 759 CO -0.01 -0.10 0.66 1.21 -4.62 0.00 0.00 176.95 174.09 1h0h s ASN 760 N 1.02 6.43 0.33 5.86 3.04 0.13 -4.86 114.94 126.88 1h0h s ASN 760 Ca 0.41 -2.09 0.07 0.00 0.04 0.00 0.00 52.86 51.30 1h0h s ASN 760 Cb -0.18 -2.23 0.76 0.00 -1.54 0.00 0.00 41.25 38.06 1h0h s ASN 760 CO 0.17 -0.80 1.83 0.00 -3.04 0.00 0.00 177.10 175.27 1h0h h ALA 761 N 8.52 1.76 -0.32 1.71 0.00 -1.94 1.67 119.26 130.65 1h0h h ALA 761 Ca -0.12 0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.73 1h0h h ALA 761 Cb 1.07 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 1h0h h ALA 761 CO 0.95 -0.04 -0.16 0.00 0.00 0.00 0.00 179.25 180.00 1h0h h ALA 762 N 1.60 0.45 0.00 0.00 0.00 -1.95 -2.89 119.26 116.47 1h0h h ALA 762 Ca 0.50 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1h0h h ALA 762 Cb 0.76 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.44 1h0h h ALA 762 CO -0.26 0.36 -0.55 0.39 0.00 0.00 0.00 179.25 179.19 1h0h n GLU 763 N -4.36 0.26 -3.64 0.00 4.71 -0.91 -4.97 120.64 111.73 1h0h n GLU 763 Ca -0.03 0.09 -0.24 0.00 -0.01 0.00 0.00 57.16 56.97 1h0h n GLU 763 Cb 0.39 -1.68 0.04 0.00 -1.01 0.00 0.00 31.44 29.17 1h0h n GLU 763 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 1h0h n LYS 764 N -2.07 -3.14 -3.74 3.49 4.76 0.57 -5.00 118.16 113.03 1h0h n LYS 764 Ca 0.04 0.59 -0.12 0.00 -2.87 0.00 0.00 58.31 55.95 1h0h n LYS 764 Cb 0.43 -4.87 -0.07 0.00 -1.84 0.00 0.00 35.03 28.67 1h0h n LYS 764 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 1h0h s LYS 765 N -5.78 0.84 -0.04 1.97 1.02 -1.06 -4.98 119.74 111.71 1h0h s LYS 765 Ca 0.23 -0.49 -0.18 0.00 0.02 0.00 0.00 55.97 55.55 1h0h s LYS 765 Cb -0.07 0.36 -0.05 0.00 -0.52 0.00 0.00 37.83 37.56 1h0h s LYS 765 CO 0.82 -0.27 0.50 -1.58 -0.92 0.00 0.00 175.35 173.90 1h0h s TRP 766 N -2.58 3.64 0.26 3.18 0.52 -1.26 0.17 118.94 122.87 1h0h s TRP 766 Ca -0.05 1.03 0.10 0.00 0.02 0.00 0.00 56.10 57.20 1h0h s TRP 766 Cb -0.01 -2.49 -0.05 0.00 -1.15 0.00 0.00 33.47 29.77 1h0h s TRP 766 CO -0.03 0.37 -0.09 0.14 0.02 0.00 0.00 176.95 177.36 1h0h s VAL 767 N -0.17 3.05 0.00 4.03 -7.23 0.05 -4.90 120.40 115.23 1h0h s VAL 767 Ca 0.27 -2.06 0.00 0.00 -1.81 0.00 0.00 61.98 58.38 1h0h s VAL 767 Cb -0.17 -2.60 0.00 0.00 0.56 0.00 0.00 36.38 34.17 1h0h s VAL 767 CO 0.14 -0.34 0.00 0.61 -0.31 0.00 0.00 175.10 175.19 1h0h n GLY 768 N -0.65 0.49 3.71 2.32 0.00 -1.26 -1.67 105.19 108.12 1h0h n GLY 768 Ca -0.07 -1.25 -0.29 0.00 0.00 0.00 0.00 46.02 44.42 1h0h n GLY 768 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1h0h s ASP 769 N -4.00 3.06 0.06 1.61 2.15 -0.29 -4.88 116.67 114.39 1h0h s ASP 769 Ca 0.00 1.20 -0.31 0.00 0.43 0.00 0.00 52.55 53.87 1h0h s ASP 769 Cb 0.00 -1.86 -0.06 0.00 -0.30 0.00 0.00 42.92 40.70 1h0h s ASP 769 CO 0.00 -2.86 1.29 -0.69 -0.17 0.00 0.00 175.17 172.74 1h0h s VAL 770 N -3.03 3.76 0.27 1.11 1.01 -1.26 -4.86 120.40 117.40 1h0h s VAL 770 Ca 0.64 1.24 -0.29 0.00 0.00 0.00 0.00 61.98 63.57 1h0h s VAL 770 Cb -0.17 -3.80 -0.10 0.00 0.00 0.00 0.00 36.38 32.31 1h0h s VAL 770 CO 0.56 0.08 1.34 -2.16 0.00 0.00 0.00 175.10 174.92 1h0h s PRO 771 N 1.33 4.35 -1.30 2.72 0.04 -1.26 -4.62 135.00 136.25 1h0h s PRO 771 Ca 0.61 2.19 -0.18 0.00 0.04 0.00 0.00 61.00 63.66 1h0h s PRO 771 Cb -0.32 -3.12 0.07 0.00 0.04 0.00 0.00 34.50 31.18 1h0h s PRO 771 CO 0.29 -0.26 1.75 -3.47 0.04 0.00 0.00 177.00 175.34 1h0h n ASP 772 N 1.74 4.92 0.00 6.66 2.03 -1.26 -4.23 116.55 126.41 1h0h n ASP 772 Ca 0.04 -2.92 0.00 0.00 0.52 0.00 0.00 54.79 52.43 1h0h n ASP 772 Cb 0.42 -1.74 0.00 0.00 -0.72 0.00 0.00 41.12 39.07 1h0h n ASP 772 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1h0h n GLY 773 N 5.32 1.46 0.41 0.27 0.00 -1.26 -4.66 105.19 106.74 1h0h n GLY 773 Ca 0.49 -0.97 0.13 0.00 0.00 0.00 0.00 46.02 45.66 1h0h n GLY 773 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1h0h n PRO 774 N 1.82 1.56 -1.13 1.61 -0.04 -1.26 -4.94 135.00 132.63 1h0h n PRO 774 Ca 0.00 -0.83 -0.30 0.00 -0.04 0.00 0.00 63.50 62.33 1h0h n PRO 774 Cb 0.00 -1.43 0.13 0.00 -0.04 0.00 0.00 33.50 32.16 1h0h n PRO 774 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 1h0h s TRP 775 N -1.92 2.26 1.09 0.54 0.51 -1.26 -4.89 118.94 115.27 1h0h s TRP 775 Ca 0.36 1.40 -0.14 0.00 -2.12 0.00 0.00 56.10 55.60 1h0h s TRP 775 Cb 0.19 -3.14 0.18 0.00 -0.81 0.00 0.00 33.47 29.88 1h0h s TRP 775 CO 0.30 -2.34 0.62 -2.30 -0.51 0.00 0.00 176.95 172.72 1h0h n PRO 776 N -3.87 -1.63 -1.17 4.98 -0.02 -1.26 -4.81 135.00 127.22 1h0h n PRO 776 Ca 0.08 -0.44 -0.36 0.00 -2.02 0.00 0.00 63.50 60.76 1h0h n PRO 776 Cb 0.54 -2.00 0.07 0.00 -0.02 0.00 0.00 33.50 32.09 1h0h n PRO 776 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1h0h n PRO 777 N -3.47 0.17 0.28 0.52 -0.02 -1.26 -3.75 135.00 127.47 1h0h n PRO 777 Ca 0.04 0.10 0.15 0.00 -2.02 0.00 0.00 63.50 61.77 1h0h n PRO 777 Cb 0.56 -1.73 0.81 0.00 -0.02 0.00 0.00 33.50 33.13 1h0h n PRO 777 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 1h0h h GLN 778 N -0.57 0.00 0.00 -0.52 4.15 -1.61 -1.69 115.11 114.87 1h0h h GLN 778 Ca -0.45 0.00 -0.02 0.00 0.77 0.00 0.00 58.65 58.95 1h0h h GLN 778 Cb 1.34 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 29.03 1h0h h GLN 778 CO 0.40 0.08 -0.10 0.00 -1.93 0.00 0.00 178.83 177.28 1h0h h ALA 779 N 1.92 1.26 -1.45 3.38 0.00 -1.37 -3.39 119.26 119.62 1h0h h ALA 779 Ca -0.00 -0.09 -0.54 0.00 0.00 0.00 0.00 54.91 54.28 1h0h h ALA 779 Cb 0.31 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.01 1h0h h ALA 779 CO 0.01 0.12 1.07 0.34 0.00 0.00 0.00 179.25 180.80 1h0h s ASP 780 N -6.07 6.15 0.30 0.00 -1.08 -0.64 -4.86 116.67 110.47 1h0h s ASP 780 Ca -0.03 -0.16 0.26 0.00 -0.52 0.00 0.00 52.55 52.10 1h0h s ASP 780 Cb 0.13 -2.55 0.82 0.00 -1.46 0.00 0.00 42.92 39.85 1h0h s ASP 780 CO 0.57 -1.78 1.75 0.11 0.52 0.00 0.00 175.17 176.34 1h0h h LYS 781 N 10.46 0.00 0.12 4.34 1.57 -1.86 0.11 116.57 131.30 1h0h h LYS 781 Ca -0.27 0.00 -0.31 0.00 -1.87 0.00 0.00 60.65 58.20 1h0h h LYS 781 Cb 1.07 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.37 1h0h h LYS 781 CO 1.24 0.00 -1.61 0.93 -0.57 0.00 0.00 179.45 179.44 1h0h h GLU 782 N 0.00 0.26 0.00 3.15 3.07 -1.95 -3.43 114.58 115.68 1h0h h GLU 782 Ca 0.00 -0.44 0.00 0.00 -0.50 0.00 0.00 59.36 58.42 1h0h h GLU 782 Cb 0.68 0.16 0.00 0.00 -0.84 0.00 0.00 28.75 28.75 1h0h h GLU 782 CO 0.00 1.21 -0.99 1.63 -1.40 0.00 0.00 179.01 179.45 1h0h n LYS 783 N -3.80 0.55 -1.73 2.33 4.76 -1.24 -5.03 118.16 113.99 1h0h n LYS 783 Ca -0.27 -0.01 -0.30 0.00 -2.87 0.00 0.00 58.31 54.86 1h0h n LYS 783 Cb 0.95 -1.00 0.09 0.00 -1.84 0.00 0.00 35.03 33.22 1h0h n LYS 783 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 1h0h s GLY 784 N -2.10 1.61 0.29 0.72 0.00 0.38 -4.20 107.32 104.01 1h0h s GLY 784 Ca -0.00 -0.42 0.02 0.00 0.00 0.00 0.00 44.72 44.32 1h0h s GLY 784 CO 0.07 0.03 0.11 0.54 0.00 0.00 0.00 173.10 173.84 1h0h s LYS 785 N -5.35 1.52 0.56 2.90 -0.14 -1.25 -4.75 119.74 113.24 1h0h s LYS 785 Ca 0.61 -1.84 -0.06 0.00 -1.36 0.00 0.00 55.97 53.32 1h0h s LYS 785 Cb -0.13 -0.35 -0.00 0.00 -1.68 0.00 0.00 37.83 35.67 1h0h s LYS 785 CO 0.52 -0.32 0.87 1.03 -0.76 0.00 0.00 175.35 176.68 1h0h s ARG 786 N -3.95 3.10 0.21 1.68 0.52 -0.80 -4.17 118.95 115.54 1h0h s ARG 786 Ca 0.36 0.04 -0.09 0.00 -0.52 0.00 0.00 55.73 55.53 1h0h s ARG 786 Cb 0.07 -2.30 0.17 0.00 0.52 0.00 0.00 34.95 33.40 1h0h s ARG 786 CO 0.15 -0.56 1.82 0.00 0.02 0.00 0.00 175.30 176.74 1h0h h ALA 787 N -0.06 1.03 -2.65 2.13 0.00 -1.86 -3.37 119.26 114.49 1h0h h ALA 787 Ca -0.46 -0.13 -0.78 0.00 0.00 0.00 0.00 54.91 53.54 1h0h h ALA 787 Cb 1.24 -0.32 -0.25 0.00 0.00 0.00 0.00 17.79 18.46 1h0h h ALA 787 CO 0.61 0.56 0.29 -0.06 0.00 0.00 0.00 179.25 180.65 1h0h s PHE 788 N -5.80 3.82 0.24 0.00 0.40 -0.35 -4.66 117.98 111.63 1h0h s PHE 788 Ca -0.13 -2.11 0.32 0.00 -0.60 0.00 0.00 56.93 54.41 1h0h s PHE 788 Cb 0.16 -3.88 1.43 0.00 0.51 0.00 0.00 43.02 41.23 1h0h s PHE 788 CO 0.82 -1.04 2.02 -0.84 0.70 0.00 0.00 175.22 176.87 1h0h h ILE 789 N 4.61 0.22 0.00 0.64 3.07 -1.83 -2.50 117.51 121.70 1h0h h ILE 789 Ca 0.14 -0.58 0.00 0.00 1.55 0.00 0.00 64.86 65.97 1h0h h ILE 789 Cb 0.99 1.47 0.00 0.00 -0.27 0.00 0.00 36.82 39.01 1h0h h ILE 789 CO 0.86 0.07 -0.46 0.23 -1.05 0.00 0.00 178.15 177.80 1h0h n MET 790 N -3.25 0.28 -3.02 0.16 2.81 -1.26 -0.71 117.12 112.14 1h0h n MET 790 Ca -0.00 0.12 -0.32 0.00 -1.81 0.00 0.00 57.70 55.68 1h0h n MET 790 Cb 0.29 -1.72 -0.06 0.00 -0.71 0.00 0.00 33.22 31.02 1h0h n MET 790 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 1h0h s LYS 791 N -3.15 4.04 0.46 0.03 -0.14 -0.94 -4.72 119.74 115.32 1h0h s LYS 791 Ca 0.07 0.78 0.11 0.00 -1.36 0.00 0.00 55.97 55.57 1h0h s LYS 791 Cb 0.13 -2.35 1.04 0.00 -1.68 0.00 0.00 37.83 34.97 1h0h s LYS 791 CO 0.69 0.08 2.10 -1.35 -0.76 0.00 0.00 175.35 176.11 1h0h h PRO 792 N 2.05 0.30 -0.01 -1.68 0.11 -1.89 -2.74 132.00 128.14 1h0h h PRO 792 Ca -0.48 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1h0h h PRO 792 Cb 1.18 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.22 1h0h h PRO 792 CO 0.64 0.20 -0.39 0.39 -0.21 0.00 0.00 178.00 178.63 1h0h n GLU 793 N -4.50 1.65 -0.56 1.05 4.71 -1.26 -4.58 120.64 117.15 1h0h n GLU 793 Ca 0.01 -0.74 0.00 0.00 -0.01 0.00 0.00 57.16 56.41 1h0h n GLU 793 Cb 0.08 -1.29 0.00 0.00 -1.01 0.00 0.00 31.44 29.22 1h0h n GLU 793 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1h0h n GLY 794 N 1.19 0.76 3.47 0.62 0.00 -1.03 -4.64 105.19 105.57 1h0h n GLY 794 Ca 0.06 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.76 1h0h n GLY 794 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1h0h s TYR 795 N -2.81 2.73 0.53 1.61 2.02 -1.26 -1.22 117.35 118.95 1h0h s TYR 795 Ca 0.00 -0.20 -0.21 0.00 -0.37 0.00 0.00 57.07 56.29 1h0h s TYR 795 Cb 0.00 -1.66 -0.05 0.00 -0.40 0.00 0.00 41.96 39.85 1h0h s TYR 795 CO 0.00 0.15 1.21 0.00 -1.57 0.00 0.00 175.55 175.35 1h0h s ALA 796 N -0.62 2.77 -0.43 3.71 0.00 -0.24 -4.71 121.76 122.25 1h0h s ALA 796 Ca 0.09 1.03 -0.15 0.00 0.00 0.00 0.00 51.96 52.92 1h0h s ALA 796 Cb -0.11 -3.44 0.03 0.00 0.00 0.00 0.00 23.12 19.60 1h0h s ALA 796 CO 0.01 -0.98 0.34 0.71 0.00 0.00 0.00 175.76 175.84 1h0h s TYR 797 N -1.54 3.23 -0.05 0.00 1.51 0.43 -0.06 117.35 120.87 1h0h s TYR 797 Ca 0.71 -0.64 -0.15 0.00 -1.01 0.00 0.00 57.07 55.97 1h0h s TYR 797 Cb -0.31 -2.75 -0.10 0.00 -0.11 0.00 0.00 41.96 38.69 1h0h s TYR 797 CO 0.36 -0.65 0.63 -0.07 -1.11 0.00 0.00 175.55 174.71 1h0h h LEU 798 N 8.71 -0.32 -9.05 -1.29 3.38 -1.90 -3.41 115.31 111.43 1h0h h LEU 798 Ca -0.27 -0.11 -0.60 0.00 0.09 0.00 0.00 57.88 56.98 1h0h h LEU 798 Cb 1.12 0.08 -0.10 0.00 0.09 0.00 0.00 40.66 41.85 1h0h h LEU 798 CO 0.77 0.17 0.20 -0.47 0.09 0.00 0.00 178.44 179.20 1h0h s TYR 799 N -3.14 3.33 -0.43 1.13 6.14 -1.26 -4.86 117.35 118.26 1h0h s TYR 799 Ca -0.09 0.93 0.02 0.00 0.64 0.00 0.00 57.07 58.57 1h0h s TYR 799 Cb 0.01 -2.86 0.13 0.00 0.42 0.00 0.00 41.96 39.65 1h0h s TYR 799 CO 0.29 -0.27 0.22 0.20 0.64 0.00 0.00 175.55 176.63 1h0h s GLY 800 N 1.33 1.66 0.00 8.97 0.00 0.11 -4.98 107.32 114.41 1h0h s GLY 800 Ca 0.29 -2.54 0.22 0.00 0.00 0.00 0.00 44.72 42.68 1h0h s GLY 800 CO 0.09 1.51 1.69 -1.55 0.00 0.00 0.00 173.10 174.84 1h0h n PRO 801 N 3.66 0.48 0.20 2.90 -0.04 -1.26 -2.98 135.00 137.95 1h0h n PRO 801 Ca 0.07 0.05 0.14 0.00 -0.04 0.00 0.00 63.50 63.72 1h0h n PRO 801 Cb 0.35 -1.50 0.45 0.00 -0.04 0.00 0.00 33.50 32.76 1h0h n PRO 801 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1h0h h GLY 802 N 3.48 0.00 -4.50 0.55 0.00 -1.93 -3.46 103.07 97.21 1h0h h GLY 802 Ca 0.00 0.00 -0.54 0.00 0.00 0.00 0.00 47.33 46.79 1h0h h GLY 802 CO 0.00 0.00 0.45 0.50 0.00 0.00 0.00 176.54 177.49 1h0h s ARG 803 N -3.36 4.51 0.65 4.80 1.81 -1.16 -4.92 118.95 121.27 1h0h s ARG 803 Ca 0.05 1.47 0.43 0.00 -1.72 0.00 0.00 55.73 55.97 1h0h s ARG 803 Cb 0.09 -3.47 2.31 0.00 -0.45 0.00 0.00 34.95 33.43 1h0h s ARG 803 CO 0.56 -0.15 2.32 1.05 -0.68 0.00 0.00 175.30 178.40 1h0h h GLU 804 N 6.89 0.00 -0.35 3.54 4.11 -1.93 -2.23 114.58 124.60 1h0h h GLU 804 Ca -0.39 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.04 1h0h h GLU 804 Cb 1.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.45 1h0h h GLU 804 CO 0.78 0.00 0.00 -0.40 0.07 0.00 0.00 179.01 179.46 1h0h n ASP 805 N -3.06 4.03 0.00 3.06 5.75 -1.26 -4.57 116.55 120.51 1h0h n ASP 805 Ca -0.03 -2.79 0.00 0.00 -0.01 0.00 0.00 54.79 51.97 1h0h n ASP 805 Cb 0.09 -0.51 0.00 0.00 -1.03 0.00 0.00 41.12 39.67 1h0h n ASP 805 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1h0h n GLY 806 N -0.05 4.27 0.02 6.12 0.00 -0.84 -4.91 105.19 109.79 1h0h n GLY 806 Ca 0.21 -1.44 0.14 0.00 0.00 0.00 0.00 46.02 44.93 1h0h n GLY 806 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1h0h n PRO 807 N -1.71 0.15 -4.11 1.61 -0.04 -1.26 -4.48 135.00 125.16 1h0h n PRO 807 Ca 0.00 -0.03 -0.14 0.00 -0.04 0.00 0.00 63.50 63.28 1h0h n PRO 807 Cb 0.00 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 31.84 1h0h n PRO 807 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1h0h s LEU 808 N -2.88 2.20 0.40 1.53 1.43 -1.26 -0.71 118.68 119.39 1h0h s LEU 808 Ca 0.17 -0.46 -0.26 0.00 -1.03 0.00 0.00 54.13 52.55 1h0h s LEU 808 Cb 0.19 -0.24 -0.09 0.00 0.03 0.00 0.00 46.19 46.08 1h0h s LEU 808 CO 0.55 -0.13 1.31 -2.16 0.23 0.00 0.00 176.35 176.16 1h0h s PRO 809 N -1.27 4.01 -0.05 1.29 0.04 -1.26 -5.03 135.00 132.72 1h0h s PRO 809 Ca -0.06 2.19 -0.05 0.00 0.04 0.00 0.00 61.00 63.12 1h0h s PRO 809 Cb -0.08 -2.80 0.02 0.00 0.04 0.00 0.00 34.50 31.67 1h0h s PRO 809 CO 0.00 -0.47 0.14 -2.00 0.04 0.00 0.00 177.00 174.72 1h0h s GLU 810 N -2.19 0.16 0.15 4.56 2.56 -1.26 -5.06 118.70 117.63 1h0h s GLU 810 Ca 0.56 0.22 -0.30 0.00 0.00 0.00 0.00 54.97 55.45 1h0h s GLU 810 Cb -0.39 0.05 -0.07 0.00 2.00 0.00 0.00 34.13 35.72 1h0h s GLU 810 CO 0.50 -0.04 1.09 -0.47 -0.56 0.00 0.00 175.26 175.79 1h0h s TYR 811 N 0.21 3.60 0.02 5.30 5.04 -1.26 -5.03 117.35 125.22 1h0h s TYR 811 Ca -0.01 1.59 -0.01 0.00 -2.44 0.00 0.00 57.07 56.21 1h0h s TYR 811 Cb -0.02 -3.26 -0.02 0.00 0.35 0.00 0.00 41.96 39.00 1h0h s TYR 811 CO -0.01 -0.58 -0.02 0.71 -1.34 0.00 0.00 175.55 174.32 1h0h s TYR 812 N -0.05 0.27 0.06 4.97 2.02 -1.26 -4.90 117.35 118.45 1h0h s TYR 812 Ca 0.50 -0.56 -0.31 0.00 -0.37 0.00 0.00 57.07 56.34 1h0h s TYR 812 Cb -0.29 -0.20 -0.07 0.00 -0.40 0.00 0.00 41.96 41.00 1h0h s TYR 812 CO 0.34 -0.21 1.49 -1.21 -1.57 0.00 0.00 175.55 174.38 1h0h s GLU 813 N -1.69 4.26 0.38 -0.62 0.41 -0.27 -4.87 118.70 116.31 1h0h s GLU 813 Ca -0.14 2.13 0.21 0.00 -0.41 0.00 0.00 54.97 56.76 1h0h s GLU 813 Cb -0.08 -3.49 0.50 0.00 -1.78 0.00 0.00 34.13 29.28 1h0h s GLU 813 CO -0.02 -0.60 1.64 -1.00 -0.49 0.00 0.00 175.26 174.80 1h0h h PRO 814 N 7.71 0.00 -5.72 0.39 0.13 -1.88 -3.41 132.00 129.22 1h0h h PRO 814 Ca -0.41 0.00 -0.49 0.00 -0.87 0.00 0.00 66.00 64.24 1h0h h PRO 814 Cb 1.19 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.18 1h0h h PRO 814 CO 0.90 0.28 -0.74 -1.64 -0.23 0.00 0.00 178.00 176.57 1h0h s MET 815 N -3.30 1.39 0.09 0.86 -1.94 -1.26 -5.04 119.30 110.10 1h0h s MET 815 Ca 0.03 -1.61 -0.10 0.00 -1.71 0.00 0.00 55.69 52.30 1h0h s MET 815 Cb 0.08 -1.27 -0.22 0.00 2.01 0.00 0.00 34.83 35.44 1h0h s MET 815 CO 0.68 0.22 1.19 0.93 -0.01 0.00 0.00 175.02 178.03 1h0h h GLU 816 N 2.56 0.52 -5.83 2.03 5.08 -2.00 -3.46 114.58 113.48 1h0h h GLU 816 Ca -0.39 -0.65 -0.54 0.00 -1.00 0.00 0.00 59.36 56.78 1h0h h GLU 816 Cb 1.23 0.20 -0.26 0.00 0.50 0.00 0.00 28.75 30.42 1h0h h GLU 816 CO 0.61 1.26 -0.83 0.00 -1.00 0.00 0.00 179.01 179.05 1h0h s PRO 818 N -1.03 0.70 -0.24 0.00 0.04 -1.26 -4.99 135.00 128.22 1h0h s PRO 818 Ca 0.06 0.63 -0.29 0.00 0.04 0.00 0.00 61.00 61.44 1h0h s PRO 818 Cb -0.08 -1.76 -0.02 0.00 0.04 0.00 0.00 34.50 32.68 1h0h s PRO 818 CO 0.01 -2.58 1.48 0.08 0.04 0.00 0.00 177.00 176.04 1h0h s VAL 819 N -2.94 3.89 -0.10 -0.36 1.01 -1.24 -4.98 120.40 115.68 1h0h s VAL 819 Ca 0.65 1.01 0.02 0.00 0.00 0.00 0.00 61.98 63.66 1h0h s VAL 819 Cb -0.18 -3.87 0.01 0.00 0.00 0.00 0.00 36.38 32.34 1h0h s VAL 819 CO 0.57 -0.33 -0.17 -0.63 0.00 0.00 0.00 175.10 174.55 1h0h s ILE 820 N 4.73 1.54 0.13 2.22 1.01 -1.26 -5.13 121.20 124.43 1h0h s ILE 820 Ca 0.65 -0.69 -0.10 0.00 0.00 0.00 0.00 60.65 60.50 1h0h s ILE 820 Cb -0.22 -1.39 -0.06 0.00 0.01 0.00 0.00 42.46 40.80 1h0h s ILE 820 CO 0.26 0.45 0.46 -1.61 0.00 0.00 0.00 174.94 174.50 1h0h s GLU 821 N 0.74 3.81 0.19 2.79 0.41 -1.26 -4.94 118.70 120.44 1h0h s GLU 821 Ca -0.12 0.25 0.07 0.00 -0.41 0.00 0.00 54.97 54.77 1h0h s GLU 821 Cb -0.16 -2.91 -0.04 0.00 -1.78 0.00 0.00 34.13 29.24 1h0h s GLU 821 CO 0.02 0.49 0.01 -3.38 -0.49 0.00 0.00 175.26 171.92 1h0h s HIS 822 N -1.51 2.86 -2.11 1.61 -3.43 -1.26 -5.03 115.29 106.42 1h0h s HIS 822 Ca 0.37 -0.14 0.15 0.00 -0.80 0.00 0.00 55.06 54.65 1h0h s HIS 822 Cb -0.14 -1.37 0.50 0.00 -1.43 0.00 0.00 32.58 30.14 1h0h s HIS 822 CO 0.19 0.53 1.38 -0.35 -2.00 0.00 0.00 174.74 174.49 1h0h n PRO 823 N -0.25 1.81 0.03 -0.38 -0.04 -1.26 -4.38 135.00 130.54 1h0h n PRO 823 Ca -0.09 -1.24 0.01 0.00 -0.04 0.00 0.00 63.50 62.14 1h0h n PRO 823 Cb 0.56 -1.33 -0.08 0.00 -0.04 0.00 0.00 33.50 32.60 1h0h n PRO 823 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1h0h n PHE 824 N 0.48 0.89 -3.81 0.54 3.72 -1.26 -5.00 117.46 113.03 1h0h n PHE 824 Ca 0.14 0.29 -0.02 0.00 -0.05 0.00 0.00 57.45 57.82 1h0h n PHE 824 Cb 0.32 -1.05 0.00 0.00 -0.94 0.00 0.00 39.48 37.82 1h0h n PHE 824 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 1h0h s SER 825 N -5.67 -0.06 0.00 4.37 1.04 -1.26 -4.82 113.70 107.30 1h0h s SER 825 Ca -0.03 -0.45 0.30 0.00 0.48 0.00 0.00 55.95 56.25 1h0h s SER 825 Cb 0.09 0.40 1.46 0.00 0.10 0.00 0.00 66.02 68.06 1h0h s SER 825 CO 0.81 -0.77 1.98 0.29 0.98 0.00 0.00 173.24 176.53 1h0h n LYS 826 N -0.62 1.20 -3.02 4.02 5.02 -1.25 -4.68 118.16 118.83 1h0h n LYS 826 Ca -0.04 -0.41 -0.43 0.00 -2.02 0.00 0.00 58.31 55.40 1h0h n LYS 826 Cb 0.60 -1.49 -0.05 0.00 -0.02 0.00 0.00 35.03 34.07 1h0h n LYS 826 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1h0h s THR 827 N -2.08 4.66 0.01 -0.18 2.01 -1.21 -4.96 115.64 113.89 1h0h s THR 827 Ca 0.41 -0.16 -0.25 0.00 0.31 0.00 0.00 61.69 61.99 1h0h s THR 827 Cb 0.21 -4.41 -0.17 0.00 0.01 0.00 0.00 72.50 68.15 1h0h s THR 827 CO 0.38 -0.95 1.26 0.25 -0.69 0.00 0.00 174.62 174.86 1h0h h LEU 828 N 10.27 -0.36 -9.71 4.42 5.85 -1.94 -3.46 115.31 120.38 1h0h h LEU 828 Ca -0.27 -0.16 -0.55 0.00 0.84 0.00 0.00 57.88 57.73 1h0h h LEU 828 Cb 1.09 0.09 -0.09 0.00 0.37 0.00 0.00 40.66 42.12 1h0h h LEU 828 CO 1.02 -0.01 -0.58 -1.00 -0.34 0.00 0.00 178.44 177.53 1h0h s HIS 829 N -4.73 2.69 -0.06 1.25 3.76 -1.26 -1.11 115.29 115.82 1h0h s HIS 829 Ca -0.14 -0.34 -0.36 0.00 -0.15 0.00 0.00 55.06 54.07 1h0h s HIS 829 Cb 0.02 -1.48 -0.14 0.00 1.11 0.00 0.00 32.58 32.09 1h0h s HIS 829 CO 0.55 0.45 1.68 -1.71 -0.85 0.00 0.00 174.74 174.86 1h0h n ASN 830 N -1.05 2.75 0.13 1.40 2.85 -1.26 -4.82 115.26 115.25 1h0h n ASN 830 Ca -0.04 1.05 0.10 0.00 -0.11 0.00 0.00 54.58 55.58 1h0h n ASN 830 Cb 0.61 -1.28 0.48 0.00 1.24 0.00 0.00 39.78 40.83 1h0h n ASN 830 CO 0.00 0.00 0.00 -2.65 -2.11 0.00 0.00 177.26 172.50 1h0h n PRO 831 N 4.90 0.14 0.00 1.20 -0.02 -1.26 -1.79 135.00 138.17 1h0h n PRO 831 Ca 0.22 0.51 0.11 0.00 -2.02 0.00 0.00 63.50 62.32 1h0h n PRO 831 Cb 0.23 -1.86 0.00 0.00 -0.02 0.00 0.00 33.50 31.85 1h0h n PRO 831 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1h0h n THR 832 N -2.14 0.00 -2.46 3.45 -2.24 -1.26 -4.71 114.28 104.92 1h0h n THR 832 Ca 0.00 -0.08 -0.39 0.00 -2.27 0.00 0.00 64.05 61.31 1h0h n THR 832 Cb 0.12 0.92 -0.04 0.00 -2.10 0.00 0.00 70.33 69.23 1h0h n THR 832 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1h0h s ALA 833 N -2.82 3.30 -0.66 6.98 0.00 -0.74 -4.97 121.76 122.86 1h0h s ALA 833 Ca 0.13 0.87 0.06 0.00 0.00 0.00 0.00 51.96 53.01 1h0h s ALA 833 Cb 0.17 -3.32 0.07 0.00 0.00 0.00 0.00 23.12 20.04 1h0h s ALA 833 CO 0.74 -0.23 0.80 1.28 0.00 0.00 0.00 175.76 178.35 1h0h n LEU 834 N 0.75 1.74 -1.19 0.00 4.77 -1.26 -4.65 117.00 117.15 1h0h n LEU 834 Ca 0.01 -1.26 0.11 0.00 -0.03 0.00 0.00 56.01 54.84 1h0h n LEU 834 Cb 0.46 -0.03 0.26 0.00 -2.33 0.00 0.00 43.42 41.78 1h0h n LEU 834 CO 0.52 0.39 0.72 0.00 -1.33 0.00 0.00 177.39 177.69 1h0h n HIS 835 N 0.25 0.72 -3.64 -1.77 1.44 -1.26 -4.95 115.22 106.01 1h0h n HIS 835 Ca 0.04 -0.39 -0.34 0.00 -2.01 0.00 0.00 57.72 55.03 1h0h n HIS 835 Cb 0.19 -0.00 -0.05 0.00 0.12 0.00 0.00 29.99 30.25 1h0h n HIS 835 CO 0.00 0.00 0.00 -0.06 -2.81 0.00 0.00 176.34 173.47 1h0h s PHE 836 N -1.19 3.55 -0.65 -1.40 0.08 -1.26 -4.96 117.98 112.15 1h0h s PHE 836 Ca 0.42 0.68 -0.17 0.00 0.12 0.00 0.00 56.93 57.98 1h0h s PHE 836 Cb 0.23 -2.08 -0.14 0.00 -0.57 0.00 0.00 43.02 40.45 1h0h s PHE 836 CO 0.31 0.52 1.85 0.00 -0.10 0.00 0.00 175.22 177.80 1h0h n ALA 837 N 0.73 3.17 -0.65 5.36 0.00 -1.26 -4.82 120.51 123.05 1h0h n ALA 837 Ca -0.07 -2.60 0.00 0.00 0.00 0.00 0.00 53.44 50.77 1h0h n ALA 837 Cb 0.52 -3.38 0.00 0.00 0.00 0.00 0.00 19.45 16.59 1h0h n ALA 837 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1h0h n THR 838 N 5.56 0.00 0.71 0.00 -2.24 -1.26 -2.62 114.28 114.44 1h0h n THR 838 Ca 0.44 0.40 0.00 0.00 -2.27 0.00 0.00 64.05 62.62 1h0h n THR 838 Cb 0.30 -0.72 0.00 0.00 -2.10 0.00 0.00 70.33 67.80 1h0h n THR 838 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1h0h n GLU 839 N -0.19 0.71 0.00 -0.78 -0.58 -1.26 -4.71 120.64 113.83 1h0h n GLU 839 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 1h0h n GLU 839 Cb 0.00 -1.23 0.00 0.00 -0.57 0.00 0.00 31.44 29.64 1h0h n GLU 839 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 1h0h n GLU 840 N 0.45 1.01 -3.83 3.49 -0.58 -1.08 -5.16 120.64 114.94 1h0h n GLU 840 Ca 0.00 0.00 -0.12 0.00 -0.42 0.00 0.00 57.16 56.62 1h0h n GLU 840 Cb 0.29 0.00 -0.11 0.00 -0.57 0.00 0.00 31.44 31.04 1h0h n GLU 840 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 1h0h s LYS 841 N 4.46 0.33 0.01 3.49 -0.14 -1.26 -5.12 119.74 121.51 1h0h s LYS 841 Ca 0.00 0.01 -0.30 0.00 -1.36 0.00 0.00 55.97 54.32 1h0h s LYS 841 Cb 0.00 0.15 -0.06 0.00 -1.68 0.00 0.00 37.83 36.23 1h0h s LYS 841 CO 0.00 -0.06 1.56 0.00 -0.76 0.00 0.00 175.35 176.09 1h0h s ALA 842 N -0.48 3.63 -0.51 5.17 0.00 -1.26 -4.95 121.76 123.36 1h0h s ALA 842 Ca -0.06 1.01 -0.20 0.00 0.00 0.00 0.00 51.96 52.71 1h0h s ALA 842 Cb -0.04 -3.67 0.05 0.00 0.00 0.00 0.00 23.12 19.46 1h0h s ALA 842 CO 0.01 -1.11 0.68 0.14 0.00 0.00 0.00 175.76 175.48 1h0h s VAL 843 N 2.92 4.79 -0.51 0.00 -7.23 -1.26 -5.01 120.40 114.11 1h0h s VAL 843 Ca 0.70 -0.32 -0.15 0.00 -1.81 0.00 0.00 61.98 60.39 1h0h s VAL 843 Cb -0.35 -4.33 0.11 0.00 0.56 0.00 0.00 36.38 32.36 1h0h s VAL 843 CO 0.29 -0.85 0.44 0.00 -0.31 0.00 0.00 175.10 174.68 1h0h s ASP 845 N 3.11 6.50 0.27 0.00 -1.08 -1.26 -4.89 116.67 119.32 1h0h s ASP 845 Ca 0.04 2.57 0.23 0.00 -0.52 0.00 0.00 52.55 54.87 1h0h s ASP 845 Cb -0.27 -2.54 1.00 0.00 -1.46 0.00 0.00 42.92 39.65 1h0h s ASP 845 CO 0.04 -1.01 1.70 -0.81 0.52 0.00 0.00 175.17 175.61 1h0h n PRO 846 N 7.14 0.19 0.24 4.34 -0.04 -1.26 -2.05 135.00 143.56 1h0h n PRO 846 Ca 0.19 0.45 0.09 0.00 -0.04 0.00 0.00 63.50 64.19 1h0h n PRO 846 Cb 0.41 -1.88 0.59 0.00 -0.04 0.00 0.00 33.50 32.58 1h0h n PRO 846 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1h0h h ARG 847 N 0.00 0.00 -2.19 0.54 3.08 -1.98 -3.33 114.38 110.50 1h0h h ARG 847 Ca 0.00 0.00 -0.59 0.00 0.07 0.00 0.00 59.98 59.46 1h0h h ARG 847 Cb 0.32 0.00 -0.41 0.00 0.08 0.00 0.00 29.97 29.96 1h0h h ARG 847 CO 0.00 0.19 -0.77 0.66 -1.07 0.00 0.00 179.97 178.98 1h0h n TYR 848 N -3.82 2.19 0.21 3.04 4.01 -0.87 -4.22 117.16 117.71 1h0h n TYR 848 Ca -0.02 -3.95 0.11 0.00 -0.16 0.00 0.00 57.90 53.88 1h0h n TYR 848 Cb 0.29 -0.47 0.24 0.00 -0.31 0.00 0.00 39.34 39.09 1h0h n TYR 848 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 1h0h h PRO 849 N 4.24 0.00 -5.93 -0.72 0.14 -1.61 -3.35 132.00 124.77 1h0h h PRO 849 Ca 0.16 0.00 -0.62 0.00 0.14 0.00 0.00 66.00 65.68 1h0h h PRO 849 Cb 0.74 0.00 -0.04 0.00 0.14 0.00 0.00 31.00 31.84 1h0h h PRO 849 CO 0.69 0.11 -0.51 -0.06 0.14 0.00 0.00 178.00 178.37 1h0h s PHE 850 N -3.27 3.50 -0.12 1.56 0.08 -0.01 -4.79 117.98 114.93 1h0h s PHE 850 Ca 0.05 0.24 -0.22 0.00 0.12 0.00 0.00 56.93 57.12 1h0h s PHE 850 Cb 0.06 -1.75 -0.03 0.00 -0.57 0.00 0.00 43.02 40.73 1h0h s PHE 850 CO 0.66 0.59 0.64 0.42 -0.10 0.00 0.00 175.22 177.43 1h0h s ILE 851 N -1.50 5.06 -0.11 0.64 1.01 0.33 -0.97 121.20 125.66 1h0h s ILE 851 Ca 0.35 1.28 -0.02 0.00 0.00 0.00 0.00 60.65 62.26 1h0h s ILE 851 Cb -0.13 -3.97 -0.03 0.00 0.01 0.00 0.00 42.46 38.34 1h0h s ILE 851 CO 0.28 0.21 -0.03 0.00 0.00 0.00 0.00 174.94 175.40 1h0h s SER 853 N -0.40 3.50 0.08 0.00 0.15 0.04 -2.08 113.70 115.00 1h0h s SER 853 Ca 0.07 -0.75 0.09 0.00 0.70 0.00 0.00 55.95 56.05 1h0h s SER 853 Cb -0.12 -0.31 -0.04 0.00 -1.71 0.00 0.00 66.02 63.84 1h0h s SER 853 CO 0.02 0.16 -0.21 0.42 1.20 0.00 0.00 173.24 174.83 1h0h s THR 854 N -1.32 2.64 0.19 6.45 -4.23 -0.33 -1.24 115.64 117.80 1h0h s THR 854 Ca 0.18 -1.43 -0.11 0.00 -1.18 0.00 0.00 61.69 59.15 1h0h s THR 854 Cb -0.09 -2.15 0.04 0.00 1.34 0.00 0.00 72.50 71.64 1h0h s THR 854 CO 0.08 0.21 0.56 0.00 -0.54 0.00 0.00 174.62 174.93 1h0h n TYR 855 N 1.18 -1.52 -3.73 3.99 0.18 -0.92 -4.67 117.16 111.68 1h0h n TYR 855 Ca -0.16 -1.00 -0.21 0.00 1.88 0.00 0.00 57.90 58.40 1h0h n TYR 855 Cb 0.52 0.50 -0.04 0.00 -0.38 0.00 0.00 39.34 39.94 1h0h n TYR 855 CO 0.00 0.00 0.00 1.03 -2.08 0.00 0.00 176.86 175.81 1h0h s ARG 856 N -2.05 2.57 0.19 -3.48 0.52 -1.26 -3.62 118.95 111.83 1h0h s ARG 856 Ca 0.12 -1.47 0.08 0.00 -0.52 0.00 0.00 55.73 53.94 1h0h s ARG 856 Cb -0.03 -2.37 -0.04 0.00 0.52 0.00 0.00 34.95 33.03 1h0h s ARG 856 CO 0.06 -0.06 -0.17 0.14 0.02 0.00 0.00 175.30 175.30 1h0h s VAL 857 N -2.41 1.80 0.31 3.52 -7.23 -1.26 -5.01 120.40 110.12 1h0h s VAL 857 Ca 0.44 -2.06 0.04 0.00 -1.81 0.00 0.00 61.98 58.59 1h0h s VAL 857 Cb -0.04 -1.94 0.30 0.00 0.56 0.00 0.00 36.38 35.26 1h0h s VAL 857 CO 0.27 -0.44 1.86 0.74 -0.31 0.00 0.00 175.10 177.21 1h0h h THR 858 N 2.91 0.91 0.00 5.32 2.02 -1.95 -2.98 112.91 119.16 1h0h h THR 858 Ca -0.40 -0.31 0.00 0.00 0.77 0.00 0.00 66.41 66.47 1h0h h THR 858 Cb 1.22 -0.07 0.00 0.00 -1.74 0.00 0.00 68.15 67.55 1h0h h THR 858 CO 0.56 0.17 -0.16 -0.62 0.37 0.00 0.00 175.52 175.84 1h0h n GLU 859 N -4.58 0.25 -4.24 6.66 4.71 -1.26 -4.61 120.64 117.57 1h0h n GLU 859 Ca 0.18 0.17 -0.23 0.00 -0.01 0.00 0.00 57.16 57.26 1h0h n GLU 859 Cb 0.37 -1.75 -0.07 0.00 -1.01 0.00 0.00 31.44 28.97 1h0h n GLU 859 CO 0.00 0.00 0.00 -1.01 0.09 0.00 0.00 177.13 176.21 1h0h s HIS 860 N -3.11 2.67 -0.12 -0.32 3.76 -1.13 -4.78 115.29 112.26 1h0h s HIS 860 Ca 0.10 -0.32 -0.00 0.00 -0.15 0.00 0.00 55.06 54.68 1h0h s HIS 860 Cb 0.13 -1.40 0.03 0.00 1.11 0.00 0.00 32.58 32.44 1h0h s HIS 860 CO 0.62 0.50 -0.07 -0.46 -0.85 0.00 0.00 174.74 174.48 1h0h s TRP 861 N -2.40 1.48 0.00 1.40 -0.11 -1.26 -4.69 118.94 113.36 1h0h s TRP 861 Ca 0.34 -0.77 0.00 0.00 1.22 0.00 0.00 56.10 56.90 1h0h s TRP 861 Cb -0.04 -1.23 0.00 0.00 -1.50 0.00 0.00 33.47 30.70 1h0h s TRP 861 CO 0.21 -0.52 0.00 1.04 -4.62 0.00 0.00 176.95 173.05 1h0h n GLN 862 N 4.94 0.00 0.00 5.86 1.13 -1.26 -0.07 117.38 127.98 1h0h n GLN 862 Ca -0.12 0.00 0.09 0.00 -1.94 0.00 0.00 57.00 55.03 1h0h n GLN 862 Cb 0.50 0.00 0.53 0.00 0.11 0.00 0.00 30.24 31.38 1h0h n GLN 862 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 1h0h n THR 863 N 0.00 0.04 -0.87 5.09 -2.24 -1.26 -3.96 114.28 111.07 1h0h n THR 863 Ca 0.00 0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.79 1h0h n THR 863 Cb 0.00 -0.73 0.00 0.00 -2.10 0.00 0.00 70.33 67.50 1h0h n THR 863 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1h0h n GLY 864 N 0.14 1.19 0.26 3.38 0.00 0.89 -3.52 105.19 107.53 1h0h n GLY 864 Ca 0.13 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.12 1h0h n GLY 864 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1h0h h LEU 865 N 0.00 -0.71 -0.56 0.99 5.85 -1.82 0.67 115.31 119.72 1h0h h LEU 865 Ca 0.00 0.18 -0.09 0.00 0.84 0.00 0.00 57.88 58.82 1h0h h LEU 865 Cb 0.00 0.41 -0.02 0.00 0.37 0.00 0.00 40.66 41.42 1h0h h LEU 865 CO 0.00 -0.23 0.02 0.24 -0.34 0.00 0.00 178.44 178.12 1h0h h MET 866 N -0.08 0.98 0.00 1.25 2.86 -1.92 -2.99 114.93 115.04 1h0h h MET 866 Ca 0.25 -0.31 -0.27 0.00 -2.06 0.00 0.00 59.70 57.31 1h0h h MET 866 Cb 0.46 -0.09 -0.05 0.00 0.06 0.00 0.00 31.60 31.98 1h0h h MET 866 CO -0.59 0.98 -1.83 0.25 1.06 0.00 0.00 176.91 176.78 1h0h n THR 867 N -4.26 1.39 -0.21 2.22 -2.24 -0.96 -3.01 114.28 107.20 1h0h n THR 867 Ca 0.02 -0.78 0.01 0.00 -2.27 0.00 0.00 64.05 61.04 1h0h n THR 867 Cb 0.32 -0.78 0.26 0.00 -2.10 0.00 0.00 70.33 68.04 1h0h n THR 867 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 1h0h h ARG 868 N 0.00 0.96 -0.17 -0.78 3.08 0.22 -2.12 114.38 115.57 1h0h h ARG 868 Ca -0.31 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 59.68 1h0h h ARG 868 Cb 1.93 -0.22 0.00 0.00 0.08 0.00 0.00 29.97 31.76 1h0h h ARG 868 CO 0.06 0.64 0.00 0.09 -1.07 0.00 0.00 179.97 179.68 1h0h n ASN 869 N -4.43 0.96 -4.17 7.04 3.02 -1.13 -4.63 115.26 111.92 1h0h n ASN 869 Ca 0.08 -1.95 -0.36 0.00 -0.03 0.00 0.00 54.58 52.32 1h0h n ASN 869 Cb 0.05 -0.11 -0.12 0.00 -0.61 0.00 0.00 39.78 38.98 1h0h n ASN 869 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1h0h s THR 870 N -1.77 3.30 0.28 3.41 2.01 -0.80 -4.92 115.64 117.15 1h0h s THR 870 Ca 0.14 -1.68 0.01 0.00 0.31 0.00 0.00 61.69 60.48 1h0h s THR 870 Cb 0.07 -3.08 0.26 0.00 0.01 0.00 0.00 72.50 69.76 1h0h s THR 870 CO 0.10 -0.42 1.76 -0.65 -0.69 0.00 0.00 174.62 174.72 1h0h h PRO 871 N 8.07 0.61 0.00 4.92 0.11 -1.82 -1.20 132.00 142.70 1h0h h PRO 871 Ca -0.17 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 65.86 1h0h h PRO 871 Cb 1.06 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 32.03 1h0h h PRO 871 CO 0.63 0.40 -0.16 -1.49 -0.21 0.00 0.00 178.00 177.18 1h0h h TRP 872 N 0.63 0.00 0.08 0.65 6.55 -1.95 0.64 115.95 122.56 1h0h h TRP 872 Ca 0.50 0.00 -0.24 0.00 0.95 0.00 0.00 58.89 60.10 1h0h h TRP 872 Cb 0.76 0.00 -0.01 0.00 -0.86 0.00 0.00 29.16 29.05 1h0h h TRP 872 CO -0.08 0.16 -1.26 -0.07 -1.05 0.00 0.00 178.44 176.15 1h0h h LEU 873 N 0.00 0.28 -1.08 -4.49 3.38 -1.50 -3.25 115.31 108.65 1h0h h LEU 873 Ca -0.00 -0.81 0.08 0.00 0.09 0.00 0.00 57.88 57.23 1h0h h LEU 873 Cb 0.33 -0.09 -0.07 0.00 0.09 0.00 0.00 40.66 40.92 1h0h h LEU 873 CO 0.02 1.54 0.62 0.25 0.09 0.00 0.00 178.44 180.96 1h0h h LEU 874 N -0.48 0.95 -0.76 1.67 5.85 -1.25 -1.56 115.31 119.73 1h0h h LEU 874 Ca -0.28 0.01 0.14 0.00 0.84 0.00 0.00 57.88 58.59 1h0h h LEU 874 Cb 1.61 -0.19 -0.09 0.00 0.37 0.00 0.00 40.66 42.36 1h0h h LEU 874 CO 0.01 0.59 0.32 -0.08 -0.34 0.00 0.00 178.44 178.94 1h0h h GLU 875 N 1.07 0.46 -0.05 1.25 4.81 -0.94 -0.92 114.58 120.26 1h0h h GLU 875 Ca 0.42 -0.03 -0.14 0.00 -0.13 0.00 0.00 59.36 59.49 1h0h h GLU 875 Cb 0.25 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.51 1h0h h GLU 875 CO -0.18 0.31 -0.59 0.00 -0.73 0.00 0.00 179.01 177.82 1h0h h ALA 876 N 1.53 0.91 -2.07 2.92 0.00 -1.34 -3.38 119.26 117.82 1h0h h ALA 876 Ca 0.41 -0.54 -0.53 0.00 0.00 0.00 0.00 54.91 54.26 1h0h h ALA 876 Cb 0.60 -0.09 -0.35 0.00 0.00 0.00 0.00 17.79 17.95 1h0h h ALA 876 CO -0.38 0.73 -0.94 0.39 0.00 0.00 0.00 179.25 179.05 1h0h n GLU 877 N -3.87 0.34 0.18 0.00 -0.58 -0.84 -5.01 120.64 110.86 1h0h n GLU 877 Ca -0.02 -3.01 0.12 0.00 -0.42 0.00 0.00 57.16 53.83 1h0h n GLU 877 Cb 0.61 -1.56 0.24 0.00 -0.57 0.00 0.00 31.44 30.16 1h0h n GLU 877 CO 0.00 0.00 0.00 -1.00 -0.48 0.00 0.00 177.13 175.65 1h0h h PRO 878 N 5.21 0.00 -3.68 3.49 0.13 -1.38 -3.42 132.00 132.34 1h0h h PRO 878 Ca 0.20 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 65.22 1h0h h PRO 878 Cb 0.93 0.00 -0.17 0.00 0.13 0.00 0.00 31.00 31.89 1h0h h PRO 878 CO 0.35 0.00 -0.43 -0.65 -0.23 0.00 0.00 178.00 177.04 1h0h s GLN 879 N -3.18 0.69 0.29 0.86 -0.21 -1.26 -4.52 119.66 112.33 1h0h s GLN 879 Ca 0.08 -0.73 -0.29 0.00 0.02 0.00 0.00 55.36 54.44 1h0h s GLN 879 Cb 0.07 0.28 -0.13 0.00 1.00 0.00 0.00 33.01 34.23 1h0h s GLN 879 CO 0.65 -0.20 1.18 -1.33 -2.12 0.00 0.00 175.29 173.48 1h0h n MET 880 N 0.57 1.73 -4.29 2.91 2.81 0.12 -4.89 117.12 116.08 1h0h n MET 880 Ca -0.18 0.61 -0.15 0.00 -1.81 0.00 0.00 57.70 56.16 1h0h n MET 880 Cb 0.59 -2.11 -0.10 0.00 -0.71 0.00 0.00 33.22 30.89 1h0h n MET 880 CO 0.00 0.00 0.00 -0.59 1.51 0.00 0.00 175.97 176.89 1h0h s PHE 881 N -0.87 1.43 -0.13 2.03 -0.12 -1.26 -0.88 117.98 118.18 1h0h s PHE 881 Ca 0.60 -1.15 -0.02 0.00 -0.05 0.00 0.00 56.93 56.31 1h0h s PHE 881 Cb -0.65 -0.82 0.04 0.00 -0.63 0.00 0.00 43.02 40.96 1h0h s PHE 881 CO 0.59 -0.32 0.02 0.00 -0.05 0.00 0.00 175.22 175.46 1h0h s GLU 883 N 1.92 4.44 0.05 0.00 2.02 0.54 -0.18 118.70 127.49 1h0h s GLU 883 Ca 0.02 1.14 -0.08 0.00 0.02 0.00 0.00 54.97 56.07 1h0h s GLU 883 Cb -0.15 -3.49 -0.00 0.00 0.10 0.00 0.00 34.13 30.59 1h0h s GLU 883 CO -0.07 -0.11 0.17 0.00 0.02 0.00 0.00 175.26 175.27 1h0h s MET 884 N 1.32 0.71 0.86 1.61 0.23 -0.82 -1.50 119.30 121.72 1h0h s MET 884 Ca 0.43 -0.77 -0.12 0.00 -1.03 0.00 0.00 55.69 54.21 1h0h s MET 884 Cb -0.19 0.29 0.11 0.00 -1.53 0.00 0.00 34.83 33.51 1h0h s MET 884 CO 0.20 -0.20 1.10 -1.54 -2.03 0.00 0.00 175.02 172.54 1h0h s SER 885 N -2.34 3.87 0.17 -1.18 1.04 -1.26 -0.88 113.70 113.12 1h0h s SER 885 Ca -0.02 1.32 -0.10 0.00 0.48 0.00 0.00 55.95 57.63 1h0h s SER 885 Cb 0.01 -2.01 0.06 0.00 0.10 0.00 0.00 66.02 64.18 1h0h s SER 885 CO -0.06 -2.37 1.65 -0.33 0.98 0.00 0.00 173.24 173.11 1h0h h GLU 886 N -1.36 0.99 -0.09 4.02 5.08 -1.80 -1.94 114.58 119.49 1h0h h GLU 886 Ca -0.49 -0.28 0.04 0.00 -1.00 0.00 0.00 59.36 57.63 1h0h h GLU 886 Cb 1.29 -0.11 -0.06 0.00 0.50 0.00 0.00 28.75 30.37 1h0h h GLU 886 CO 0.58 0.95 -0.29 0.93 -1.00 0.00 0.00 179.01 180.18 1h0h h GLU 887 N 0.89 -0.37 -0.56 2.33 3.07 -1.92 0.27 114.58 118.29 1h0h h GLU 887 Ca 0.18 0.03 -0.01 0.00 -0.50 0.00 0.00 59.36 59.05 1h0h h GLU 887 Cb 0.46 0.08 -0.03 0.00 -0.84 0.00 0.00 28.75 28.42 1h0h h GLU 887 CO 0.02 -0.25 0.31 1.25 -1.40 0.00 0.00 179.01 178.94 1h0h h LEU 888 N -0.38 0.70 -0.36 1.33 5.85 -1.90 0.12 115.31 120.67 1h0h h LEU 888 Ca 0.09 -0.09 0.03 0.00 0.84 0.00 0.00 57.88 58.75 1h0h h LEU 888 Cb 0.51 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.33 1h0h h LEU 888 CO -0.30 0.59 0.16 0.00 -0.34 0.00 0.00 178.44 178.54 1h0h h ALA 889 N 1.14 0.44 0.04 1.25 0.00 -0.96 0.78 119.26 121.95 1h0h h ALA 889 Ca 0.20 0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.15 1h0h h ALA 889 Cb 0.04 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1h0h h ALA 889 CO -0.03 -0.22 -0.14 1.15 0.00 0.00 0.00 179.25 180.00 1h0h h THR 890 N 0.33 0.66 -0.94 0.00 2.02 0.01 0.63 112.91 115.62 1h0h h THR 890 Ca 0.16 0.00 0.14 0.00 0.77 0.00 0.00 66.41 67.48 1h0h h THR 890 Cb 0.10 0.66 -0.08 0.00 -1.74 0.00 0.00 68.15 67.09 1h0h h THR 890 CO -0.14 0.00 0.60 0.25 0.37 0.00 0.00 175.52 176.60 1h0h h LEU 891 N -0.26 0.75 -0.38 2.58 5.85 -0.08 -2.58 115.31 121.19 1h0h h LEU 891 Ca 0.04 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.80 1h0h h LEU 891 Cb 0.30 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.23 1h0h h LEU 891 CO -0.11 0.37 -0.51 0.54 -0.34 0.00 0.00 178.44 178.39 1h0h n ARG 892 N -4.60 0.53 -2.16 1.25 5.12 0.20 -4.95 116.66 112.06 1h0h n ARG 892 Ca 0.19 -0.38 -0.01 0.00 -1.93 0.00 0.00 57.85 55.72 1h0h n ARG 892 Cb 0.45 -1.49 0.00 0.00 -1.16 0.00 0.00 32.46 30.26 1h0h n ARG 892 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1h0h n GLY 893 N 1.43 0.50 3.61 -0.13 0.00 0.05 -4.63 105.19 106.02 1h0h n GLY 893 Ca 0.08 -0.80 -0.34 0.00 0.00 0.00 0.00 46.02 44.96 1h0h n GLY 893 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1h0h s ILE 894 N -2.31 4.62 0.21 -0.61 1.01 -0.25 -4.93 121.20 118.95 1h0h s ILE 894 Ca 0.01 -0.09 0.05 0.00 0.00 0.00 0.00 60.65 60.61 1h0h s ILE 894 Cb -0.00 -3.07 -0.03 0.00 0.01 0.00 0.00 42.46 39.36 1h0h s ILE 894 CO 0.01 0.47 0.28 -0.54 0.00 0.00 0.00 174.94 175.16 1h0h s LYS 895 N 0.31 3.28 0.26 2.79 1.02 -1.26 -4.55 119.74 121.58 1h0h s LYS 895 Ca 0.02 -0.79 -0.31 0.00 0.02 0.00 0.00 55.97 54.91 1h0h s LYS 895 Cb -0.13 -2.82 -0.12 0.00 -0.52 0.00 0.00 37.83 34.25 1h0h s LYS 895 CO 0.01 0.45 1.66 1.21 -0.92 0.00 0.00 175.35 177.75 1h0h s ASN 896 N -3.67 6.36 0.00 2.83 2.47 -1.26 -1.54 114.94 120.13 1h0h s ASN 896 Ca 0.34 2.93 0.00 0.00 0.42 0.00 0.00 52.86 56.54 1h0h s ASN 896 Cb -0.09 -2.62 0.00 0.00 -1.45 0.00 0.00 41.25 37.09 1h0h s ASN 896 CO 0.27 -0.95 0.00 0.61 -3.72 0.00 0.00 177.10 173.32 1h0h n GLY 897 N 2.93 1.50 3.76 1.21 0.00 -0.26 -4.99 105.19 109.35 1h0h n GLY 897 Ca 0.11 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.74 1h0h n GLY 897 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1h0h s ASP 898 N -3.21 5.95 0.17 1.61 1.01 -0.59 -4.43 116.67 117.18 1h0h s ASP 898 Ca 0.00 2.76 -0.31 0.00 0.71 0.00 0.00 52.55 55.71 1h0h s ASP 898 Cb 0.00 -2.64 -0.09 0.00 1.01 0.00 0.00 42.92 41.20 1h0h s ASP 898 CO 0.00 -1.11 1.36 -0.75 0.21 0.00 0.00 175.17 174.88 1h0h s LYS 899 N -2.47 4.34 0.18 8.23 2.20 -1.26 -0.33 119.74 130.64 1h0h s LYS 899 Ca 0.61 2.10 0.07 0.00 -0.36 0.00 0.00 55.97 58.39 1h0h s LYS 899 Cb -0.40 -3.20 -0.05 0.00 -1.51 0.00 0.00 37.83 32.67 1h0h s LYS 899 CO 0.51 -0.35 -0.13 0.14 -0.36 0.00 0.00 175.35 175.15 1h0h s VAL 900 N 0.52 1.56 -0.16 4.02 -7.23 0.58 -1.37 120.40 118.32 1h0h s VAL 900 Ca 0.60 -2.12 -0.02 0.00 -1.81 0.00 0.00 61.98 58.63 1h0h s VAL 900 Cb -0.37 -1.94 -0.02 0.00 0.56 0.00 0.00 36.38 34.61 1h0h s VAL 900 CO 0.35 -0.61 -0.08 -0.63 -0.31 0.00 0.00 175.10 173.83 1h0h s ILE 901 N -2.95 3.42 -0.07 -0.62 -1.09 0.21 -1.51 121.20 118.59 1h0h s ILE 901 Ca 0.19 -0.52 -0.02 0.00 -2.23 0.00 0.00 60.65 58.08 1h0h s ILE 901 Cb -0.00 -2.49 -0.04 0.00 -1.58 0.00 0.00 42.46 38.35 1h0h s ILE 901 CO 0.05 0.49 0.05 -0.76 -1.23 0.00 0.00 174.94 173.53 1h0h s LEU 902 N 0.60 3.80 -0.01 2.97 1.02 -0.19 -0.97 118.68 125.89 1h0h s LEU 902 Ca -0.05 0.19 -0.01 0.00 0.02 0.00 0.00 54.13 54.28 1h0h s LEU 902 Cb -0.15 -1.99 0.00 0.00 0.02 0.00 0.00 46.19 44.08 1h0h s LEU 902 CO 0.03 0.35 0.04 -1.61 0.02 0.00 0.00 176.35 175.17 1h0h s GLU 903 N -1.16 0.05 0.42 1.70 2.02 -0.95 -1.32 118.70 119.46 1h0h s GLU 903 Ca 0.16 0.04 0.04 0.00 0.02 0.00 0.00 54.97 55.23 1h0h s GLU 903 Cb -0.12 0.02 -0.02 0.00 0.10 0.00 0.00 34.13 34.12 1h0h s GLU 903 CO 0.06 -0.01 0.14 -1.54 0.02 0.00 0.00 175.26 173.93 1h0h s SER 904 N -0.00 2.89 0.60 -0.19 1.04 -0.28 -0.88 113.70 116.88 1h0h s SER 904 Ca -0.00 -1.71 0.35 0.00 0.48 0.00 0.00 55.95 55.07 1h0h s SER 904 Cb -0.00 0.56 1.93 0.00 0.10 0.00 0.00 66.02 68.61 1h0h s SER 904 CO 0.00 -0.96 2.24 -0.37 0.98 0.00 0.00 173.24 175.13 1h0h h VAL 905 N 1.74 0.31 0.00 5.02 -1.51 -1.86 -2.91 116.25 117.04 1h0h h VAL 905 Ca -0.35 -0.16 -0.15 0.00 -1.23 0.00 0.00 66.70 64.82 1h0h h VAL 905 Cb 1.28 1.11 -0.02 0.00 -2.13 0.00 0.00 31.29 31.53 1h0h h VAL 905 CO 0.56 0.03 -1.14 0.03 -1.23 0.00 0.00 177.57 175.81 1h0h h ARG 906 N 0.00 0.00 0.00 5.19 -0.00 -1.84 -3.50 114.38 114.23 1h0h h ARG 906 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.48 1h0h h ARG 906 Cb 0.11 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.08 1h0h h ARG 906 CO 0.00 0.35 0.00 0.41 0.00 0.00 0.00 179.97 180.74 1h0h n GLY 907 N 1.34 -1.29 3.25 0.04 0.00 -1.10 -4.85 105.19 102.58 1h0h n GLY 907 Ca -0.06 -0.92 -0.13 0.00 0.00 0.00 0.00 46.02 44.90 1h0h n GLY 907 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1h0h s LYS 908 N -0.59 0.67 0.11 1.61 -2.85 -1.26 -1.13 119.74 116.30 1h0h s LYS 908 Ca 0.00 -0.14 -0.12 0.00 -1.00 0.00 0.00 55.97 54.70 1h0h s LYS 908 Cb 0.00 0.30 0.02 0.00 -2.06 0.00 0.00 37.83 36.09 1h0h s LYS 908 CO 0.00 -0.18 0.30 -0.48 0.10 0.00 0.00 175.35 175.09 1h0h s LEU 909 N -1.24 0.90 0.18 2.77 0.05 -0.43 -4.99 118.68 115.92 1h0h s LEU 909 Ca -0.13 -0.47 0.04 0.00 0.05 0.00 0.00 54.13 53.62 1h0h s LEU 909 Cb -0.05 1.45 -0.03 0.00 -2.05 0.00 0.00 46.19 45.50 1h0h s LEU 909 CO 0.04 -0.79 0.26 -1.66 -0.55 0.00 0.00 176.35 173.66 1h0h s TRP 910 N -3.80 3.37 0.19 3.48 1.48 -1.26 -1.03 118.94 121.38 1h0h s TRP 910 Ca 0.04 0.04 -0.17 0.00 -1.06 0.00 0.00 56.10 54.94 1h0h s TRP 910 Cb 0.03 -1.59 0.03 0.00 -1.16 0.00 0.00 33.47 30.78 1h0h s TRP 910 CO -0.11 0.50 0.52 0.00 -4.06 0.00 0.00 176.95 173.79 1h0h s ALA 911 N -1.84 -0.94 -0.17 2.67 0.00 -0.57 -4.75 121.76 116.17 1h0h s ALA 911 Ca 0.34 -0.20 -0.14 0.00 0.00 0.00 0.00 51.96 51.95 1h0h s ALA 911 Cb -0.10 0.85 -0.05 0.00 0.00 0.00 0.00 23.12 23.82 1h0h s ALA 911 CO 0.27 -0.80 0.32 0.15 0.00 0.00 0.00 175.76 175.70 1h0h s LYS 912 N -3.87 4.25 0.13 0.00 -0.14 -0.06 -0.31 119.74 119.74 1h0h s LYS 912 Ca 0.09 0.12 -0.31 0.00 -1.36 0.00 0.00 55.97 54.51 1h0h s LYS 912 Cb -0.01 -3.45 -0.07 0.00 -1.68 0.00 0.00 37.83 32.62 1h0h s LYS 912 CO -0.03 0.18 1.29 0.00 -0.76 0.00 0.00 175.35 176.02 1h0h s ALA 913 N 0.64 3.49 -0.46 5.17 0.00 0.55 -0.44 121.76 130.71 1h0h s ALA 913 Ca 0.17 1.01 -0.02 0.00 0.00 0.00 0.00 51.96 53.12 1h0h s ALA 913 Cb -0.13 -3.48 0.12 0.00 0.00 0.00 0.00 23.12 19.63 1h0h s ALA 913 CO 0.05 -0.51 0.25 0.42 0.00 0.00 0.00 175.76 175.98 1h0h s ILE 914 N 0.71 3.27 -0.03 0.00 1.01 0.75 -1.10 121.20 125.82 1h0h s ILE 914 Ca 0.59 -2.38 -0.30 0.00 0.00 0.00 0.00 60.65 58.56 1h0h s ILE 914 Cb -0.34 -3.23 -0.04 0.00 0.01 0.00 0.00 42.46 38.86 1h0h s ILE 914 CO 0.32 -0.74 1.25 -0.63 0.00 0.00 0.00 174.94 175.15 1h0h s ILE 915 N 0.74 4.09 -0.01 2.92 1.01 -1.26 -1.94 121.20 126.75 1h0h s ILE 915 Ca 0.11 1.44 -0.02 0.00 0.00 0.00 0.00 60.65 62.18 1h0h s ILE 915 Cb -0.22 -3.93 -0.00 0.00 0.01 0.00 0.00 42.46 38.32 1h0h s ILE 915 CO -0.04 0.01 0.04 0.28 0.00 0.00 0.00 174.94 175.23 1h0h s THR 916 N 2.11 0.04 -1.58 2.92 -1.32 -0.06 -4.94 115.64 112.81 1h0h s THR 916 Ca 0.58 -0.34 0.30 0.00 -1.21 0.00 0.00 61.69 61.02 1h0h s THR 916 Cb -0.27 -0.18 0.61 0.00 -1.51 0.00 0.00 72.50 71.15 1h0h s THR 916 CO 0.24 -0.19 2.07 0.29 -2.21 0.00 0.00 174.62 174.82 1h0h n LYS 917 N 2.44 0.57 0.03 7.08 5.02 -1.26 -3.57 118.16 128.46 1h0h n LYS 917 Ca -0.17 0.01 0.12 0.00 -2.02 0.00 0.00 58.31 56.25 1h0h n LYS 917 Cb 0.58 -1.50 0.49 0.00 -0.02 0.00 0.00 35.03 34.58 1h0h n LYS 917 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1h0h n ARG 918 N -1.21 0.07 -5.08 1.97 1.74 -1.26 -4.64 116.66 108.25 1h0h n ARG 918 Ca 0.16 0.14 -0.28 0.00 -0.77 0.00 0.00 57.85 57.10 1h0h n ARG 918 Cb 0.20 -1.60 -0.16 0.00 -1.02 0.00 0.00 32.46 29.88 1h0h n ARG 918 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1h0h s ILE 919 N -3.05 1.74 0.09 0.55 1.01 -1.23 -1.35 121.20 118.95 1h0h s ILE 919 Ca 0.11 -0.92 0.04 0.00 0.00 0.00 0.00 60.65 59.87 1h0h s ILE 919 Cb 0.15 -1.46 -0.03 0.00 0.01 0.00 0.00 42.46 41.12 1h0h s ILE 919 CO 0.47 0.49 -0.10 -0.54 0.00 0.00 0.00 174.94 175.26 1h0h s LYS 920 N -0.34 0.82 0.79 2.79 1.02 -1.26 -4.28 119.74 119.27 1h0h s LYS 920 Ca 0.04 -1.11 -0.14 0.00 0.02 0.00 0.00 55.97 54.78 1h0h s LYS 920 Cb -0.10 -0.53 0.07 0.00 -0.52 0.00 0.00 37.83 36.75 1h0h s LYS 920 CO 0.01 0.09 1.21 -2.14 -0.92 0.00 0.00 175.35 173.59 1h0h s PRO 921 N -2.61 1.75 -0.16 -1.68 0.02 -1.26 -4.82 135.00 126.25 1h0h s PRO 921 Ca 0.04 1.77 -0.05 0.00 0.02 0.00 0.00 61.00 62.78 1h0h s PRO 921 Cb -0.04 -1.79 -0.03 0.00 0.02 0.00 0.00 34.50 32.66 1h0h s PRO 921 CO 0.00 -2.13 0.01 -0.06 -0.33 0.00 0.00 177.00 174.49 1h0h s PHE 922 N -2.08 3.13 -0.35 6.54 0.08 0.13 -4.92 117.98 120.51 1h0h s PHE 922 Ca 0.74 -0.11 -0.17 0.00 0.12 0.00 0.00 56.93 57.51 1h0h s PHE 922 Cb -0.29 -2.00 -0.01 0.00 -0.57 0.00 0.00 43.02 40.15 1h0h s PHE 922 CO 0.49 0.07 0.44 0.00 -0.10 0.00 0.00 175.22 176.13 1h0h s ALA 923 N 0.30 3.49 -0.11 5.36 0.00 -1.26 -0.16 121.76 129.39 1h0h s ALA 923 Ca -0.00 -1.11 -0.02 0.00 0.00 0.00 0.00 51.96 50.83 1h0h s ALA 923 Cb -0.13 -2.92 0.04 0.00 0.00 0.00 0.00 23.12 20.10 1h0h s ALA 923 CO 0.02 -1.14 0.01 0.42 0.00 0.00 0.00 175.76 175.06 1h0h s ILE 924 N 2.21 0.44 -1.20 0.00 -1.09 -0.13 -4.69 121.20 116.74 1h0h s ILE 924 Ca 0.15 -0.07 -0.21 0.00 -2.23 0.00 0.00 60.65 58.29 1h0h s ILE 924 Cb -0.16 -0.68 0.00 0.00 -1.58 0.00 0.00 42.46 40.04 1h0h s ILE 924 CO 0.12 0.14 0.70 0.00 -1.23 0.00 0.00 174.94 174.68 1h0h n GLN 925 N 5.12 -1.29 -3.55 2.79 6.02 -1.26 -1.40 117.38 123.80 1h0h n GLN 925 Ca -0.08 0.36 -0.25 0.00 -0.01 0.00 0.00 57.00 57.02 1h0h n GLN 925 Cb 0.49 -3.81 0.05 0.00 1.02 0.00 0.00 30.24 28.00 1h0h n GLN 925 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1h0h n GLY 926 N -1.83 -0.53 3.02 1.08 0.00 -1.26 -4.97 105.19 100.69 1h0h n GLY 926 Ca -0.13 0.21 -0.13 0.00 0.00 0.00 0.00 46.02 45.97 1h0h n GLY 926 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1h0h s GLN 927 N -6.26 0.17 -0.31 1.61 0.74 -0.49 -5.12 119.66 109.98 1h0h s GLN 927 Ca 0.55 0.25 -0.16 0.00 0.05 0.00 0.00 55.36 56.05 1h0h s GLN 927 Cb -0.25 0.04 -0.02 0.00 1.10 0.00 0.00 33.01 33.87 1h0h s GLN 927 CO 0.67 -0.05 0.40 -0.65 -0.55 0.00 0.00 175.29 175.12 1h0h s GLN 928 N 0.31 3.77 -0.27 1.67 -1.52 -1.26 -0.95 119.66 121.40 1h0h s GLN 928 Ca -0.02 -0.16 -0.10 0.00 -1.95 0.00 0.00 55.36 53.14 1h0h s GLN 928 Cb -0.03 -3.74 -0.04 0.00 -0.22 0.00 0.00 33.01 28.98 1h0h s GLN 928 CO -0.01 -0.45 0.15 0.08 -0.25 0.00 0.00 175.29 174.81 1h0h s VAL 929 N 2.13 4.96 -0.22 1.09 1.01 0.78 -4.93 120.40 125.21 1h0h s VAL 929 Ca 0.15 0.05 -0.10 0.00 0.00 0.00 0.00 61.98 62.07 1h0h s VAL 929 Cb -0.16 -3.35 -0.05 0.00 0.00 0.00 0.00 36.38 32.82 1h0h s VAL 929 CO 0.11 0.28 0.15 -1.00 0.00 0.00 0.00 175.10 174.65 1h0h s HIS 930 N 1.69 3.35 -0.10 5.22 3.76 -1.26 -0.70 115.29 127.25 1h0h s HIS 930 Ca 0.07 0.28 0.03 0.00 -0.15 0.00 0.00 55.06 55.29 1h0h s HIS 930 Cb -0.16 -2.23 0.00 0.00 1.11 0.00 0.00 32.58 31.30 1h0h s HIS 930 CO 0.08 0.15 -0.22 1.41 -0.85 0.00 0.00 174.74 175.31 1h0h s MET 931 N 0.79 2.88 0.38 1.40 0.00 -1.26 -0.51 119.30 122.98 1h0h s MET 931 Ca 0.08 -0.82 0.08 0.00 0.00 0.00 0.00 55.69 55.03 1h0h s MET 931 Cb -0.13 -2.22 -0.05 0.00 0.00 0.00 0.00 34.83 32.44 1h0h s MET 931 CO 0.02 0.12 0.17 0.14 0.00 0.00 0.00 175.02 175.47 1h0h s VAL 932 N 0.48 2.62 0.02 10.11 -7.23 0.16 -4.69 120.40 121.87 1h0h s VAL 932 Ca -0.16 -1.68 0.02 0.00 -1.81 0.00 0.00 61.98 58.35 1h0h s VAL 932 Cb -0.17 -2.97 -0.02 0.00 0.56 0.00 0.00 36.38 33.78 1h0h s VAL 932 CO 0.06 -0.08 -0.07 -0.83 -0.31 0.00 0.00 175.10 173.87 1h0h s GLY 933 N -3.89 0.41 0.05 2.32 0.00 -0.56 -0.78 107.32 104.87 1h0h s GLY 933 Ca 0.40 -0.53 0.01 0.00 0.00 0.00 0.00 44.72 44.59 1h0h s GLY 933 CO 0.23 -0.54 -0.05 -0.26 0.00 0.00 0.00 173.10 172.47 1h0h s ILE 934 N -0.81 0.39 0.36 0.90 -4.36 -0.37 -0.34 121.20 116.96 1h0h s ILE 934 Ca -0.04 -1.37 -0.11 0.00 -0.26 0.00 0.00 60.65 58.86 1h0h s ILE 934 Cb -0.06 -0.94 -0.07 0.00 1.25 0.00 0.00 42.46 42.64 1h0h s ILE 934 CO 0.00 -0.65 0.73 -2.16 0.24 0.00 0.00 174.94 173.10 1h0h s PRO 935 N -2.53 3.83 -0.27 0.37 0.04 -1.26 -2.16 135.00 133.02 1h0h s PRO 935 Ca -0.03 0.47 0.12 0.00 0.04 0.00 0.00 61.00 61.59 1h0h s PRO 935 Cb -0.03 -2.44 0.56 0.00 0.04 0.00 0.00 34.50 32.64 1h0h s PRO 935 CO -0.03 0.06 1.54 -2.67 0.04 0.00 0.00 177.00 175.93 1h0h n TRP 936 N -0.94 1.40 0.27 0.56 4.27 -1.24 -4.47 117.44 117.29 1h0h n TRP 936 Ca 0.02 -1.29 0.07 0.00 -3.89 0.00 0.00 57.50 52.41 1h0h n TRP 936 Cb 0.54 -0.49 0.23 0.00 -1.36 0.00 0.00 31.31 30.22 1h0h n TRP 936 CO 0.00 0.00 0.00 0.72 -2.29 0.00 0.00 177.69 176.12 1h0h n HIS 937 N -0.76 0.85 -4.40 -2.67 8.25 -1.25 -4.39 115.22 110.85 1h0h n HIS 937 Ca 0.32 -0.36 -0.24 0.00 -0.26 0.00 0.00 57.72 57.17 1h0h n HIS 937 Cb 1.09 -0.11 -0.09 0.00 1.12 0.00 0.00 29.99 32.00 1h0h n HIS 937 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 1h0h s TYR 938 N -1.58 2.44 -0.07 4.41 1.51 -1.23 -3.55 117.35 119.27 1h0h s TYR 938 Ca 0.33 -0.29 -0.31 0.00 -1.01 0.00 0.00 57.07 55.79 1h0h s TYR 938 Cb 0.20 -1.10 0.08 0.00 -0.11 0.00 0.00 41.96 41.03 1h0h s TYR 938 CO 0.19 0.64 0.75 0.20 -1.11 0.00 0.00 175.55 176.22 1h0h s GLY 939 N -3.38 -0.51 0.65 0.71 0.00 -1.03 -2.17 107.32 101.59 1h0h s GLY 939 Ca 0.29 1.48 0.43 0.00 0.00 0.00 0.00 44.72 46.91 1h0h s GLY 939 CO 0.16 0.97 2.35 0.11 0.00 0.00 0.00 173.10 176.69 1h0h h TRP 940 N 2.90 0.00 0.00 1.90 5.08 -1.90 -3.07 115.95 120.87 1h0h h TRP 940 Ca -0.25 0.00 -0.08 0.00 1.08 0.00 0.00 58.89 59.64 1h0h h TRP 940 Cb 1.15 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 27.29 1h0h h TRP 940 CO 0.36 0.00 -0.36 0.66 -1.28 0.00 0.00 178.44 177.82 1h0h h SER 941 N 0.00 0.00 -2.80 0.11 4.64 -1.94 -3.46 113.55 110.09 1h0h h SER 941 Ca -0.00 0.00 0.13 0.00 -0.47 0.00 0.00 61.79 61.45 1h0h h SER 941 Cb 0.02 0.00 -0.29 0.00 -0.31 0.00 0.00 62.40 61.82 1h0h h SER 941 CO 0.00 0.36 0.69 0.12 -0.87 0.00 0.00 176.83 177.13 1h0h s PHE 942 N -3.62 -0.25 0.29 4.77 5.36 -1.16 -4.85 117.98 118.53 1h0h s PHE 942 Ca 0.00 0.58 -0.05 0.00 -0.96 0.00 0.00 56.93 56.50 1h0h s PHE 942 Cb 0.11 0.43 0.07 0.00 -0.34 0.00 0.00 43.02 43.29 1h0h s PHE 942 CO 0.68 -0.13 0.39 -0.35 -1.46 0.00 0.00 175.22 174.35 1h0h n PRO 943 N 1.68 -0.40 -0.05 10.12 -0.04 -1.26 -4.47 135.00 140.58 1h0h n PRO 943 Ca -0.10 -0.60 -0.02 0.00 -0.04 0.00 0.00 63.50 62.74 1h0h n PRO 943 Cb 0.57 -0.40 0.24 0.00 -0.04 0.00 0.00 33.50 33.87 1h0h n PRO 943 CO 0.00 0.00 0.00 1.57 -0.04 0.00 0.00 175.50 177.03 1h0h h LYS 944 N 0.00 0.63 -0.74 0.54 2.10 -1.89 -3.16 116.57 114.05 1h0h h LYS 944 Ca -0.13 -0.15 -0.49 0.00 -2.00 0.00 0.00 60.65 57.89 1h0h h LYS 944 Cb 0.35 -0.09 -0.42 0.00 -0.90 0.00 0.00 32.23 31.17 1h0h h LYS 944 CO 0.09 0.65 -0.88 -1.71 -2.00 0.00 0.00 179.45 175.60 1h0h n ASN 945 N -4.26 4.24 0.00 7.07 5.15 -1.26 -4.72 115.26 121.49 1h0h n ASN 945 Ca 0.02 -3.41 -0.06 0.00 -0.60 0.00 0.00 54.58 50.53 1h0h n ASN 945 Cb 0.26 -0.38 -0.12 0.00 -0.53 0.00 0.00 39.78 39.01 1h0h n ASN 945 CO 0.00 0.00 0.00 1.23 1.40 0.00 0.00 177.26 179.89 1h0h h GLY 946 N 2.30 0.00 0.00 8.20 0.00 -1.78 -3.46 103.07 108.33 1h0h h GLY 946 Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.59 1h0h h GLY 946 CO 0.65 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.80 1h0h n GLY 947 N 1.49 -0.97 1.00 4.60 0.00 -1.26 -0.70 105.19 109.35 1h0h n GLY 947 Ca -0.13 -2.21 -0.08 0.00 0.00 0.00 0.00 46.02 43.60 1h0h n GLY 947 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1h0h n ASP 948 N 0.00 1.87 -4.72 1.61 -0.08 -1.26 -2.48 116.55 111.49 1h0h n ASP 948 Ca 0.00 -1.63 -0.42 0.00 -1.51 0.00 0.00 54.79 51.24 1h0h n ASP 948 Cb 0.00 0.18 -0.03 0.00 2.34 0.00 0.00 41.12 43.61 1h0h n ASP 948 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1h0h s ALA 949 N -2.27 3.68 0.53 -1.67 0.00 -0.92 -4.27 121.76 116.83 1h0h s ALA 949 Ca 0.02 1.25 0.22 0.00 0.00 0.00 0.00 51.96 53.46 1h0h s ALA 949 Cb 0.00 -3.58 1.36 0.00 0.00 0.00 0.00 23.12 20.91 1h0h s ALA 949 CO 0.02 -0.70 2.05 0.00 0.00 0.00 0.00 175.76 177.13 1h0h h ALA 950 N 6.59 2.33 0.00 0.00 0.00 -1.80 -1.93 119.26 124.45 1h0h h ALA 950 Ca -0.43 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1h0h h ALA 950 Cb 1.21 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1h0h h ALA 950 CO 0.88 -0.44 0.00 0.09 0.00 0.00 0.00 179.25 179.77 1h0h n ASN 951 N -4.42 0.00 0.16 0.00 3.02 -1.26 -1.68 115.26 111.08 1h0h n ASN 951 Ca 0.06 -0.20 0.06 0.00 -0.03 0.00 0.00 54.58 54.47 1h0h n ASN 951 Cb 0.44 -0.15 0.55 0.00 -0.61 0.00 0.00 39.78 40.01 1h0h n ASN 951 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 1h0h h ILE 952 N 0.00 1.05 0.00 2.41 2.04 -1.69 0.33 117.51 121.65 1h0h h ILE 952 Ca 0.00 -0.11 0.00 0.00 1.00 0.00 0.00 64.86 65.75 1h0h h ILE 952 Cb 0.07 0.83 0.00 0.00 -0.74 0.00 0.00 36.82 36.98 1h0h h ILE 952 CO 0.00 0.05 -0.87 -0.07 0.00 0.00 0.00 178.15 177.26 1h0h h LEU 953 N 0.21 0.00-10.01 1.44 3.38 -1.55 -3.27 115.31 105.50 1h0h h LEU 953 Ca 0.06 -0.03 -0.49 0.00 0.09 0.00 0.00 57.88 57.51 1h0h h LEU 953 Cb -0.01 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 1h0h h LEU 953 CO -0.01 0.01 0.09 0.42 0.09 0.00 0.00 178.44 179.04 1h0h s THR 954 N -3.33 4.69 0.51 0.22 -4.23 -1.15 -4.54 115.64 107.81 1h0h s THR 954 Ca 0.01 0.93 -0.01 0.00 -1.18 0.00 0.00 61.69 61.43 1h0h s THR 954 Cb 0.10 -3.61 0.01 0.00 1.34 0.00 0.00 72.50 70.33 1h0h s THR 954 CO 0.77 -0.18 0.76 -2.16 -0.54 0.00 0.00 174.62 173.28 1h0h s PRO 955 N -2.96 2.90 0.82 3.99 0.04 -1.26 -1.63 135.00 136.89 1h0h s PRO 955 Ca 0.54 -0.41 -0.12 0.00 0.04 0.00 0.00 61.00 61.05 1h0h s PRO 955 Cb -0.10 -2.46 0.08 0.00 0.04 0.00 0.00 34.50 32.06 1h0h s PRO 955 CO 0.18 -0.50 1.14 -1.54 0.04 0.00 0.00 177.00 176.32 1h0h s SER 956 N -4.29 4.39 0.50 6.66 1.04 -1.26 -2.38 113.70 118.37 1h0h s SER 956 Ca 0.52 0.96 -0.21 0.00 0.48 0.00 0.00 55.95 57.69 1h0h s SER 956 Cb -0.10 -1.56 -0.07 0.00 0.10 0.00 0.00 66.02 64.40 1h0h s SER 956 CO 0.40 -1.99 1.16 0.68 0.98 0.00 0.00 173.24 174.46 1h0h s VAL 957 N -3.41 3.09 0.00 5.02 -7.23 0.71 -4.49 120.40 114.08 1h0h s VAL 957 Ca 0.62 0.75 0.00 0.00 -1.81 0.00 0.00 61.98 61.53 1h0h s VAL 957 Cb -0.12 -3.34 0.00 0.00 0.56 0.00 0.00 36.38 33.47 1h0h s VAL 957 CO 0.51 -0.08 0.00 0.61 -0.31 0.00 0.00 175.10 175.84 1h0h n GLY 958 N 0.33 2.09 0.14 2.32 0.00 -1.26 -4.04 105.19 104.78 1h0h n GLY 958 Ca 0.09 -0.36 -0.05 0.00 0.00 0.00 0.00 46.02 45.71 1h0h n GLY 958 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1h0h h ASN 959 N 5.67 0.15 -3.80 1.61 2.35 -1.92 -3.47 115.58 116.18 1h0h h ASN 959 Ca 0.00 -0.10 -0.48 0.00 -0.55 0.00 0.00 56.30 55.17 1h0h h ASN 959 Cb 0.00 -0.04 0.20 0.00 0.05 0.00 0.00 38.32 38.53 1h0h h ASN 959 CO 0.00 0.80 0.12 -2.84 -1.65 0.00 0.00 177.43 173.86 1h0h s PRO 960 N -3.51 0.10 -0.02 0.81 0.02 -1.26 -4.98 135.00 126.16 1h0h s PRO 960 Ca -0.02 1.22 0.16 0.00 0.02 0.00 0.00 61.00 62.38 1h0h s PRO 960 Cb 0.12 -1.64 -0.24 0.00 0.02 0.00 0.00 34.50 32.75 1h0h s PRO 960 CO 0.79 -3.15 0.42 0.09 -0.33 0.00 0.00 177.00 174.82 1h0h n ASN 961 N -4.56 1.14 -2.85 2.53 3.02 -1.26 -4.35 115.26 108.93 1h0h n ASN 961 Ca 0.08 -0.16 -0.14 0.00 -0.03 0.00 0.00 54.58 54.33 1h0h n ASN 961 Cb 0.53 1.61 -0.04 0.00 -0.61 0.00 0.00 39.78 41.28 1h0h n ASN 961 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1h0h n THR 962 N -1.94 0.00 0.00 3.41 -2.24 -1.26 -4.26 114.28 107.98 1h0h n THR 962 Ca -0.02 -1.22 0.00 0.00 -2.27 0.00 0.00 64.05 60.54 1h0h n THR 962 Cb 0.40 0.40 0.00 0.00 -2.10 0.00 0.00 70.33 69.02 1h0h n THR 962 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1h0h n GLY 963 N 0.99 0.74 3.66 3.38 0.00 -1.25 -4.66 105.19 108.05 1h0h n GLY 963 Ca -0.05 -1.17 -0.43 0.00 0.00 0.00 0.00 46.02 44.38 1h0h n GLY 963 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1h0h s ILE 964 N 0.00 4.75 0.24 -0.61 1.01 -1.26 0.08 121.20 125.41 1h0h s ILE 964 Ca 0.00 1.90 -0.30 0.00 0.00 0.00 0.00 60.65 62.26 1h0h s ILE 964 Cb 0.00 -4.26 -0.09 0.00 0.01 0.00 0.00 42.46 38.13 1h0h s ILE 964 CO 0.00 -0.11 1.04 -2.16 0.00 0.00 0.00 174.94 173.71 1h0h s PRO 965 N 2.82 4.71 -0.85 2.79 0.05 -1.26 -0.21 135.00 143.05 1h0h s PRO 965 Ca 0.42 1.66 -0.21 0.00 0.05 0.00 0.00 61.00 62.92 1h0h s PRO 965 Cb -0.16 -3.25 0.09 0.00 0.05 0.00 0.00 34.50 31.24 1h0h s PRO 965 CO 0.09 0.29 1.15 -2.00 0.05 0.00 0.00 177.00 176.58 1h0h s GLU 966 N -1.08 3.42 0.15 4.56 2.12 -1.00 -4.63 118.70 122.24 1h0h s GLU 966 Ca 0.44 -1.27 0.23 0.00 0.36 0.00 0.00 54.97 54.73 1h0h s GLU 966 Cb -0.29 -4.74 -0.00 0.00 0.26 0.00 0.00 34.13 29.36 1h0h s GLU 966 CO 0.36 -1.89 1.00 0.25 -0.54 0.00 0.00 175.26 174.45 1h0h n THR 967 N 5.93 0.48 0.53 -1.70 -2.24 -1.26 -4.20 114.28 111.82 1h0h n THR 967 Ca 0.16 -0.48 0.11 0.00 -2.27 0.00 0.00 64.05 61.57 1h0h n THR 967 Cb 0.48 -0.22 0.06 0.00 -2.10 0.00 0.00 70.33 68.56 1h0h n THR 967 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1h0h n LYS 968 N -2.50 0.32 -3.61 -0.78 4.76 -1.26 -1.19 118.16 113.90 1h0h n LYS 968 Ca 0.00 0.03 -0.03 0.00 -2.87 0.00 0.00 58.31 55.44 1h0h n LYS 968 Cb 0.53 -1.63 -0.06 0.00 -1.84 0.00 0.00 35.03 32.03 1h0h n LYS 968 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1h0h s ALA 969 N -3.20 -2.14 0.11 7.82 0.00 -1.24 -4.24 121.76 118.86 1h0h s ALA 969 Ca 0.04 2.30 -0.25 0.00 0.00 0.00 0.00 51.96 54.05 1h0h s ALA 969 Cb 0.14 -1.68 0.08 0.00 0.00 0.00 0.00 23.12 21.66 1h0h s ALA 969 CO 0.78 -0.59 0.67 -0.59 0.00 0.00 0.00 175.76 176.02 1h0h s PHE 970 N 1.99 -0.51 0.01 0.00 -0.71 -0.88 -4.93 117.98 112.94 1h0h s PHE 970 Ca -0.08 0.35 -0.16 0.00 -1.04 0.00 0.00 56.93 56.00 1h0h s PHE 970 Cb -0.06 0.55 -0.06 0.00 -1.21 0.00 0.00 43.02 42.23 1h0h s PHE 970 CO -0.18 -0.77 0.46 -1.64 -1.34 0.00 0.00 175.22 171.74 1h0h s MET 971 N -3.46 4.04 0.24 1.99 -1.94 -1.26 -0.12 119.30 118.79 1h0h s MET 971 Ca 0.01 0.50 -0.08 0.00 -1.71 0.00 0.00 55.69 54.41 1h0h s MET 971 Cb -0.01 -3.25 -0.02 0.00 2.01 0.00 0.00 34.83 33.57 1h0h s MET 971 CO -0.11 0.62 0.37 0.14 -0.01 0.00 0.00 175.02 176.03 1h0h s VAL 972 N -0.90 0.00 0.18 -6.03 -7.23 -0.14 -4.59 120.40 101.69 1h0h s VAL 972 Ca 0.25 -1.61 0.07 0.00 -1.81 0.00 0.00 61.98 58.88 1h0h s VAL 972 Cb -0.17 -2.33 -0.04 0.00 0.56 0.00 0.00 36.38 34.40 1h0h s VAL 972 CO 0.14 0.00 0.04 0.21 -0.31 0.00 0.00 175.10 175.19 1h0h s ASN 973 N -3.08 4.98 -0.11 4.85 2.47 -0.05 -0.83 114.94 123.17 1h0h s ASN 973 Ca 0.28 -0.33 0.01 0.00 0.42 0.00 0.00 52.86 53.24 1h0h s ASN 973 Cb 0.02 -1.13 0.02 0.00 -1.45 0.00 0.00 41.25 38.70 1h0h s ASN 973 CO 0.11 0.08 -0.11 -0.69 -3.72 0.00 0.00 177.10 172.77 1h0h s VAL 974 N -1.77 1.20 -0.00 -5.21 1.01 -1.26 -2.23 120.40 112.14 1h0h s VAL 974 Ca 0.29 -0.43 0.01 0.00 0.00 0.00 0.00 61.98 61.84 1h0h s VAL 974 Cb -0.09 -1.16 -0.00 0.00 0.00 0.00 0.00 36.38 35.12 1h0h s VAL 974 CO 0.20 0.39 -0.02 -0.89 0.00 0.00 0.00 175.10 174.78 1h0h s THR 975 N 1.36 0.19 0.30 3.92 2.01 -0.14 -4.96 115.64 118.31 1h0h s THR 975 Ca -0.01 -0.13 -0.30 0.00 0.31 0.00 0.00 61.69 61.56 1h0h s THR 975 Cb -0.14 -0.17 -0.12 0.00 0.01 0.00 0.00 72.50 72.08 1h0h s THR 975 CO -0.05 0.04 1.55 1.17 -0.69 0.00 0.00 174.62 176.63 1h0h n LYS 976 N 2.97 2.58 0.00 4.92 4.81 -1.26 0.66 118.16 132.85 1h0h n LYS 976 Ca -0.13 0.92 0.14 0.00 -0.87 0.00 0.00 58.31 58.37 1h0h n LYS 976 Cb 0.59 -2.67 0.85 0.00 0.02 0.00 0.00 35.03 33.82 1h0h n LYS 976 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57